smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Oc1c(I)cc(I)cc1CNCCCN1CCC(O)CC1	48277699	GLQHGEJHDGGUAI-UHFFFAOYSA-N	516.161	2.538	10	40	KFCB	
O=C(NC[C@@H]1CCCO1)[C@@H](c1ccc(N2CCOCC2)cc1)N(Cc1ccco1)C(=O)Cn1nnc2ccccc21	100336664	FCLNGUQOXUOSQY-PWUYWRBVSA-N	558.639	2.926	10	40	KFCB	
CCOC(=O)COc1c(Br)cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1Br	103856218	UCXVDOOHCXBTKR-UHFFFAOYSA-N	520.199	2.752	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\[C@H]3C(=O)NC(=S)N(c4ccc(Cl)cc4)C3=O)C2=O)ccc1Br	408763317	SAAVWZUVECMGBY-HNRFISLBSA-N	561.801	2.984	10	40	KFCB	
COc1ccc(N2C(=O)/C(=C/c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C(=O)NC2=S)cc1	409377576	JBBUSRHIKFURCZ-LDADJPATSA-N	560.426	2.527	10	40	KFCB	
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CSC(=O)c1ccccc1)C[C@H]3O[C@H]1C[C@@H](N)[C@H](O)[C@@H](C)O1	150388715	JJXYGMBBVYMPBI-XUTQAFIISA-N	663.701	2.583	10	40	KFCB	
COc1cc(/C=C2\SC(=S)N(NC(=O)Cn3c(=O)sc4ccccc43)C2=O)cc(OC)c1O	32594797	GPQDRMQJKZUCOJ-SXGWCWSVSA-N	503.583	2.718	10	40	KFCB	
O=C1NC(=S)N(c2ccccc2)C(=O)/C1=C/c1ccc(OCC(=O)N2CCOCC2)c(Br)c1	409376581	ZSJAYKHCQPLTCD-SFQUDFHCSA-N	530.400	2.518	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4ccc(OC)cc4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19940449	MNTFFUJFVPWTIV-BVAGGSTKSA-N	531.617	2.622	10	40	KFCB	
NC(=O)C1CCN(C2=NC(=O)/C(=C\c3cn(-c4ccccc4)nc3-c3ccc(S(=O)(=O)N4CCOCC4)cc3)S2)CC1	97947174	FJEVJQNAOGURHS-XIEYBQDHSA-N	606.730	2.728	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc(OC)c(O)c(OC)c3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	408983967	LMQIMSRVKJSBEC-YJADQXIJSA-N	523.611	2.587	10	40	KFCB	
Cc1cc(C(=O)COC(=O)[C@H]2COc3ccccc3O2)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1	3365942	PHQXMMIGJUAPSB-AREMUKBSSA-N	540.594	2.681	10	40	KFCB	
Cc1cc(C)cc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]3CCCN43)C(=O)N=C2O)c1	97968166	OTFZEVXYQQWDNP-XOYGFPHKSA-N	555.591	2.736	10	40	KFCB	
CCn1c(=O)/c(=C2/Sc3ccc(OC)cc3N2C)s/c1=C1/C(=O)N(c2ccc(C(=O)O)cc2)N=C1C	33354227	HOOQVAKHGZXUSM-CBAIGBLSSA-N	522.608	2.518	10	40	KFCB	
COc1ccc(C(=O)Oc2ccc(/C=C3/C(=N)N4N=C(S(C)(=O)=O)SC4=NC3=O)cc2)cc1OC	41077841	MJZSDKHBROIVSR-IQGAPNPZSA-N	514.541	2.544	10	40	KFCB	
COc1cc(/C=C2/C(=O)NC(=O)N(c3ccc(I)cc3)C2=O)ccc1OC(C)=O	408537890	XYXBTZPFZDHRKS-DHDCSXOGSA-N	506.252	2.892	10	40	KFCB	
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1OC(=O)/C=C/c1ccc(O)c(O)c1	1857787973	OAFXTKGAKYAFSI-PTQGEPLWSA-N	678.599	2.705	10	40	KFCB	
C[C@H]1CCCCN1Cc1c(O)c(CN2CCCC[C@@H]2C)c2occ(-c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3)c(=O)c2c1O	79209910	VPHGNASNUHAYHV-XDJLFPQVSA-N	654.757	2.799	10	40	KFCB	biogenic
CN1C(=O)N(C)C(=O)C2(Cc3cc(/C=C4\C(=O)NC(=O)N(CCC5=CCCCC5)C4=O)ccc3N3CCC[C@H]32)C1=O	97968251	CVRDOBSCIWWNLL-HWYOBBEWSA-N	559.623	2.601	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4cc(C)ccc4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19826203	VGCIZXMTXLOGCZ-OZXSUGGESA-N	515.618	2.922	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4cccc(C)c4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19826428	IHDPARKNSIPZAR-BVAGGSTKSA-N	515.618	2.922	10	40	KFCB	
Cc1ccc(NC(=O)CN2C(=O)/C(=C3\SC(=S)N([C@@H]4CCS(=O)(=O)C4)C3=O)c3ccccc32)cc1	17337344	MFOXMUZWSUDBMW-MODMUFLJSA-N	527.649	2.739	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4cccc(C)c4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19826419	IHDPARKNSIPZAR-JYFHCDHNSA-N	515.618	2.922	10	40	KFCB	
COCCN1C(=O)/C(=C\c2ccc(CNC(=O)C(=O)Nc3cccc(Cl)c3)o2)C(C(=O)OC)=C1C	409185743	PIMDXEQFANBBRY-UNOMPAQXSA-N	501.923	2.507	10	40	KFCB	
O=C(CCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	16036781	WCAAKXYKKCDSNY-FXMMDWOBSA-N	509.609	2.814	10	40	KFCB	
CC(/C=C1\SC(=S)N([C@H]2CC(=O)N(CCC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2=O)C1=O)=C\c1ccccc1	101113448	LJRQXGPOXLAZHZ-OSTYBKSYSA-N	584.701	2.638	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	257346727	OPMJIWCAYZDKKJ-JSWGAGIDSA-N	586.040	2.624	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(I)c1OCC(=O)Nc1ccc(C)cc1	408915810	ZGUFNWVIYYASMR-OVCLIPMQSA-N	565.389	2.882	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(I)c(O)c([N+](=O)[O-])c3)C2=O)cc1	408741172	OGGXLIUDAYVZNJ-NTUHNPAUSA-N	523.239	2.970	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C(=O)O)cc3)C2=O)cc(I)c1OC	408945605	XAYYNPBDLVRIOB-NTUHNPAUSA-N	522.251	2.673	10	40	KFCB	
COc1cccc(OCCOc2ccc(/C=C3/C(=N)N4N=C(S(C)(=O)=O)SC4=NC3=O)cc2)c1	41077756	DOXKCODXVHRHJA-BIWIXZEJSA-N	500.558	2.774	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(I)c1O	408935652	IIQAWSOBWIQGDC-NTUHNPAUSA-N	523.239	2.970	10	40	KFCB	
CCOC(=O)N1CCN(c2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(CCCOC)C2=O)CC1	100863826	IUIKQQOZVRQQJA-SDXDJHTJSA-N	531.660	2.519	10	40	KFCB	
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](N)[C@@H](O)[C@@H](C)O2)C1)C(=O)c1c(OCc2ccccc2)cccc1C3=O	104196913	SRILNPQAKDAONQ-SASNSFEESA-N	603.624	2.599	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccccc1C	409252169	CGCKXOOYCSQXEU-UHFFFAOYSA-N	565.389	2.930	10	40	KFCB	
Cc1ccc2nc(N3CCN(C)CC3)c(/C=C3\SC(=S)N(Cc4ccc5c(c4)OCO5)C3=O)c(=O)n2c1	100763827	DKMGQBMBGIZFCT-MTJSOVHGSA-N	535.651	2.885	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3cc4nc(O)[nH]c4cc3N3CCN(C)CC3)C2=O)ccc1Br	408526705	CEBGRUMVPSIZOU-NTCAYCPXSA-N	554.405	2.670	10	40	KFCB	
O=C(COc1c(Br)cc(Br)cc1C=C1C(=O)NC(=O)NC1=O)Nc1ccccc1	409251528	PJZGFPYZPICQBR-UHFFFAOYSA-N	523.137	2.979	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(O)c(OCC)c3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	1022630	VOKUJTAVKQZGLS-NLZIUFDSSA-N	507.612	2.969	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1F	409370129	LQMLVLDOEYHCHL-UHFFFAOYSA-N	506.284	2.754	10	40	KFCB	
O=C1/C(=C/c2c(N3CCOCC3)nc3ccccn3c2=O)SC(=S)N1Cc1ccc2c(c1)OCO2	2360010	VJBVXGQLPIVMHC-UNOMPAQXSA-N	508.581	2.661	10	40	KFCB	
CCc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NCCOC)c1ccc(N(C)C)cc1	6135415	HVENVBASDNJMQJ-QFIPXVFZSA-N	524.647	2.603	10	40	KFCB	
C[C@@H]1CN(c2cc3c(cc2[N+](=O)[O-])c(=O)c(C(=O)O)cn3C2CC2)CCN1/N=N/c1ccc(S(N)(=O)=O)cc1	100032712	YVHJBZKSISIGNR-OUDCYCMLSA-N	555.573	2.800	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCc1cccc([N+](=O)[O-])c1	408801487	AZHAJEQAYKKMNJ-UHFFFAOYSA-N	523.239	2.536	10	40	KFCB	
Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(/N=N\c3ccc(S(=O)(=O)Nc4ncccn4)cc3)c(O)c12	104342713	WYHGGBPOJRORSG-IZHYLOQSSA-N	580.582	2.627	10	40	KFCB	
N=C1/C(=C/c2ccc(OC(=O)c3cccs3)cc2)C(=O)N=C2SC(CC(=O)N3CCOCC3)=NN12	9291973	OUYINXSCHJWSGQ-YXBAXSDQSA-N	509.569	2.835	10	40	KFCB	
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCN=[N+]=[N-])C(C)(C)C)cc1	820924994	YVCURZJBLHZABY-ZRCGQRJVSA-N	557.677	2.554	10	40	KFCB	
CCOc1cc(/C=C2/C(=N)N3N=C(S(=O)(=O)CC)SC3=NC2=O)ccc1OS(=O)(=O)c1ccccc1	97964742	FBTHYZYQTWEOCD-OMLAYDHKSA-N	548.624	2.864	10	40	KFCB	
O=C(CN(c1ccc(F)cc1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCc1ccc(N2CCOCC2)cc1	100075097	WTJUYFHKUKQUDD-UHFFFAOYSA-N	541.601	2.945	10	40	KFCB	
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)OCC(=O)c3cc(C)n(-c4ccc5c(c4)OCO5)c3C)c2)CC1	103054964	CYQKDXYNYTXYIR-UHFFFAOYSA-N	567.620	2.715	10	40	KFCB	
CCOc1cc(/C=C2\SC(=S)N(C)C2=O)cc(I)c1OCC(=O)N1CCOCC1	409254038	CWPNITKRLRBSJD-GDNBJRDFSA-N	548.424	2.759	10	40	KFCB	
CCc1cccc2c(/C=C3\C(=O)N(CC)c4ccc(S(=O)(=O)N5CCOCC5)cc43)cn(CC(=O)N3CCOCC3)c12	8778074	NIVQHDPQMGOCIN-IMRQLAEWSA-N	592.718	2.991	10	40	KFCB	
Oc1c(I)cc(I)cc1CNC[C@@H](O)CN1CCCCC1	48277685	KEWDGKZLJQPOGB-CYBMUJFWSA-N	516.161	2.538	10	40	KFCB	
COc1ccc(N2CCN(C(=O)COc3coc(CN4CCc5cc(OC)c(OC)cc5C4)cc3=O)CC2)cc1	70666108	YYQCDBYLINBYFV-UHFFFAOYSA-N	549.624	2.952	10	40	KFCB	biogenic
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1cccc(C)c1C	409262935	GHIMBVHMTDCDOK-UHFFFAOYSA-N	549.321	2.684	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1F	409377015	FCJHXKJETJBYEG-UHFFFAOYSA-N	522.352	2.919	10	40	KFCB	
CCOC(=O)N1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N([C@H](C)CC)C2=O)CC1	1447004	YYVAYYNPFGYVLQ-ARSNJYAISA-N	501.634	2.973	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(NCCO)nc4ccccn4c3=O)SC2=S)cc1OC	8834860	VTDZBVKIRLUGFV-RGEXLXHISA-N	512.613	2.560	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4ccc(C)cc4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19940604	XQROCJMXCGCQBS-ZEQKJWHPSA-N	515.618	2.922	10	40	KFCB	
Cn1c(=O)n(C)c2cc(N/C=C3\C(=O)NC(=O)N(c4ccc(Br)cc4)C3=O)c(Br)cc21	408531997	LSJVIZAKWALOJF-FMIVXFBMSA-N	549.179	2.981	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C(=O)OC)cc3)C2=O)cc(Cl)c1OCC(=O)O	409045607	GPUVELIMPZCFMK-OVCLIPMQSA-N	502.863	2.655	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc(I)c1OCC(=O)OC	408954566	RMYUOUGFHWBXKJ-MKMNVTDBSA-N	594.314	2.637	10	40	KFCB	
Cc1nc2ccc(S(=O)(=O)O)cc2c(=O)n1-c1ccc(C(=O)NN2C(=O)CS[C@@H]2c2ccccc2O)cc1	1659421	VYAFCEHZCPOOEY-RUZDIDTESA-N	552.590	2.565	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NCc2ccccc2)N(Cc2cccnc2)C(=O)c2snc(C(N)=O)c2N)cc1	6135975	VONZUDNFGGOZDQ-XMMPIXPASA-N	543.653	2.985	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(C)cc1	409219468	MYIHODXATWLAIB-UHFFFAOYSA-N	504.362	2.698	10	40	KFCB	
COC(=O)c1ccc(N2CCN(C)CC2)c(NC(=O)/C=C/c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1	21595375	RINHYSWXJPCJOW-XBXARRHUSA-N	509.563	2.622	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(F)cc43)[C@@H]2C(=O)N1Cc1ccc(F)cc1	16020686	QSOUOPFFXZGRBD-YRCDICCDSA-N	505.477	2.539	10	40	KFCB	
O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C/c1ccc(OCC(=O)N2CCOCC2)cc1	409240034	PISLYVAHCXHNJM-GZTJUZNOSA-N	504.326	2.897	10	40	KFCB	
CCOc1ccccc1N1C(=O)/C(=C/c2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]2CCCN32)C(=O)N=C1O	97967840	IDSLIDSIAHXGRD-UWUFYVNFSA-N	571.590	2.518	10	40	KFCB	
CCOc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]3CCCN43)C(=O)N=C2O)cc1	97968055	HVEYVVJMWORFFO-QFVBLGFASA-N	571.590	2.518	10	40	KFCB	
COc1cc(N2C(=O)/C(=C\Nc3c(C)n(C)n(-c4ccccc4)c3=O)C(=O)N=C2S)cc(OC)c1OC	102590610	ZGTQNTKZQFBZKU-LGMDPLHJSA-N	523.571	2.665	10	40	KFCB	
Cn1c(=O)n(C)c2cc(N/C=C3\C(=O)NC(=O)N(c4ccccc4Cl)C3=O)c(Br)cc21	408532248	QBRYZCCSOLERQJ-MDZDMXLPSA-N	504.728	2.872	10	40	KFCB	
COC(=O)COc1c(I)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1I	409400507	SDBSUZWMVJETGW-QPEQYQDCSA-N	604.138	2.909	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2)cc1	6135880	DIYJAWIFXCMYIO-KNQAVFIVSA-N	522.631	2.574	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCc1cccc(F)c1	408887730	QRHOTVNEXMZFPG-UHFFFAOYSA-N	512.300	2.932	10	40	KFCB	
NC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1Br	409218475	FJHCLQUIXGOUTG-WUXMJOGZSA-N	523.137	2.742	10	40	KFCB	
CNc1c(I)cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1I	103855887	UCVUAYNFICOCCT-UHFFFAOYSA-N	541.152	2.536	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(c3ccccc3C)C2=O)cc(I)c1OCC(=O)O	408904196	GHDWKVNMZWQULT-NTUHNPAUSA-N	552.346	2.903	10	40	KFCB	
COc1ccc(N2CCN(CCNC(=O)CCc3nnc4n(Cc5ccccc5)c(=O)c5ccccc5n34)CC2)cc1	97986861	PWNCRVPFJFMOPQ-UHFFFAOYSA-N	565.678	2.972	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2)cc1	6135871	DIYJAWIFXCMYIO-UGKGYDQZSA-N	522.631	2.574	10	40	KFCB	
CC(C)S(=O)(=O)C1=NSC2=NC(=O)/C(=C\c3ccc(OS(=O)(=O)c4ccccc4)cc3)C(=N)N21	101396451	XDQWAIXJKLOFHB-SABKFZPKSA-N	518.598	2.854	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(Br)c1OCc1cccc(C(=O)O)c1	408910064	IYSWCGONLLPJFC-VGOFMYFVSA-N	505.346	2.991	10	40	KFCB	
CC(C)OC(=O)[C@@H](C(=O)C(F)(F)F)c1cc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)ccc1O	6023941	GCPJAOGXQAWWAA-GOSISDBHSA-N	529.493	2.550	10	40	KFCB	
C[C@H]1CCCN(Cc2c(O)c(CN3CCC[C@H](C)C3)c3occ(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)c(=O)c3c2O)C1	150344934	JWVPRIUMDUETIT-XDJLFPQVSA-N	654.757	2.514	10	40	KFCB	
CS(=O)(=O)N(CC(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(I)cc1	13673448	AKVSEKMIXFNSRF-UHFFFAOYSA-N	513.401	2.974	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	101572379	OPMJIWCAYZDKKJ-LSXFZMABSA-N	586.040	2.624	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(Br)c1OCc1ccc(C(=O)O)cc1	408912481	GTWWWRDJXCLRPH-VGOFMYFVSA-N	505.346	2.991	10	40	KFCB	
Cc1cc(C)cc(N2C(=O)/C(=C/c3cn(CC(=O)N4CCOCC4)c4ccccc34)C(=O)NC2=S)c1	408962496	SOVQCTFZADWFLM-HYARGMPZSA-N	502.596	2.948	10	40	KFCB	
Cc1cc([C@]2(c3cc(C)c(O)c(CN(CC(=O)O)CC(=O)O)c3)CS(=O)(=O)c3ccccc32)ccc1O	98210709	LKOLMEGIJIQMAG-MHZLTWQESA-N	525.579	2.808	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@@H](c1ccc(O)c(O)c1)[C@H](O)C2	5085287	XFZJEEAOWLFHDH-YGFVOSGVSA-N	578.526	2.995	10	40	KFCB	endogenous,in-man
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1ccccc1OC	140583521	PLDHDHLRMAHQGO-QXHVWWCLSA-N	519.623	2.644	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC2CCCC2)N(Cc2cccnc2)C(=O)c2snc(C(N)=O)c2N)cc1	6135830	BQKZRBFYGMWXSE-QFIPXVFZSA-N	521.647	2.728	10	40	KFCB	
CN(C)c1ccc(/C=c2/sc3n(c2=O)N[C@@]2(c4ccccc4)N(C)C(=O)N(C)[C@@]2(c2ccccc2)N=3)cc1	12416614	JETDYKDVQXDARZ-COWYGKLSSA-N	524.650	2.685	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C[C@@H]4CCCO4)C3=O)c(N3C[C@H](C)O[C@H](C)C3)nc12	27016515	PFMKXYKEVOBINJ-IXKBBHMXSA-N	500.646	2.997	10	40	KFCB	
CN1C(=O)N(C)C(=O)C2(Cc3cc(/C=C4\C(=O)N=C(O)N(c5ccc(Cl)cc5)C4=O)ccc3N3CCC[C@@H]32)C1=O	97968174	DRKBQPRJNFZVJT-UBXANZILSA-N	561.982	2.773	10	40	KFCB	
CCc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\Nc2cc3nc(O)[nH]c3cc2N2CCN(C)CC2)C1=O	408529155	HCOFRQDIBNOTGI-DTQAZKPQSA-N	568.432	2.924	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	70701376	RKVSPMXKWFVSSN-WAWVIVDZSA-N	541.560	2.599	10	40	KFCB	biogenic
COC(=O)C1=C(C(=O)OC)C2(O[C@@H]1c1ccc(I)cc1)C(=O)c1ccccc1C2=O	97951599	OOABMVHELSINOX-QGZVFWFLSA-N	518.259	2.823	10	40	KFCB	
Nc1nc(N)c(/N=N\c2ccc(S(=O)(=O)c3ccc(/N=N/c4c(N)nc(N)nc4O)cc3)cc2)c(O)n1	104090970	UNBYTCZXPDCWTG-SNQKRLHOSA-N	522.511	2.670	10	40	KFCB	
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1	6193899	NBLYXYAUWMFTQL-QFIPXVFZSA-N	524.647	2.658	10	40	KFCB	
CCOc1c(OC)cccc1[C@@H]1C(C(=O)OCCOC)=C(C)N=c2s/c(=C/c3ccc(N(C)C)c([N+](=O)[O-])c3)c(=O)n21	408974449	ZICAQBFEVMXJSN-OWXSRONMSA-N	596.662	2.806	10	40	KFCB	
CCOC(=O)COc1cc(Br)c(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1OC	408954539	RGYDQQBJFOHIOD-MKMNVTDBSA-N	547.314	2.795	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1ccccc1OC	409108365	WRKMLXVWWQDMFP-YWRNMLBISA-N	546.693	2.949	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)CN2C(=O)C[C@@H](N3C(=O)/C(=C/c4ccccc4)SC3=S)C2=O)cc1	102845025	ZAFLMZXTGGBXQJ-GEBKJHSDSA-N	523.592	2.831	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4ccc(OC)cc4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19940447	MNTFFUJFVPWTIV-OZXSUGGESA-N	531.617	2.622	10	40	KFCB	
Cc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(OCC(=O)N3CCOCC3)c(Br)c2)C1=O	409380174	JQAWAFACZIVJDO-SFQUDFHCSA-N	528.359	2.662	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CC(=O)O)C3=O)c(N3CCN(c4ccc(F)cc4)CC3)nc12	33354123	QHAZCFZQHMWRTK-UYRXBGFRSA-N	539.614	2.754	10	40	KFCB	
O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(CN2CCN(S(=O)(=O)c3ccccc3)CC2)cc1	113624769	XUTWIVWVJVBADT-UHFFFAOYSA-N	534.682	2.960	10	40	KFCB	
COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc(I)c1O[C@H](C)C(=O)O	409407253	LXWIYQYCMDYVAM-ZEVOCZHWSA-N	508.268	2.613	10	40	KFCB	
CCCCN1C(=O)/C(=C/c2c(N3CCN(C(=O)OCC)CC3)nc3ccccn3c2=O)SC1=S	8858380	PWLIYCUYWOLVDO-ICFOKQHNSA-N	501.634	2.974	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2	70699505	VVAJHKDQYMGEMR-SJEQQYOWSA-N	541.560	2.552	10	40	KFCB	biogenic
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1ccc(OC)cc1OC	166817136	VOWGKZHTYODPMR-MKWGYRPRSA-N	549.649	2.652	10	40	KFCB	
CCOc1c(OC)cccc1[C@@H]1C(C(=O)OCCOC)=C(C)N=c2s/c(=C/c3ccc(N(C)C)cc3)c(=O)n21	409015330	OSDTYOJITMDPKT-LBKCIFGTSA-N	551.665	2.898	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OC)c(OC)c3OC)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	8450449	WISRDYRPLKAWCE-JDCXBEBJSA-N	537.638	2.890	10	40	KFCB	
COc1ccc(N2CCN([C@H](CNC(=O)C(=O)NCCc3ccccc3OC)c3ccco3)CC2)cc1	56946063	YCIRCAQHWAHWDS-XMMPIXPASA-N	506.603	2.635	10	40	KFCB	
Cc1ccc2nc(N3CCN(c4ccc(F)cc4)CC3)c(/C=C3\SC(=S)N(CC(=O)O)C3=O)c(=O)n2c1	97947287	BMHQLNYIJSPHTL-UNOMPAQXSA-N	539.614	2.754	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\Nc3ccc(S(=O)(=O)N4CCCCC4)cc3OC)C2=O)cc1	408526270	BJHJTVNZKPLXCI-CAPFRKAQSA-N	528.587	2.847	10	40	KFCB	
CCOc1ccc(N2C(=O)/C(=C/c3cc(I)c(OCC(=O)O)c(OC)c3)C(=O)NC2=S)cc1	408905548	ZCKHZFULJCKLLJ-OVCLIPMQSA-N	582.372	2.993	10	40	KFCB	
O=C(CN1C(=O)N/C(=C\c2ccc(N3CCOCC3)c(F)c2)C1=O)Nc1ccc(Br)cc1	409130686	XHXPNOMNDILGPB-PDGQHHTCSA-N	503.328	2.956	10	40	KFCB	
COc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Br)cc(Br)c3OCC(N)=O)C2=O)cc1	409262206	DGUZKRQIHQFMBS-VGOFMYFVSA-N	553.163	2.751	10	40	KFCB	
COc1ccccc1N1C(=O)/C(=C/c2cc(I)c(O)c(OC)c2)C(=O)NC1=S	409174400	RYYGDXRXOIIUBE-YRNVUSSQSA-N	510.309	2.845	10	40	KFCB	
COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)[C@H](Cc2ccccc2)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	408691205	YURRUKCVTUVARK-KNKQGSTJSA-N	507.499	2.648	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)ccc1OCCOc1ccccc1	41077760	JDGCAPKLKYIWEG-OMLAYDHKSA-N	500.558	2.774	10	40	KFCB	
Cc1ccc2nc(N3CCN(c4ccc(F)cc4)CC3)c(/C=C3/SC(=S)N(CC(=O)O)C3=O)c(=O)n2c1	100843120	BMHQLNYIJSPHTL-XDHOZWIPSA-N	539.614	2.754	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@@H]31)C(=O)N2	229616466	HPHNEOJMOVENCK-SSDLVIMLSA-N	561.978	2.999	10	40	KFCB	
O=C1NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2Br)C(=O)/C1=C/NC12CN3CN(CN(C3)C1)C2	408530678	JLCYBGZOJIOZNT-UFFVCSGVSA-N	581.515	2.531	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc(I)c1O	408948969	HPDHPNQQKSYSCA-LFYBBSHMSA-N	522.251	2.791	10	40	KFCB	
COc1ccc(N2CCN(C(=O)C[C@H]3C(=O)NCCN3C(=O)c3ccc(Cl)cc3Cl)CC2)cc1	9096675	LLQJWECRHAOHNM-NRFANRHFSA-N	505.402	2.682	10	40	KFCB	
COc1ccc(CCN2C(=O)[C@H]3[C@H](Cc4ccc(O)c(O)c4)N[C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1OC	103521088	OHEMAVIQDGBOJN-BTANPKBMSA-N	578.021	2.974	10	40	KFCB	
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCN=[N+]=[N-])C(C)(C)C)cc1	820924945	SDSUWMZOAFJCPF-OTNCWRBYSA-N	601.730	2.571	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4cc(OC)ccc4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19940673	VGPDJZRKTGNLHW-BVAGGSTKSA-N	531.617	2.622	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1Cc1ccccc1Cl	16021698	UYYOJRBRGCNQTK-JYYLQKJRSA-N	503.942	2.915	10	40	KFCB	
COc1ccccc1OCCOc1ccc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)cc1OC	101393695	MDAOBYTTWRXQOC-SNMDACFJSA-N	530.584	2.783	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1	6135867	VFXBEHCMMVXNET-UGKGYDQZSA-N	540.621	2.713	10	40	KFCB	
O=C(CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)N3CCCCC3)C2=O)SC1=S)N1CCCCC1	101000109	PWXBLCQFBACDTI-ISLYRVAYSA-N	540.758	2.724	10	40	KFCB	
Cn1c(=O)n(C)c2cc(N3CCN(c4ccccc4)CC3)c(N/C=C3\C(=O)NC(=O)N(CCc4ccccc4)C3=O)cc21	408531520	OINHTUTWCJHUQT-DARPEHSRSA-N	579.661	2.821	10	40	KFCB	
Cc1cc([C@@H]2NC(N)=Nc3nc4ccccc4n32)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1	6198970	VDYGYFUORXFIOR-HSZRJFAPSA-N	505.604	2.561	10	40	KFCB	
O=C(CN(c1ccc2c(c1)OCCO2)S(=O)(=O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1	10113417	HVYHSTLDBQLJQP-UHFFFAOYSA-N	523.611	2.806	10	40	KFCB	
CC(C)C(=O)O[C@H](C(=O)O)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O	150345553	RIVNVLITMUKUQK-DKEMRKBRSA-N	766.661	2.833	10	40	KFCB	biogenic,in-vitro
CCOc1c(OC)cccc1[C@H]1C(C(=O)OCCOC)=C(C)N=c2s/c(=C/c3ccc(N(C)C)c([N+](=O)[O-])c3)c(=O)n21	408974454	ZICAQBFEVMXJSN-ZMIGGIFCSA-N	596.662	2.806	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1ccc(OC)c(OC)c1	409065955	GNOMCVIQRHOFAG-MKWGYRPRSA-N	549.649	2.652	10	40	KFCB	
Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(/N=N/c3ccc(S(=O)(=O)Nc4ncccn4)cc3)c(O)c12	4522189	WYHGGBPOJRORSG-OCOZRVBESA-N	580.582	2.627	10	40	KFCB	
CC(=O)OC[C@H]1O[C@H](Oc2ccc3c(-c4ccccc4)cc(=O)oc3c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	70665330	QCLMGHOOPBXDPV-RIAYOEEMSA-N	568.531	2.922	10	40	KFCB	biogenic
NC(=O)C1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(Cc3ccccc3)C2=O)CC1	2373841	ZSYZMGDBFXWHFD-RGEXLXHISA-N	505.625	2.798	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(I)c1O	408879124	FOTRRONFKBICTR-LFYBBSHMSA-N	509.212	2.580	10	40	KFCB	
Cc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(C)n1-c1ccc(OCC(=O)N2CCOCC2)cc1	409401430	YMEWNOVXADDWTL-UQQQWYQISA-N	500.555	2.793	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc(F)cc4)C(=O)[C@H]31)C(=O)N2	16020005	HMFPPESKNCQDQF-KMGQHQDOSA-N	515.541	2.963	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OS(=O)(=O)c1ccc(Cl)cc1	409066646	BCZBFLIVONFEDR-UHFFFAOYSA-N	515.725	2.628	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c3C)C2=O)cc1	408967736	UFFUURZABNBYHJ-HYARGMPZSA-N	508.556	2.807	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3cc4nc(O)[nH]c4cc3N3CCOCC3)C2=O)ccc1Br	408531518	KPVPMBONGCYWGX-SDNWHVSQSA-N	541.362	2.755	10	40	KFCB	
CCCCCN1C(=O)/C(=C/c2c(N3CCN(CCO)CC3)nc3ccc(C)cn3c2=O)SC1=S	20130135	OVVSOCDANLMTJR-CYVLTUHYSA-N	501.678	2.509	10	40	KFCB	
COCCn1nnnc1[C@H](c1cc2cc(C)cc(C)c2[nH]c1=O)N1CCN(c2ccc(OC)cc2)CC1	20083111	XCVJYPLYTLRMEG-VWLOTQADSA-N	503.607	2.698	10	40	KFCB	
CCS(=O)(=O)C1=NN2C(=N)/C(=C/c3ccc(OS(=O)(=O)c4ccc(C)cc4)cc3)C(=O)N=C2S1	97964787	HPQLBXRSQACSBX-SABKFZPKSA-N	518.598	2.774	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(Br)c1OCC(=O)O	409056905	NKUWGBUIZFUZKG-VGOFMYFVSA-N	534.275	2.886	10	40	KFCB	
COc1ccc(N2C(=O)[C@@H]3[C@H](Cc4ccccc4)NC4(C(=O)c5ccccc5C4=O)[C@H]3C2=O)c([N+](=O)[O-])c1	245284192	QLIYSITUZMKHNC-WWPVKYPJSA-N	511.490	2.742	10	40	KFCB	
CCOC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1OC	409374235	ZGHRCGPXSZKBEY-VGOFMYFVSA-N	507.293	2.655	10	40	KFCB	
Cc1ccc(N2C(=O)/C(=C/c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C(=O)NC2=S)cc1	409378414	OYINCGQSZHKFDE-LDADJPATSA-N	544.427	2.826	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc(I)c1OCC(N)=O	409221701	ABMWBDVOJIBHLT-LZYBPNLTSA-N	563.348	2.837	10	40	KFCB	
CCOc1ccc(N2C(=O)/C(=C/c3cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c3C)C(=O)NC2=S)cc1	2175486	PYPKOANXWUPAHU-HYARGMPZSA-N	524.624	2.972	10	40	KFCB	
CN(C)CCN(C)C(=O)C[C@@H]1CCN2C[C@@H]1CCCOc1ccc(N(C)CCc3ccccn3)cc1CNCC2=O	67879165	SHFWVSRQGCRBGJ-UIOOFZCWSA-N	564.775	2.898	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OC(=O)c1ccc(OC)cc1	100648440	KAKNNLWIVRDYOI-UHFFFAOYSA-N	536.278	2.667	10	40	KFCB	
Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)O)c(I)c3)C2=O)cc1	408787120	RSPABFRKTFEFLU-RIYZIHGNSA-N	506.252	2.729	10	40	KFCB	
COc1ccc(CCN2C(=O)[C@@H]3[C@H](Cc4ccc(O)c(O)c4)N[C@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1OC	70707325	OHEMAVIQDGBOJN-WAWVIVDZSA-N	578.021	2.974	10	40	KFCB	biogenic
C[C@@H](CCc1ccccc1)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]2CCCN32)C1=O	97967961	FYZXSIGZVOXJIX-FBEFIZPRSA-N	583.645	2.731	10	40	KFCB	
CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)Nc4ccc(O)c(C(=O)O)c4)ccc3OCC)nc12	2274417	HQWXZTRYIWULAX-UHFFFAOYSA-N	527.559	2.879	10	40	KFCB	in-vitro
CCc1ccc2[nH]c(=O)c([C@H](c3nnnn3CCOC)N3CCN(c4ccc(OC)cc4)CC3)cc2c1	19972956	MEOICWCHPRAGFT-RUZDIDTESA-N	503.607	2.644	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OCC(=O)N4CCCC4)c(OC)c3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409169622	QIQCYZIMRAMROK-FJSZTYFPSA-N	604.729	2.874	10	40	KFCB	
COc1ccccc1OCCOc1c(Br)cc(C=C2C(=O)NC(=S)NC2=O)cc1OC	9553582	CRNRHVPWUVIQEC-UHFFFAOYSA-N	507.362	2.838	10	40	KFCB	
COc1ccc(N2CCN(c3nc4c(c(O)nc(=O)n4C)n3C[C@H](O)COc3ccc4ccccc4c3)CC2)cc1	102612713	LYTCAESNJVSIBQ-QHCPKHFHSA-N	556.623	2.764	10	40	KFCB	
CCOc1c(OC)cccc1[C@H]1C(C(=O)OCCOC)=C(C)N=c2s/c(=C/c3ccc(N(C)C)cc3)c(=O)n21	409015331	OSDTYOJITMDPKT-QXHVWWCLSA-N	551.665	2.898	10	40	KFCB	
NC(=O)COc1c(Br)cc(Br)cc1/C=C1\C(=O)NC(=O)N(c2ccc(F)cc2)C1=O	409266348	YEDYYYYJVMAPBI-AWNIVKPZSA-N	541.127	2.881	10	40	KFCB	
O=C1NC(=S)N(c2ccccc2F)C(=O)/C1=C/c1ccc(OCC(=O)N2CCOCC2)c(Br)c1	409388052	SZQONLVLIOBPOO-RVDMUPIBSA-N	548.390	2.657	10	40	KFCB	
CCOC(=O)CNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1CC	6135423	YFGIBVUMYKNCIE-HSZRJFAPSA-N	552.657	2.520	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc([N+](=O)[O-])c(OC)cc3OC)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	408718740	DNYDWNUTRKWXFG-RWTNITNYSA-N	552.609	2.790	10	40	KFCB	
CCCOc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(N)=O)c(OCC)c3)C2=O)cc1OCC	409224760	MKRDPZKLJYNWEJ-LDADJPATSA-N	511.531	2.803	10	40	KFCB	
CCOC(=O)N1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N([C@@H](C)CC)C2=O)CC1	1447006	YYVAYYNPFGYVLQ-YIQZXQSLSA-N	501.634	2.973	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4ccc(C)cc4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19940603	XQROCJMXCGCQBS-OZXSUGGESA-N	515.618	2.922	10	40	KFCB	
O=C(CCCCCN1C(=O)/C(=C2\SC(=S)N(CCCCCC(=O)N3CCOCC3)C2=O)SC1=S)N1CCOCC1	100547092	BLJJSLRZADTTFT-QURGRASLSA-N	628.864	2.757	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	257346812	WVRUVXYKXRESME-MXZJTYQTSA-N	577.633	2.527	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1ccccc1Cl	409256161	KEQKIDUXNSWQQS-UHFFFAOYSA-N	555.712	2.720	10	40	KFCB	
Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3C[C@H](O)CN3S(=O)(=O)c3ccccc3[N+](=O)[O-])c2C)cc1	103128845	FWEYHHWNNREBBK-NZQKXSOJSA-N	541.582	2.861	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(F)cc1	409363062	JGVOGZNOPBHVDI-UHFFFAOYSA-N	506.284	2.754	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)CN2C(=O)C[C@H](N3C(=O)/C(=C/c4cccs4)SC3=S)C2=O)cc1	101113438	YOYCBRYTSKOGKG-IUPCOXQMSA-N	529.621	2.892	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCN(C)CC4)c([N+](=O)[O-])c3)c(=O)n2[C@H]1c1ccccc1OC	409099243	KIHHWWBHIHXKPS-QYTZQGLJSA-N	604.733	2.772	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	247897742	HPHNEOJMOVENCK-MAMYROPKSA-N	561.978	2.999	10	40	KFCB	
COc1ccc(N2CCN(C(=O)COc3ccc(S(=O)(=O)NCCc4ccc(OC)c(OC)c4)cc3)CC2)cc1	409206380	NPFZFVPFZDOMDN-UHFFFAOYSA-N	569.680	2.961	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1c1ccc2c(c1)OCCO2	101335317	ZEVLNQPGMPTENN-HUDHWQHISA-N	547.951	2.690	10	40	KFCB	
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)N/C=C1/C(=O)N=C(S)N(c2cc(OC)ccc2OC)C1=O	102620621	RMJJGJQQXXAXLZ-BLMOFCDVSA-N	508.556	2.602	10	40	KFCB	
COc1c2c(cc3c1[C@@H](CN/C=C1\C(=O)NC(=S)N(c4ccc(C(C)C)cc4)C1=O)N(C)CC3)OCO2	103924501	STGCPQUPUMETKG-QDDTUJKSSA-N	522.627	2.998	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(OC)cc1	409370093	KUUHNMGMAAFDGE-UHFFFAOYSA-N	534.388	2.788	10	40	KFCB	
O=C1/C(=C/c2c(N3CCN(c4ccccc4F)CC3)nc3ccccn3c2=O)SC(=S)N1[C@@H]1CCS(=O)(=O)C1	97946857	GQTCRKUQDWPUML-VKZJTJHYSA-N	585.708	2.549	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OCC(=O)N4CCOCC4)c(OCC)c3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409154154	NXIXJTZUWNUXCC-CFEDROAVSA-N	634.755	2.501	10	40	KFCB	
O=C(O)/C=C/c1ccc(O)c2c1[C@H](C(=O)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O)[C@H](c1ccc(O)c(O)c1)O2	225096165	HHKGQYGYEDKXNE-XPXASJQOSA-N	538.461	2.769	10	40	KFCB	biogenic,in-vitro
CCOC(=O)CNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(CC)cc1	6134772	DGFBAGLZTUOAGT-HSZRJFAPSA-N	552.657	2.520	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1ccc(Cl)cc1	409218486	FJUBPWFNBCCWRP-UHFFFAOYSA-N	555.712	2.720	10	40	KFCB	
COCCNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1	6193932	NBLYXYAUWMFTQL-JOCHJYFZSA-N	524.647	2.658	10	40	KFCB	
COc1ccc(OCCOc2ccc(/C=C3/C(=N)N4N=C(S(C)(=O)=O)SC4=NC3=O)cc2OC)cc1	97964386	LDBCEXIXGJNQCM-WPTKKBASSA-N	530.584	2.783	10	40	KFCB	
NC(=O)COc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O	409219144	JKLTZDUJTKUGEQ-RIYZIHGNSA-N	523.137	2.742	10	40	KFCB	
O=C1/C(=C/c2c(N3CCN(c4ccc(F)cc4)CC3)nc3ccccn3c2=O)SC(=S)N1[C@H]1CCS(=O)(=O)C1	97946763	VLOSGYIYJKAFHQ-SLOMDMAXSA-N	585.708	2.549	10	40	KFCB	
COc1ccc(OC)c(N2C(=O)NC(=O)/C(=C/c3cc(I)c(O)c(OC)c3)C2=O)c1	100330586	BCSULTZHAMMARE-SDQBBNPISA-N	524.267	2.689	10	40	KFCB	
COc1ccc(N2CCN(c3nc4ccccn4c(=O)c3/C=C3\SC(=S)N(CCC(=O)O)C3=O)CC2)cc1	100762377	BABHELLVUCMRFQ-SILNSSARSA-N	551.650	2.706	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCC(=O)O)C3=O)c(NC[C@@H](O)c3ccccc3)nc12	1885438	WANOVQFEUNAHFM-ZCWPUFOUSA-N	510.597	2.824	10	40	KFCB	
COc1c2c(cc3c1[C@H](CN/C=C1\C(=O)NC(=S)N(c4ccc(C(C)C)cc4)C1=O)N(C)CC3)OCO2	103924506	STGCPQUPUMETKG-RQRMZWKBSA-N	522.627	2.998	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cn(CC(=O)N4CCOCC4)c4ccccc34)C2=O)cc1	9259926	VGKPOZYHSLLKAS-PXLXIMEGSA-N	502.527	2.565	10	40	KFCB	
O=C(O)CCN1C(=O)/C(=C\c2c(N3CCN(c4ccc(F)cc4)CC3)nc3ccccn3c2=O)SC1=S	100860242	VEEHILDCYSKASI-XDJHFCHBSA-N	539.614	2.836	10	40	KFCB	
CC[C@]1(O)C[C@H](O[C@@H]2C[C@H](N(C)C)[C@H](O[C@@H]3C[C@H](O)[C@H](O[C@@H]4CCC(=O)[C@H](C)O4)[C@H](C)O3)[C@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)ccc(O)c2C3=O)[C@@H]1C(=O)OC	85431578	STUJMJDONFVTGM-WEYMSSJYSA-N	827.877	2.863	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1OC	409384221	CHDUZVXSZCTBBQ-UHFFFAOYSA-N	534.388	2.788	10	40	KFCB	
COc1ccc(CCNC(=O)C(=O)NC[C@@H](c2ccco2)N2CCN(c3ccc(OC)cc3)CC2)cc1	56946166	PPCCELYTMXCAQF-VWLOTQADSA-N	506.603	2.635	10	40	KFCB	
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@@H](Cc4ccc(O)c(O)c4)N[C@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1	101334849	KXFBVFVJPXOQQG-PKVHRPSESA-N	547.951	2.844	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc(I)c1O	409190636	UCLCONGBMXFRKK-WUXMJOGZSA-N	524.292	2.535	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1c1ccc2c(c1)OCCO2	101335328	ZEVLNQPGMPTENN-VLRVBGRWSA-N	547.951	2.690	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1cc(OC)ccc1OC	138386379	MIQGUDIOKKESJB-OCEWKHMESA-N	549.649	2.652	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Br)c(OCC(=O)O)c(OC)c3)C2=O)cc1	409048112	RNNGUCPYGXVHEZ-OVCLIPMQSA-N	519.304	2.986	10	40	KFCB	
O=C1NC(=O)N(c2ccc(I)cc2)C(=O)/C1=C/NN1CCCC[C@@H]1c1cccnc1	9108905	NTIIWAQYKGZSTR-VJSYINPZSA-N	517.327	2.885	10	40	KFCB	
O=C(CCCCCN1C(=O)/C(=C2\SC(=S)N(CCCCCC(=O)NCCCN3CCOCC3)C2=O)SC1=S)NCCCN1CCOCC1	150406930	AWPLSSGFIUSHEJ-BYYHNAKLSA-N	743.056	2.716	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(I)c1OCc1ccc(C(=O)O)cc1	408912370	FLZXXZXGRKKUOO-VGOFMYFVSA-N	552.346	2.834	10	40	KFCB	
CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C/NCCN1CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1	100149271	MTYZPIYZEZGJPV-BHFAEPNASA-N	533.545	2.557	10	40	KFCB	
COc1ccc(OCCOc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(C)(=O)=O)cc2OC)cc1	101394144	YXKUOFYZYFGRMF-WPTKKBASSA-N	530.584	2.783	10	40	KFCB	
COC[C@@H]1CCCN1c1ccc2c(c1)CNCC(=O)N1CC[C@@H](CC(=O)NCc3ccncc3)[C@@H](C=CCO2)C1	958317633	XMXKELGDWWERQE-VBOOUTDYSA-N	547.700	2.906	10	40	KFCB	
COc1ccc(CCN2C(=O)[C@@H]3[C@H](Cc4ccc(O)c(O)c4)N[C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1OC	70707322	OHEMAVIQDGBOJN-ZLEDHLGDSA-N	578.021	2.974	10	40	KFCB	biogenic
CCc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	408528130	FGYRVPGGCOPXRA-BXBHGGAKSA-N	503.309	2.710	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3N=C(c4cccnc4)SC3=NC2=O)cc(Br)c1OS(C)(=O)=O	6157280	UQOKWOFKNXSSCC-RHVZPXKPSA-N	536.389	2.859	10	40	KFCB	
Cc1cc([C@H]2NC(N)=Nc3nc4ccccc4n32)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1	6198969	VDYGYFUORXFIOR-QHCPKHFHSA-N	505.604	2.561	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N(C)C)cc3)c(=O)n2[C@H]1c1cc(OC)ccc1OC	16682435	GHJGPHCLNLSTFC-XPCGLTFESA-N	507.612	2.882	10	40	KFCB	
Cc1ccc(NC(=O)CN2C(=O)/C(=C3\SC(=S)N([C@H]4CCS(=O)(=O)C4)C3=O)c3ccccc32)cc1	8691456	MFOXMUZWSUDBMW-JHBCHSCWSA-N	527.649	2.739	10	40	KFCB	
CC(C)C(=O)O[C@H](C(=O)O)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O	253390629	RIVNVLITMUKUQK-BEHNTHPTSA-N	766.661	2.833	10	40	KFCB	biogenic,in-vitro
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OS(=O)(=O)c1ccc(Cl)cc1	409072394	NGHLSGAQFFVQCP-UHFFFAOYSA-N	531.793	2.793	10	40	KFCB	
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1C	6195226	VIEIGAIZOIERSJ-QFIPXVFZSA-N	524.647	2.658	10	40	KFCB	
CCCCCCN1C(=O)/C(=C/c2c(N3CCN(CCO)CC3)nc3ccccn3c2=O)SC1=S	20150097	VSGLDNHYLLBPLX-ZPHPHTNESA-N	501.678	2.590	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N([C@H]4CCS(=O)(=O)C4)C3=O)c(NC[C@H](O)c3ccccc3)nc12	101351410	LZDZDEUEKTXNJL-PTBKXAHWSA-N	556.691	2.537	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)COC(=O)[C@@H](Cc2ccccc2)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	408679011	CAJACENNBSFFLX-XPWALMASSA-N	504.539	2.908	10	40	KFCB	
Cc1ccc2nc(N3CCN(CCO)CC3)c(/C=C3\SC(=S)N(C4CCCCC4)C3=O)c(=O)n2c1	20065248	IDWPOSYILNJREW-HKWRFOASSA-N	513.689	2.651	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(CCc4ccc(OC)c(OC)c4)C(=O)[C@H]31)C(=O)N2	70705940	KJDQGMIITGVSAH-PERLVZDISA-N	571.630	2.883	10	40	KFCB	biogenic
CN(C)S(=O)(=O)c1ccc(-c2nn(-c3ccccc3)cc2/C=C2/SC(N3CCC(C(N)=O)CC3)=NC2=O)cc1	97947173	ZXKRHSKSOGXLPB-XQNSMLJCSA-N	564.693	2.957	10	40	KFCB	
Cc1ccc2nc(NCCCOC(C)C)c(/C=C3\SC(=S)N([C@H]4CCS(=O)(=O)C4)C3=O)c(=O)n2c1	101008325	ZJYJJJLNUALBJR-GYXHFJGISA-N	536.701	2.618	10	40	KFCB	
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1C	6195555	WMSFFFQUAUULND-QFIPXVFZSA-N	524.647	2.658	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)ccc1OCCOc1ccccc1	20205612	BUXKOKAEMAHLTA-OMLAYDHKSA-N	500.558	2.774	10	40	KFCB	
COc1cccc(OCCOc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(C)(=O)=O)cc2)c1	20205701	ZYUKMEODOJJIBU-BIWIXZEJSA-N	500.558	2.774	10	40	KFCB	
COc1ccc([N+](=O)[O-])cc1-n1c(C)cc(/C=C2/SC(=O)N(CC(=O)N3CCOCC3)C2=O)c1C	409133024	ZBQXGYCLZAIUMW-RGVLZGJSSA-N	500.533	2.906	10	40	KFCB	
Cc1ccc2nc(NCCCO)c(/C=C3\SC(=S)N(Cc4ccc5c(c4)OCO5)C3=O)c(=O)n2c1	2332929	HPXGFKBXQNCZQR-GRSHGNNSSA-N	510.597	2.927	10	40	KFCB	
CC(C)C(=O)O[C@H](C(=O)O)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O	229769823	RIVNVLITMUKUQK-ILGQVXMJSA-N	766.661	2.833	10	40	KFCB	biogenic,in-vitro
CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(Br)c(Br)c1OCC(N)=O	409399621	KVLGHJKYBOBTSL-JYRVWZFOSA-N	539.180	2.936	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc(Cl)c1OCC(=O)OC	408951768	MOXUPWBFFJGUHT-MKMNVTDBSA-N	502.863	2.686	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2	70701129	VHUFKLNZFVLLNM-WWFOEIHLSA-N	527.533	2.557	10	40	KFCB	biogenic
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc4c(cc3[N+](=O)[O-])OCO4)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	408723301	QHDJVORMQZDGLP-GSOQPGDSSA-N	536.566	2.501	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(Br)c1OCC(=O)Nc1ccccc1	408914035	XDKVKXZKIIAHAB-RIYZIHGNSA-N	504.362	2.732	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)ccc1OC(=O)c1ccc(F)cc1	20205856	VNWGUMKYVRMCBD-WMYZHHRISA-N	502.505	2.675	10	40	KFCB	
CCOC(=O)CNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1	6089329	WTDZSEXDJIBZQA-HSZRJFAPSA-N	552.657	2.574	10	40	KFCB	
COc1cc(/C=C2/SC(=S)N(CC(=O)O)C2=O)ccc1OCC(=O)Nc1cccc([N+](=O)[O-])c1	9310478	GAOSHMCZRVWUKF-CAOOACKPSA-N	503.514	2.907	10	40	KFCB	
O=C(O)CCN1C(=O)/C(=C/c2c(N3CCN(c4ccccc4F)CC3)nc3ccccn3c2=O)SC1=S	97947257	OZAMZCMIURCMAB-CYVLTUHYSA-N	539.614	2.836	10	40	KFCB	
COC(=O)c1cc(C(=O)OC)cc(N2C(=O)[C@H]3[C@H](C2=O)C2(O[C@H]3c3ccccc3)C(=O)c3ccccc3C2=O)c1	250365747	JLRILKQBCDQYDO-ZRBLBEILSA-N	539.496	2.955	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OS(=O)(=O)c1ccccc1	408878939	BUWCNTSWFRIAHD-UHFFFAOYSA-N	511.375	2.530	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3cc4c(cc3N3CCN(C)CC3)n(C)c(=O)n4C)C2=O)c(C)cc1Br	408536572	WRMYZHIPMSZRMA-SAPNQHFASA-N	596.486	2.587	10	40	KFCB	
Cc1cccc(N2C(=O)/C(=C/c3cn(CC(=O)N4CCOCC4)c4ccccc34)C(=O)NC2=S)c1C	408961553	NAVXILVNJMDMPD-KGENOOAVSA-N	502.596	2.948	10	40	KFCB	
O=C(CN1C(=O)S/C(=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O)Nc1ccc(N2CCOCC2)cc1	409147259	VQOHJTUAUFJMJZ-KQWNVCNZSA-N	553.597	2.943	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(C)c(C)c1	409268405	SUSMVNPLKLPCBB-UHFFFAOYSA-N	502.321	2.841	10	40	KFCB	
COc1cc(/C=C2\SC(=S)N([C@H]3CC(=O)N(CC(=O)O)C3=O)C2=O)ccc1OCc1ccc(F)cc1	100971791	AALBYRSWFFNMKB-SCPBCGJWSA-N	530.555	2.827	10	40	KFCB	
CCS(=O)(=O)C1=NN2C(=N)/C(=C/c3ccc(OC(=O)c4ccc(OC)c(OC)c4)cc3)C(=O)N=C2S1	97964781	CLEKJXFTTBHXSV-MLDLNWIHSA-N	528.568	2.934	10	40	KFCB	
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@@H](Cc4ccc(O)c(O)c4)N[C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1	101334846	KXFBVFVJPXOQQG-IGGVYQGESA-N	547.951	2.844	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)CN2C(=O)C[C@@H](N3C(=O)/C(=C/c4cccs4)SC3=S)C2=O)cc1	101113440	YOYCBRYTSKOGKG-FNTDYBJHSA-N	529.621	2.892	10	40	KFCB	
Cc1cc(C(=O)COC(=O)[C@@H]2COc3ccccc3O2)c(C)n1-c1cccc(S(=O)(=O)N2CCOCC2)c1	3365946	PHQXMMIGJUAPSB-SANMLTNESA-N	540.594	2.681	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCc1ccc(C(=O)O)cc1	409067614	GHPRYWLLAAKPKJ-UHFFFAOYSA-N	536.278	2.717	10	40	KFCB	
CC(=O)COCOC(=O)CN(CC(=O)OCOCC(C)=O)c1ccc(-c2cc3ccc(C(=O)OCOC(C)=O)cc3[nH]2)cc1	95696900	XLQNJLJDRRJLCB-UHFFFAOYSA-N	612.588	2.531	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(NC[C@@H](C)O)nc4ccccn4c3=O)SC2=S)cc1OC	97946726	NQNHFUARTHTTST-CTFRJJSNSA-N	526.640	2.948	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc(I)c1OCC(=O)O	409043023	PDTUIFFFXFJBJC-VGOFMYFVSA-N	552.277	2.525	10	40	KFCB	
CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(Br)cc1OCC(=O)N1CCOCC1	409409948	XYIDCLLZOCEQPV-PDGQHHTCSA-N	530.375	2.547	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(CCc4ccc(OC)c(OC)c4)C(=O)[C@@H]31)C(=O)N2	103518786	KJDQGMIITGVSAH-QRGRHKGWSA-N	571.630	2.883	10	40	KFCB	
CCn1c(=O)/c(=C2/Sc3ccc(OC)cc3N2C)s/c1=C1\C(=O)N(c2ccc(C(=O)O)cc2)N=C1C	100087497	HOOQVAKHGZXUSM-SRPFLQSCSA-N	522.608	2.518	10	40	KFCB	
CCOc1ccc(NC(=O)[C@@H](/N=N\c2ccc(S(=O)(=O)N[C@H]3ON[C@@H](C)[C@H]3C)cc2)C(C)=O)cc1	104124224	KOXFRJDYKODYFV-PKBYBAGWSA-N	503.581	2.929	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(=O)(=O)C(C)C)ccc1OS(=O)(=O)c1ccccc1	38148328	GACGAYVSQYELNL-GJXXPDGXSA-N	548.624	2.863	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@@H]1c1cccc(OC)c1	100303326	FWBSMMCWYSTRQF-XSZPGNIMSA-N	564.620	2.552	10	40	KFCB	
COc1ccc(Oc2nc3ccccn3c(=O)c2/C=C2/SC(=S)N([C@@H]3CCS(=O)(=O)C3)C2=O)cc1	102993405	ROZINMWMHBLQJR-CRRKTRLDSA-N	529.621	2.884	10	40	KFCB	
CCOc1ccc([C@@H]2C(C(=O)OC)=CN=c3s/c(=C\c4ccc(N(C)C)cc4)c(=O)n32)cc1OCC	408933233	IQWOWFRHVXEDTQ-JXCKLXDISA-N	507.612	2.882	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2	70699508	VVAJHKDQYMGEMR-RBEXELFYSA-N	541.560	2.552	10	40	KFCB	biogenic
COCCN1C(=O)/C(=C/c2c(N3CCN(c4ccccc4OC)CC3)nc3ccccn3c2=O)SC1=S	100833660	RUFKWYWZHCKFBJ-FXBPSFAMSA-N	537.667	2.877	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc(I)c1OCC(=O)O	103850442	VOZLVGMPSOTZFX-VGOFMYFVSA-N	554.268	2.959	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1Cc1ccccc1	16020933	CZTOQNOGECBLFJ-KKBCGBJISA-N	503.942	2.915	10	40	KFCB	
CCCCNC(=O)CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)NCCCC)C2=O)SC1=S	8819079	FJBJEATXSCYTOL-FOCLMDBBSA-N	516.736	2.531	10	40	KFCB	
COc1ccc(N2CCN(C(=O)CSc3nnc4c(=O)n(Cc5ccccc5F)ccn34)CC2)cc1	49421447	SIVVKJLOQCOZID-UHFFFAOYSA-N	508.579	2.528	10	40	KFCB	
CN1C(=O)N(C)C(=O)C2(Cc3cc(/C=C4\C(=O)N=C(O)N(c5cccc(Cl)c5)C4=O)ccc3N3CCC[C@H]32)C1=O	97968435	FFSNXTILDSMVOT-SRKIZSPNSA-N	561.982	2.773	10	40	KFCB	
COc1ccccc1-n1c(C)cc(/C=C2/C(=N)N3N=C(CC(=O)N4CCOCC4)SC3=NC2=O)c1C	103596345	YAWRVJRVOAQUHZ-JINVPOKMSA-N	506.588	2.971	10	40	KFCB	
COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)Nc1cc(C(=O)OC)ccc1C(=O)OC	103920266	MFKSNERNKXWBKA-BKUYFWCQSA-N	510.459	2.820	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)c(Br)cc1OCC(=O)O	103842774	QIIFMGQVMJCFOA-WLRTZDKTSA-N	533.287	2.706	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(Cc2ccccc2)C(=O)c2snc(C(N)=O)c2N)cc1	6135955	KCTAERDGUNBAKQ-NZQKXSOJSA-N	536.658	2.569	10	40	KFCB	
Cc1cc(C(=O)COC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccccc2[N+](=O)[O-])c(C)n1-c1ccc(F)cc1	102778384	CNLAGWGHPSEQMI-KNQAVFIVSA-N	545.545	2.691	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1cccc(OC)c1	409061365	WMHJVSMIOIJLAL-OWXSRONMSA-N	519.623	2.644	10	40	KFCB	
CCNC(=O)C[C@@H]1CCN2C[C@@H]1/C=C/COc1ccc(N(C)CCc3ccccn3)cc1CNCC2=O	100035269	AWPQLJOGIUTHIM-BBKGRECJSA-N	505.663	2.790	10	40	KFCB	
COC(=O)[C@H](C)Oc1c(I)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1OC	409408921	SBUDZJOHBBZUEI-ZENNRRHLSA-N	522.295	2.702	10	40	KFCB	
COc1ccc(N2CCN(Cc3cc(=O)c(OC)cn3CC(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)cc1	22698791	XFTPUYHEZIJUBJ-UHFFFAOYSA-N	507.547	2.735	10	40	KFCB	
CCOc1cc(/C=C2/C(=N)N3N=C(S(=O)(=O)CC)SC3=NC2=O)ccc1OC(=O)c1ccco1	41083999	PFBPXMWXDNQIIC-DJCMSSBQSA-N	502.530	2.909	10	40	KFCB	
Nc1c(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(/N=N/c3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3)c(O)c12	96077630	OTKRGWXWWWNPKU-FUEWEDNTSA-N	903.904	2.638	10	40	KFCB	in-vitro
CN1C(=O)N(C)C(=O)C2(Cc3cc(/C=C4\C(=O)N=C(O)N(c5ccccc5Cl)C4=O)ccc3N3CCC[C@@H]32)C1=O	97968402	LTERSYGJDRXPRF-RYEVTAHJSA-N	561.982	2.773	10	40	KFCB	
CCNc1nc(NCC)n2c(SCC(=O)Nc3cc(OCC)c(N4CCOCC4)cc3OCC)nnc2n1	5947835	RBIKYZOIBHKDIB-UHFFFAOYSA-N	545.670	2.748	10	40	KFCB	
Cc1cc(/C=C2/C(=O)NC(=S)N(C)C2=O)c(C)n1-c1ccc(N2CCOCC2)c(Br)c1	409143776	IYRSIPWEHWKFOT-BOPFTXTBSA-N	503.422	2.950	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(I)c1OC	408804229	DNXGNJQGFKCZEP-AWNIVKPZSA-N	523.239	2.883	10	40	KFCB	
COc1ccc(N2CCN(C(=O)C[C@@H]3C(=O)NCCN3C(=O)c3ccc(Cl)cc3Cl)CC2)cc1	9096674	LLQJWECRHAOHNM-OAQYLSRUSA-N	505.402	2.682	10	40	KFCB	
Cc1nn(C)cc1C(=O)N1CCOc2ccc(N3CCOCC3)cc2Cc2cccc(c2)C(=O)N(C)CC1	643568141	LDQYIPQTYBJOIS-UHFFFAOYSA-N	517.630	2.763	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1C	409265815	PLDBBPLOGRYEES-UHFFFAOYSA-N	504.362	2.698	10	40	KFCB	
CCOC(=O)N1CCN(c2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(C(C)C)C2=O)CC1	8858373	GFXJUGZLFZEBSX-LGMDPLHJSA-N	501.634	2.891	10	40	KFCB	
CN(C)c1ccc(/C=c2/sc3n(c2=O)N[C@]2(c4ccccc4)N(C)C(=O)N(C)[C@@]2(c2ccccc2)N=3)cc1	12416611	JETDYKDVQXDARZ-YABQEUBLSA-N	524.650	2.685	10	40	KFCB	
COCCNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C	6442826	YKCXFVTVGCNGNA-JOCHJYFZSA-N	524.647	2.658	10	40	KFCB	
O=C1NC(=S)NC(=O)C1=Cc1cc(Br)cc(Br)c1OS(=O)(=O)c1ccccc1	409066115	AOXHMCBZZWHBCG-UHFFFAOYSA-N	546.218	2.894	10	40	KFCB	
CCCN1C(=O)/C(=C/c2c(N3CCN(C(=O)OCC)CC3)nc3c(C)cccn3c2=O)SC1=S	1446998	AMILHQCPLGIERV-VKAVYKQESA-N	501.634	2.893	10	40	KFCB	
CCOC(=O)CC1=NN(c2ccccc2)C(=O)/C1=c1/s/c(=C2\Sc3ccc(OC)cc3N2C)c(=O)n1CC	97994433	WRZTUERXDIDLFZ-FLPXOHCLSA-N	550.662	2.753	10	40	KFCB	
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	101572350	WVRUVXYKXRESME-AUSZMLSWSA-N	577.633	2.527	10	40	KFCB	
Cn1c(=O)n(C)c2cc(N/C=C3/C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)c(Br)cc21	408533181	OEXHZFXUNICYGO-XFXZXTDPSA-N	504.728	2.872	10	40	KFCB	
CC(=O)O[C@H](C)[C@H]1[C@@](C)(O)CC(=O)[C@]23O[C@]12C(=O)c1ccc(-c2ccc4c(c2O)C(=O)c2c(O)cc(C)c(C(C)=O)c2C4=O)c(O)c1[C@H]3O	77269360	JJRMFXHFOOMZIG-GANHTAAKSA-N	670.623	2.786	10	40	KFCB	biogenic,in-vitro
CCOC(=O)CC1=NN(c2ccccc2)C(=O)/C1=c1/s/c(=C2\Sc3ccc(Cl)cc3N2C)c(=O)n1C	97964017	AKWQQPQHCQLIDY-AIMKKSDKSA-N	541.054	2.915	10	40	KFCB	
CC(C)CC(=O)O[C@H]1[C@@H](N2CCOCC2)c2c(ccc(/C=C/C(=O)N3CCOCC3)c2O)OC1(C)C	19229458	HABFVMRKJUPSNL-PQGAWXBYSA-N	502.608	2.766	10	40	KFCB	biogenic
Cc1cccn2c(=O)c(/C=C3\SC(=S)N([C@H]4CCS(=O)(=O)C4)C3=O)c(NCCCOC(C)C)nc12	101002951	OCSMODLSGAFSKS-JIHKLPAASA-N	536.701	2.618	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1cc(OC)ccc1OC	409093728	ASTQVILOAKJHNS-FHMSYZJOSA-N	576.719	2.957	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCCC(=O)O)C3=O)c(NCCCn3ccnc3)nc12	36006958	IJYHPQJRUDANQY-LGMDPLHJSA-N	512.617	2.768	10	40	KFCB	
O=C(CSc1nnnn1-c1ccccc1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S	97981062	OJYNQRXHACZXLG-WOJGMQOQSA-N	526.625	2.501	10	40	KFCB	
O=C(CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)N(CCO)Cc3ccccc3)C2=O)SC1=S)N(CCO)Cc1ccccc1	150463954	GOWXCLKCSUGXQV-OCEACIFDSA-N	672.876	2.741	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(CCc4ccc(OC)c(OC)c4)C(=O)[C@@H]31)C(=O)N2	230034785	KJDQGMIITGVSAH-STLKKDIWSA-N	571.630	2.883	10	40	KFCB	
CCOC(=O)N1CCN(c2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)CC1	100863822	HWDANXIOZZJUIY-FJSNCCPHSA-N	543.671	2.662	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1ccc(F)cc1	409361650	CSCCNXVGPCFESB-UHFFFAOYSA-N	553.284	2.596	10	40	KFCB	
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)cc1	3337668	PFDNNCKRCDATBR-UHFFFAOYSA-N	541.582	2.528	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cn(CC(=O)N4CCOCC4)c4ccccc34)C2=O)c(OCC)c1	408960707	HUCASAYGOVADBU-PXLXIMEGSA-N	546.580	2.964	10	40	KFCB	
O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc(Cl)c(OCC(=O)N2CCOCC2)c(Br)c1	409400192	QGVOROSWOYHTSI-YBEGLDIGSA-N	520.767	2.802	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N(C)C)cc3)c(=O)n2[C@@H]1c1cc(OC)ccc1OC	16682434	GHJGPHCLNLSTFC-MGSPXPDISA-N	507.612	2.882	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4ccc(C)cc4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19940605	XQROCJMXCGCQBS-BVAGGSTKSA-N	515.618	2.922	10	40	KFCB	
COC[C@H](C)NC1=NN=C(c2cc(C)n(-c3cccc(S(=O)(=O)N4CCOCC4)c3)c2C)CS1	12542352	BYUSDRFYXNZUMQ-INIZCTEOSA-N	505.666	2.546	10	40	KFCB	
COc1ccc(N2CCN(CCCNC(=O)CCCn3c(=O)[nH]c4ccc(Br)cc4c3=O)CC2)cc1	4766538	QNDXRPIXSKKUGM-UHFFFAOYSA-N	558.477	2.570	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc(OC)c(OC)cc3[N+](=O)[O-])c(=O)n2[C@H]1c1ccc(N(C)C)cc1	408723532	YMTUABJXDVQKCD-MFUBYVTQSA-N	552.609	2.790	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc(I)c1O	409192377	BUJGMNJPMSFXCF-NTUHNPAUSA-N	538.319	2.925	10	40	KFCB	
Cc1ccc(N2C(=O)NC(=O)/C(=C/[C@H]3C(=O)NC(=S)N(c4ccc(Cl)cc4)C3=O)C2=O)cc1Cl	409335098	JSKNZNMVTAAQMT-MZLJFPOFSA-N	517.350	2.875	10	40	KFCB	
CCOC(=O)c1cccc(-c2ccc(/C=C3/C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)o2)c1	103242913	SWOPIJTVTOEIIC-MBYGRGGXSA-N	521.555	2.991	10	40	KFCB	
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C/c3ccc(Br)s3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	150390309	INTTWHIIIGFJPG-NESFITAMSA-N	636.520	2.795	10	40	KFCB	
CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc(I)c1OCC(=O)O	409408828	RTINSRLNFBKDMG-ZSOIEALJSA-N	508.268	2.615	10	40	KFCB	
O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(OCC(=O)N2CCOCC2)cc1	409227881	SJMYUGWFHCECBF-GZTJUZNOSA-N	504.326	2.897	10	40	KFCB	
COCCCN1C(=O)/C(=C/c2cc(Br)c(OCC(=O)N3CCOCC3)c(OC)c2)SC1=S	409255760	IRRJKCHPCVCNHF-ATVHPVEESA-N	545.477	2.933	10	40	KFCB	
COc1ccc(-c2c(C)oc3c(CN4CCN(C)CC4)c(O)c(CN4CCN(C)CC4)c(O)c3c2=O)cc1OC	22854541	CXJMCFAYCWXUBP-UHFFFAOYSA-N	552.672	2.692	10	40	KFCB	biogenic
CC(=O)OC[C@@H]1O[C@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O	257346811	WVRUVXYKXRESME-CZBKBKTASA-N	577.633	2.527	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1cccc(C)c1	409047681	PSAYHLAEJIORDR-UHFFFAOYSA-N	565.389	2.930	10	40	KFCB	
O=S(=O)(O)c1cc(O)c2c(N=Nc3c(S(=O)(=O)O)cc4cc(S(=O)(=O)O)cc(O)c4c3O)cc(S(=O)(=O)O)cc2c1	261109255	HUCRMWBRQRSUCH-UHFFFAOYSA-N	650.599	2.512	10	40	KFCB	
COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)[C@H](Cc2ccccc2)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	408691203	YURRUKCVTUVARK-IPJJNNNSSA-N	507.499	2.648	10	40	KFCB	
COc1ccc(N2CCC(O)(CN3CCN(C(C)=O)C[C@@](O)(COc4ccc(C)c(C)c4)C3)CC2)cc1	585282465	KQXRYGTYTDGDQQ-GDLZYMKVSA-N	511.663	2.618	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(Cc2ccccc2)C(=O)c2snc(C(N)=O)c2N)cc1	6135864	KCTAERDGUNBAKQ-REWPJTCUSA-N	536.658	2.569	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1F	409385252	IJSNKUGTWTVENH-UHFFFAOYSA-N	508.325	2.529	10	40	KFCB	
COc1cc(/C=C2/SC(=S)N(CC(=O)O)C2=O)ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-]	113832606	ZEGKXSSUCCFPCA-OQLLNIDSSA-N	510.527	2.657	10	40	KFCB	
CN1C(=O)N(C)C(=O)C2(Cc3cc(/C=C4\C(=O)N=C(O)N(c5ccccc5Cl)C4=O)ccc3N3CCC[C@H]32)C1=O	97968403	LTERSYGJDRXPRF-ZDJZVTAXSA-N	561.982	2.773	10	40	KFCB	
CC[C@]1(O)C[C@H](O[C@@H]2C[C@H](N(C)C)[C@H](O[C@@H]3C[C@H](O)[C@H](O[C@@H]4CCC(=O)[C@H](C)O4)[C@H](C)O3)[C@@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)ccc(O)c2C3=O)[C@@H]1C(=O)OC	257546042	STUJMJDONFVTGM-WELJMQIGSA-N	827.877	2.863	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCCC(=O)O)C3=O)c(N3C[C@H](C)O[C@@H](C)C3)nc12	16741567	CJAJITXNFYZALM-MFUVWIPLSA-N	502.618	2.683	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(F)cc1	409364427	PNBZVSVCCHTRMW-UHFFFAOYSA-N	508.325	2.529	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4cccc(C)c4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19826425	IHDPARKNSIPZAR-ZEQKJWHPSA-N	515.618	2.922	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc(I)c1OCC(N)=O	409222496	DHYGXTCKXHSNPX-VGOFMYFVSA-N	569.739	2.874	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O	254449345	OPMJIWCAYZDKKJ-VFVYLXGSSA-N	586.040	2.624	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\NNc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2=O)ccc1Br	408537106	ZDOQVRKXPSTXTJ-XYOKQWHBSA-N	505.241	2.657	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCCC(=O)O)C3=O)c(N3C[C@H](C)O[C@H](C)C3)nc12	16741566	CJAJITXNFYZALM-PGICLHPDSA-N	502.618	2.683	10	40	KFCB	
COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(Br)c(Br)c1OCC(=O)N1CCOCC1	409400941	VYQCMNWAVJMSIJ-WJDWOHSUSA-N	595.244	2.919	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OC)c(OC)c3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	8435155	QYYRTFLBQRQDGV-NLZIUFDSSA-N	507.612	2.882	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2	196819009	XFZJEEAOWLFHDH-CLFZCTPNSA-N	578.526	2.995	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(I)c(OCC(=O)O)c(OC)c3)C2=O)cc1	409053915	DOHRGGBOVVULOD-OVCLIPMQSA-N	566.304	2.828	10	40	KFCB	
CCOc1cc(/C=C2/C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc(Br)c1OCC(N)=O	13915021	GNMDSCYDLWWXRM-NVNXTCNLSA-N	502.321	2.687	10	40	KFCB	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)cc1	3378959	SAYDDDUNIHPGPU-UHFFFAOYSA-N	541.582	2.828	10	40	KFCB	
O=C(O)c1cc(NS(=O)(=O)c2cc(S(=O)(=O)Nc3ccc(O)c(C(=O)O)c3)c3cccc4c3c2NC4=O)ccc1O	102628686	PDRNGFRTJRGNJW-UHFFFAOYSA-N	599.555	2.815	10	40	KFCB	
O=C1NC(=O)C(=Cc2cc(Br)cc(Br)c2OS(=O)(=O)c2ccccc2)C(=O)N1	409063400	BEVQTLDJSGKSKJ-UHFFFAOYSA-N	530.150	2.729	10	40	KFCB	
COc1ccc(N2CCN(Cc3nc4c(c(=O)n(C)c(=O)n4C)n3Cc3c(F)cccc3Cl)CC2)cc1	57010858	KBPWEIDLNALSNS-UHFFFAOYSA-N	527.000	2.605	10	40	KFCB	
CCOCCCN1C(=O)/C(=C/c2c(N3CCN(C(=O)OCC)CC3)nc3ccccn3c2=O)SC1=S	100863787	KYFPJKPSQCXEFZ-VLGSPTGOSA-N	531.660	2.601	10	40	KFCB	
[N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCC(=O)Oc1c(F)c(F)cc(F)c1F	96503449	YBUKWUBLZURFHW-UHFFFAOYSA-N	527.468	2.948	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OC(=O)c1ccc(OC)cc1	408893869	GOHYRFHQZBFBIW-UHFFFAOYSA-N	505.346	2.990	10	40	KFCB	
COC(=O)COc1cc(Br)c(/C=C2\C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1OC	103852249	FAKWDGJSMRMYNZ-KPKJPENVSA-N	523.336	2.980	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409052098	GKUFSBNSUXYMJF-INZJWMLVSA-N	532.666	2.701	10	40	KFCB	
CCNC(=S)N1CCN(CCN/C(C)=C2\C(=O)N(c3nc4ccccc4s3)N=C2C(F)(F)F)CC1	101615318	UESIZWAYAGMYSW-VKAVYKQESA-N	525.626	2.937	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1cccc(C)c1C	409260428	QDRPJZRGZBABIP-UHFFFAOYSA-N	502.321	2.841	10	40	KFCB	
O=C(NN1C(=O)/C(=C2\SC(=S)N(NC(=O)c3ccccc3)C2=O)SC1=S)c1ccccc1	8870058	FBKFYIMGKYUYDC-BUHFOSPRSA-N	500.608	2.609	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1Cc1ccccc1	16020931	CZTOQNOGECBLFJ-JYYLQKJRSA-N	503.942	2.915	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)cc(Br)c1OCC(=O)O	409043914	ADEUADQHXWXHIK-OVCLIPMQSA-N	519.304	2.986	10	40	KFCB	
COC(=O)[C@H](Cc1c[nH]c2ccccc12)N/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O	2375764	RFNFKFPCOYYTFA-WPNIOXTASA-N	511.332	2.771	10	40	KFCB	
Cc1ccc(OCC(=O)c2cc(C)n(-c3cccc(S(=O)(=O)N4CCOCC4)c3)c2C)c([N+](=O)[O-])n1	3367393	FXOHIQBTPGLGIN-UHFFFAOYSA-N	514.560	2.988	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\[C@@H]3C(=O)NC(=S)N(c4ccc(Cl)cc4)C3=O)C2=O)ccc1Br	408763312	SAAVWZUVECMGBY-AAWPKVBNSA-N	561.801	2.984	10	40	KFCB	
CN1CCN(c2ccc(CNS(=O)(=O)c3nnc(NC(=O)c4ccc(Cl)cc4)s3)cc2)CC1	225625720	XIABOHQYXSDIGY-UHFFFAOYSA-N	507.041	2.674	10	40	KFCB	
COc1ccccc1/C=C1\SC(=S)N(Nc2nc3c(c(=O)n(C)c(=O)n3C)n2CCc2ccccc2)C1=O	102760931	SETUYXOHJZVLKX-CYVLTUHYSA-N	548.650	2.913	10	40	KFCB	
COc1ccc(N2C(=O)/C(=C\c3cc(I)c(O)c(OC)c3)C(=O)NC2=S)cc1	9311141	MBGAQWDWXUFVQW-QPEQYQDCSA-N	510.309	2.845	10	40	KFCB	
COc1ccc(N2C(=O)[C@@H]3[C@H](Cc4ccccc4)NC4(C(=O)c5ccccc5C4=O)[C@@H]3C2=O)c([N+](=O)[O-])c1	102924573	QLIYSITUZMKHNC-PMOQBDJRSA-N	511.490	2.742	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NCc2ccccc2)N(Cc2cccnc2)C(=O)c2snc(C(N)=O)c2N)cc1	6135884	VONZUDNFGGOZDQ-DEOSSOPVSA-N	543.653	2.985	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(I)c1OCC(=O)O	409046668	LEOUXRSIYXRLPT-MKMNVTDBSA-N	581.275	2.728	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc([N+](=O)[O-])ccc3N3CCN(C)CC3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	104607845	LKINLZDUZGCKBE-XKGHIZKOSA-N	590.706	2.524	10	40	KFCB	
COc1ccc(CN2C(=O)/C(=C/c3c(NCCOCCO)nc4c(C)cccn4c3=O)SC2=S)cc1	100839382	XOFYJCIFTUPEOH-ZHZULCJRSA-N	526.640	2.834	10	40	KFCB	
O=C1NC(=S)N(c2ccccc2F)C(=O)/C1=C/c1cc(I)c(O)c([N+](=O)[O-])c1	103850935	DLVHHKYQEVHEMJ-WEVVVXLNSA-N	513.244	2.875	10	40	KFCB	
NC(=O)C1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(CCc3ccccc3)C2=O)CC1	2194679	XNUVFJZJMLEAPW-SILNSSARSA-N	519.652	2.840	10	40	KFCB	
COc1ccc(CCNC(=O)C(=O)NC[C@H](c2ccco2)N2CCN(c3ccc(OC)cc3)CC2)cc1	56946168	PPCCELYTMXCAQF-RUZDIDTESA-N	506.603	2.635	10	40	KFCB	
COC(=O)COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1I	408908356	BWFLVKJGSKOYER-VGOFMYFVSA-N	524.242	2.649	10	40	KFCB	
CCOC(=O)N1CCN(CC2=CC(C)(C)N3C(=O)/C(=C4\SC(=S)NC4=O)c4cc(F)cc2c43)CC1	1554503018	AZZLWWONOHDABH-ZPHPHTNESA-N	516.620	2.981	10	40	KFCB	
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCOCCOCCN=[N+]=[N-])C(C)(C)C)cc1	820924946	UFMONCFLONVNNI-UWPQIUOOSA-N	689.836	2.604	10	40	KFCB	
O=C1/C(=C/c2c(NCCOCCO)nc3ccccn3c2=O)SC(=S)N1Cc1ccc(F)cc1	9019311	NEPJZWUKKVBGSQ-AQTBWJFISA-N	500.577	2.656	10	40	KFCB	
COc1c(/C=C2\C(=O)NC(=O)N(c3ccc(I)cc3)C2=O)c(CCN(C)C(C)=O)cc2c1OCO2	100288099	YGNCKOYHGZARPN-WOJGMQOQSA-N	591.358	2.716	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C[C@@H]4CCCO4)C3=O)c(N3C[C@H](C)O[C@@H](C)C3)nc12	107629297	PFMKXYKEVOBINJ-UCOKWQRQSA-N	500.646	2.997	10	40	KFCB	
COc1ccc(N2C(=O)[C@@H]3[C@@H](Cc4ccccc4)NC4(C(=O)c5ccccc5C4=O)[C@@H]3C2=O)c([N+](=O)[O-])c1	102924576	QLIYSITUZMKHNC-PTUXOGIPSA-N	511.490	2.742	10	40	KFCB	
CCOC(=O)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1Br	408951717	MMIDHKOULXLQMD-VGOFMYFVSA-N	517.288	2.786	10	40	KFCB	
COc1ccc(N2CCN(CCCn3c(=O)c4c(nc5n(C(C)C)c(C)c(C)n45)n(C)c3=O)CC2)cc1	96306561	XXFBAMBVAZYZPY-UHFFFAOYSA-N	507.639	2.568	10	40	KFCB	
CCc1ccccc1N1C(=O)/C(=C\c2cn(CC(=O)N3CCOCC3)c3ccccc23)C(=O)NC1=S	8722746	DEXGSZXUAMEZOI-QNGOZBTKSA-N	502.596	2.894	10	40	KFCB	
Cc1ccc2nc(N3CCN(CCO)CC3)c(/C=C3\SC(=S)N(Cc4ccccc4)C3=O)c(=O)n2c1	20082872	KQVQKKILIYCSAN-QNGOZBTKSA-N	521.668	2.519	10	40	KFCB	
CC[C@]1(O)C[C@H](O[C@@H]2C[C@H](N(C)C)[C@H](O[C@@H]3C[C@H](O)[C@H](O[C@@H]4CCC(=O)[C@H](C)O4)[C@H](C)O3)[C@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)ccc(O)c2C3=O)[C@H]1C(=O)OC	257546041	STUJMJDONFVTGM-HCTOIIPRSA-N	827.877	2.863	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc(Br)c1OCC(N)=O	409225339	OMCMEQDUOVLRNO-WLRTZDKTSA-N	522.739	2.950	10	40	KFCB	
O=C(/C=C/c1ccc(O)c2c1[C@@H](C(=O)O)[C@H](c1ccc(O)c(O)c1)O2)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O	4097773	UJZQBMQZMKFSRV-PHQFMFTGSA-N	538.461	2.769	10	40	KFCB	biogenic,in-vitro
CN(C)CCCNc1cc(N2CCN(C(=O)c3ccco3)CC2)c(N)c2c1C(=O)c1ccccc1C2=O	9130675	QKUJVZRMDPAPBP-UHFFFAOYSA-N	501.587	2.963	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2	70699500	VVAJHKDQYMGEMR-ZLEDHLGDSA-N	541.560	2.552	10	40	KFCB	biogenic
CCOC(=O)c1ccc(NC(=O)CN2C(=O)C[C@H](N3C(=O)/C(=C/c4ccccc4)SC3=S)C2=O)cc1	102845023	ZAFLMZXTGGBXQJ-IZILLXMLSA-N	523.592	2.831	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccccc1Cl	409247768	BBNMDNHZZLTVSD-UHFFFAOYSA-N	571.780	2.885	10	40	KFCB	
CCOC(=O)CNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1C	6089328	HTRDNLNCBGIZFP-HSZRJFAPSA-N	552.657	2.574	10	40	KFCB	
CCOC(=O)c1ccc(-c2ccc(/C=C3/C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)o2)cc1	101165174	JAQNRMABNNVGCI-MBYGRGGXSA-N	521.555	2.991	10	40	KFCB	
COc1cc(/C=C2/SC(=S)N(CC(=O)N(CCO)Cc3ccccc3)C2=O)cc(OC)c1OC	8766074	FDCDCDUGSHTDJM-DEDYPNTBSA-N	502.614	2.935	10	40	KFCB	
O=C(O)COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1Br	408951968	NCZIAMRACYSFRO-QDEBKDIKSA-N	523.679	2.961	10	40	KFCB	
Cc1nc2ccc(S(=O)(=O)O)cc2c(=O)n1-c1ccc(C(=O)NN2C(=O)CS[C@H]2c2ccccc2O)cc1	6040277	VYAFCEHZCPOOEY-VWLOTQADSA-N	552.590	2.565	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	101572355	WVRUVXYKXRESME-IBEFWLKCSA-N	577.633	2.527	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	257346726	OPMJIWCAYZDKKJ-HGLRGHGCSA-N	586.040	2.624	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(/C=C3\C(=O)N(C[C@@H]4CCCO4)C(C)=C3C(=O)OC)o2)cc1	409184090	FADGKWYEZWEBSY-MQXJPVLKSA-N	565.579	2.563	10	40	KFCB	
COC(=O)C[C@H](c1ccc(OCC(N)=O)cc1)c1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc12	97971970	OVIYREYKTPRMLS-OAHLLOKOSA-N	537.477	2.547	10	40	KFCB	biogenic
Cc1ccc2nc(N3CCN(Cc4ccc5c(c4)OCO5)CC3)c(/C=C3\SC(=S)N(C)C3=O)c(=O)n2c1	100763064	FTTMXJYLQLNBOE-MTJSOVHGSA-N	535.651	2.885	10	40	KFCB	
COC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1OC	103852124	HTEQHFJASGOZON-KPKJPENVSA-N	523.336	2.980	10	40	KFCB	
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C\c1cc([N+](=O)[O-])ccc1N1CCOCC1	408902851	MGEKIYOCPYKXKB-ATVHPVEESA-N	501.293	2.860	10	40	KFCB	
NC(=O)COc1c(Br)cc(Br)cc1/C=C1/C(=O)NC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	409257422	QUYLVMZLVLISIS-ACAGNQJTSA-N	568.134	2.650	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1ccccc1C	409271765	MVTNRFBFXJLJEZ-UHFFFAOYSA-N	549.321	2.765	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O	254449344	OPMJIWCAYZDKKJ-JGJGYIGKSA-N	586.040	2.624	10	40	KFCB	
COc1cc(N2CCOCC2)ccc1/C=C1\NC(=O)N(CC(=O)Nc2ccc(Br)cc2)C1=O	409242179	NGZUYRDMXQIBLJ-UNOMPAQXSA-N	515.364	2.826	10	40	KFCB	
CCOc1c(I)cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1I	103856483	MGHBSNBSKOAYOG-UHFFFAOYSA-N	556.163	2.893	10	40	KFCB	
CCOC(=O)CNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1	6089353	WTDZSEXDJIBZQA-QHCPKHFHSA-N	552.657	2.574	10	40	KFCB	
CC(/C=C1\SC(=S)N([C@H]2CC(=O)N(c3ccc(S(N)(=O)=O)cc3)C2=O)C1=O)=C\c1ccccc1	16805947	WUPADEVDLVABFU-LJWICLCPSA-N	513.622	2.814	10	40	KFCB	
C[C@H](CCc1ccccc1)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@H]2CCCN32)C1=O	97967960	FYZXSIGZVOXJIX-ZISVAXDRSA-N	583.645	2.731	10	40	KFCB	
O=C(O)COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1I	408910554	KTUSEIJNUJRMEH-AWNIVKPZSA-N	510.215	2.560	10	40	KFCB	
COc1cc(C(=O)NN2C(=O)/C(=C3\SC(=S)N(NC(=O)c4cc(OC)c(OC)c(OC)c4)C3=O)SC2=S)cc(OC)c1OC	150400726	ZFHVTBAKTUNLBR-FMQUCBEESA-N	680.764	2.660	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)CN2C(=O)C[C@@H](N3C(=O)/C(=C\c4ccccc4)SC3=S)C2=O)cc1	97981181	ZAFLMZXTGGBXQJ-LSCADSNKSA-N	523.592	2.831	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)COC(=O)[C@H](Cc2ccccc2)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1	408679014	CAJACENNBSFFLX-ZRBLBEILSA-N	504.539	2.908	10	40	KFCB	
COc1ccc(CCN2C(=O)[C@@H]3[C@H](Cc4ccc(O)c(O)c4)N[C@]4(C(=O)Nc5ccc(Cl)cc54)[C@H]3C2=O)cc1OC	247894868	OHEMAVIQDGBOJN-HUTQFVMSSA-N	578.021	2.974	10	40	KFCB	
Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C2=O)cc1C	409384111	BDCABPPGWMUUAE-XDHOZWIPSA-N	542.386	2.970	10	40	KFCB	
COC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1OC	408777070	VDXFQBDLQFIQSR-OVCLIPMQSA-N	503.305	2.984	10	40	KFCB	
COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc(I)c1O[C@@H](C)C(=O)O	409407249	LXWIYQYCMDYVAM-KSSSLANASA-N	508.268	2.613	10	40	KFCB	
Cc1ccc2nc(N3CCN(CCO)CC3)c(/C=C3\SC(=S)N(Cc4ccc(F)cc4)C3=O)c(=O)n2c1	100861777	CVNAQUZDCOUGAQ-STZFKDTASA-N	539.658	2.658	10	40	KFCB	
Cc1ccc(N2C(=O)[C@H](/C=C3/C(=O)NC(=O)N(c4ccc(Br)c(C)c4)C3=O)C(=O)NC2=S)cc1C	408764410	RUPVGAKLBLQLDJ-LPPOOGIUSA-N	555.410	2.948	10	40	KFCB	
CCOc1ccccc1N1C(=O)/C(=C\c2c(CCN(C)C(C)=O)cc3c(c2OC)OCO3)C(=O)N=C1O	9353833	XHTUELHEYDUVKU-AQTBWJFISA-N	509.515	2.714	10	40	KFCB	biogenic
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(CC(=O)O)C3=O)c(N3CCN(c4ccc(F)cc4)CC3)nc12	100843118	QHAZCFZQHMWRTK-CPNJWEJPSA-N	539.614	2.754	10	40	KFCB	
COc1ccc(N2C(=O)NC(=O)/C(=C/NN3C(=O)c4cccc5c(Br)ccc(c45)C3=O)C2=O)cc1	408526230	AKRNXUFMCTWQSC-BOPFTXTBSA-N	535.310	2.878	10	40	KFCB	
O=C(O)CCCN1C(=O)/C(=C/c2c(NC[C@H](O)c3ccccc3)nc3ccccn3c2=O)SC1=S	13806851	YIOOXBPAPJRQNB-XIDKLXSXSA-N	510.597	2.906	10	40	KFCB	
O=C1/C(=C/c2c(N3CCN(c4ccccc4F)CC3)nc3ccccn3c2=O)SC(=S)N1[C@H]1CCS(=O)(=O)C1	97946858	GQTCRKUQDWPUML-SZHLLGMXSA-N	585.708	2.549	10	40	KFCB	
Cc1cccc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]3CCCN43)C(=O)N=C2O)c1C	97967963	CUANXTZTXASFEI-POEBIKTISA-N	555.591	2.736	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@@H]3C(=O)N(CCc4ccc(OC)c(OC)c4)C(=O)[C@@H]31)C(=O)N2	229652664	KJDQGMIITGVSAH-DINFFJJTSA-N	571.630	2.883	10	40	KFCB	
C[C@H](OC(=O)NCCOCCOCCOCCN=[N+]=[N-])c1cc(CNC(=O)CCOCCOCCOCCOCCNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)ccc1[N+](=O)[O-]	1848432506	APXHNGAQDHMBFB-KVHAFXAUSA-N	914.049	2.657	10	40	KFCB	
CCc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NCCOC)c1ccc(N(C)C)cc1	6135425	HVENVBASDNJMQJ-JOCHJYFZSA-N	524.647	2.603	10	40	KFCB	
CCc1cccc2c(/C=C3\C(=O)N(CC)c4ccc(S(=O)(=O)N5CCOCC5)cc43)cn(CC(N)=O)c12	8778077	QQVTVWFLWDXFGU-UCQKPKSFSA-N	522.627	2.617	10	40	KFCB	
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)N/C=C1\C(=O)NC(=O)N(c2ccc(I)cc2)C1=O	97967998	QOFYDJSPNGPBTG-XYSGSMRZSA-N	558.332	2.613	10	40	KFCB	
COc1cc(NS(=O)(=O)c2ccc(N/C=C3/C(=O)NC(=O)N(c4cccc(Cl)c4)C3=O)cc2)nc(OC)n1	8429925	PKCAGNUUKGQAGF-ATVHPVEESA-N	558.960	2.527	10	40	KFCB	
CCCCCCN1C(=O)/C(=C/c2c(N3CCN(CCO)CC3)nc3ccc(C)cn3c2=O)SC1=S	20065195	BHBUXZYKSIQTGB-SILNSSARSA-N	515.705	2.899	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1ccc(C)c(C)c1	409272026	XTHIAAJKKAIKDX-UHFFFAOYSA-N	549.321	2.684	10	40	KFCB	
CCOC(=O)COc1c(I)cc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1OCC	409374463	QGYFWSTWAWWXTO-OVCLIPMQSA-N	568.320	2.887	10	40	KFCB	
Cc1cc(O)c2c(c1)C(=O)c1c(c(O)cc(O)c1-c1c(O)cc(O)c3c1C(=O)c1cc(CO)cc(O)c1C3=O)C2=O	85636823	BTHHWOXILLICEL-UHFFFAOYSA-N	554.463	2.939	10	40	KFCB	biogenic,in-vitro
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CSc1ccccc1)C[C@H]3O[C@H]1C[C@@H](N)[C@H](O)[C@H](C)O1	150388724	WXRBTXBZCINPCH-LPHIRMSZSA-N	635.691	2.801	10	40	KFCB	
COc1ccc(OCCOc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(C)(=O)=O)cc2)cc1	20205924	OGKYSPKRENMKPP-JJEZRMFNSA-N	500.558	2.774	10	40	KFCB	
CCOC(=O)N1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(Cc3ccco3)C2=O)CC1	100863846	JNMGCYFGERKLJF-JXAWBTAJSA-N	525.612	2.967	10	40	KFCB	
CCOc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)ccc1OS(=O)(=O)c1ccc(C)cc1	101393786	LWZDUNRYTXGSPJ-GJXXPDGXSA-N	548.624	2.783	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\Nc3cc4c(cc3N(CC)CC)n(C)c(=O)n4C)C2=O)cc1	408528359	FUZZTOKGCUAVMH-OBGWFSINSA-N	506.563	2.701	10	40	KFCB	
Cc1c(Br)ccc(N2C(=O)NC(=O)/C(=C\Nc3cc4nc(O)[nH]c4cc3N3CCN(C)CC3)C2=O)c1C	408533149	ODLOVPKZSLDSLR-NTCAYCPXSA-N	568.432	2.978	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OCC(=O)N4CCOCC4)c(OCC)c3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409154148	NXIXJTZUWNUXCC-BFOKUZPWSA-N	634.755	2.501	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4ccc(OC)cc4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19940446	MNTFFUJFVPWTIV-JYFHCDHNSA-N	531.617	2.622	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2	5811940	XFZJEEAOWLFHDH-CTWGYRKFSA-N	578.526	2.995	10	40	KFCB	biogenic,in-vitro
COc1ccccc1-n1c(C)cc(/C=C2\C(=N)N3N=C(CC(=O)N4CCOCC4)SC3=NC2=O)c1C	9282633	YAWRVJRVOAQUHZ-WZHFLWTNSA-N	506.588	2.971	10	40	KFCB	
C[C@@H](CCc1ccccc1)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@H]2CCCN32)C1=O	97967959	FYZXSIGZVOXJIX-GZMFWOMFSA-N	583.645	2.731	10	40	KFCB	
O=C(O)CCN1C(=O)/C(=C\c2c(N3CCN(c4ccccc4F)CC3)nc3ccccn3c2=O)SC1=S	100860365	OZAMZCMIURCMAB-XDJHFCHBSA-N	539.614	2.836	10	40	KFCB	
O=C(O)CCN1C(=O)/C(=C/c2c(N3CCN(c4ccccc4)CC3)nc3ccccn3c2=O)SC1=S	16734282	KYMQOTKSALJZDJ-MNDPQUGUSA-N	521.624	2.697	10	40	KFCB	
CCc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\Nc2cc3c(cc2[N+](=O)[O-])n(C)c(=O)n3C)C1=O	408527583	DRHGLHRJKPYNAX-JLHYYAGUSA-N	543.334	2.689	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1cccc(C)c1	409045194	HZULBFLLIGQERI-UHFFFAOYSA-N	551.362	2.540	10	40	KFCB	
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(N(C)C)cc2)cc1	6089825	QYFVFBLZFPTWFB-QPPBQGQZSA-N	566.684	2.972	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(Cc4ccc(F)cc4)C3=O)c(NCCOCCO)nc12	8834817	ZYTQUAFTFRCGJD-UYRXBGFRSA-N	514.604	2.964	10	40	KFCB	
COc1cc(/C=C2/C(=O)NN(c3ccc(F)cc3)C2=O)ccc1OS(=O)(=O)c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1	100165282	PJSNKSZOCDGHJD-YVLHZVERSA-N	558.456	2.880	10	40	KFCB	
COc1ccc(C(=O)Oc2ccc(/C=C3/C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)cc2)cc1	101096873	SLAOTBCUFPYYQF-ICALIKLASA-N	533.566	2.782	10	40	KFCB	
Cc1cc(Br)c(N2C(=O)NC(=O)/C(=C/Nc3cc4c(cc3[N+](=O)[O-])n(C)c(=O)n4C)C2=O)cc1C	408532372	MMINENHFQJEPGW-XFXZXTDPSA-N	543.334	2.743	10	40	KFCB	
CCC(C)(C)NC(=O)[C@H](c1ccc(N(C)C)cc1)N(Cc1cccnc1)C(=O)c1snc(C(N)=O)c1N	6077449	NAYQEEFKKIDELR-NRFANRHFSA-N	523.663	2.974	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4cc(OC)ccc4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19940671	VGPDJZRKTGNLHW-OZXSUGGESA-N	531.617	2.622	10	40	KFCB	
CN1C(=O)/C(=C/c2c(N3CCN(Cc4ccc5c(c4)OCO5)CC3)nc3ccccn3c2=O)SC1=S	20149988	PBBXYKMENMIANJ-MOSHPQCFSA-N	521.624	2.576	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1	6135872	SEWNDRMHHBRPMX-JTSKRJEESA-N	540.621	2.713	10	40	KFCB	
O=C1/C(=C/c2c(N3CCc4ccccc4C3)nc3ccccn3c2=O)SC(=S)N1[C@@H]1CCS(=O)(=O)C1	101231059	FZIJJKBDLJWLMG-RXWSAZGZSA-N	538.676	2.646	10	40	KFCB	
O=C(CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)Nc3ccc(C(=O)O)c(O)c3)C2=O)SC1=S)Nc1ccc(C(=O)O)c(O)c1	150415224	RCYWXYRBSHVHNR-FMQUCBEESA-N	676.732	2.784	10	40	KFCB	
O=C(COc1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1cccc2c1C(=O)c1ccccc1C2=O	12561416	YLPDKFFLCKJRJX-UHFFFAOYSA-N	506.536	2.500	10	40	KFCB	
O=C(/C=C/c1ccc(O)c2c1[C@@H](C(=O)O)[C@@H](c1ccc(O)c(O)c1)O2)O[C@@H](Cc1ccc(O)c(O)c1)C(=O)O	226444248	UJZQBMQZMKFSRV-IJUXTCFMSA-N	538.461	2.769	10	40	KFCB	
CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C/c1ccc(CNC(=O)C(=O)Nc2ccc(C)c(C)c2)o1	409011335	GCTJERPAKRFPTC-HYARGMPZSA-N	509.559	2.860	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccc(C)cc1	409224949	MSOQUYWBLWBGET-UHFFFAOYSA-N	551.362	2.540	10	40	KFCB	
COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)[C@@H](Cc2ccccc2)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	408691206	YURRUKCVTUVARK-XQBPLPMBSA-N	507.499	2.648	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)c(Br)cc1OCC(=O)Nc1ccccc1	408908327	BSFOFOPMBKGIPL-RIYZIHGNSA-N	504.362	2.732	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(C)cc1	409218319	HYMOTSQKJIGQMK-UHFFFAOYSA-N	502.321	2.923	10	40	KFCB	
CCCOc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(N)=O)c(Br)c3)C2=O)cc1OC	409224621	KYJRFNRNOFNXKK-OQLLNIDSSA-N	532.347	2.777	10	40	KFCB	
CCN(CCO)C(=O)CCCCCN1C(=O)/C(=C2\SC(=S)N(CCCCCC(=O)N(CC)CCO)C2=O)SC1=S	101002500	VDHFYUCUCAVAME-QURGRASLSA-N	632.896	2.721	10	40	KFCB	
CN1CCN(c2cc3[nH]c(O)nc3cc2N/C=C2\C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)CC1	408536726	XPEIOWNMCRJXEN-OBGWFSINSA-N	511.542	2.752	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCCC(=O)O)C3=O)c(N3C[C@@H](C)O[C@H](C)C3)nc12	16741564	CJAJITXNFYZALM-IGIWSDCRSA-N	502.618	2.683	10	40	KFCB	
CC(/C=C1\SC(=S)N([C@@H]2CC(=O)N(c3ccc(S(N)(=O)=O)cc3)C2=O)C1=O)=C\c1ccccc1	100912632	WUPADEVDLVABFU-BEUYGYBQSA-N	513.622	2.814	10	40	KFCB	
O=C(O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1Br	409371749	HCURLWNQRROOBX-NYYWCZLTSA-N	528.109	2.930	10	40	KFCB	
CCOC(=O)C1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)CC1	100860981	IUBFOMNDWSBHKN-FJSNCCPHSA-N	528.656	2.854	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc(I)c1OCC(=O)O	103844206	CJTLDVPPOFCWKR-WLRTZDKTSA-N	580.287	2.548	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCN(C)CC4)c([N+](=O)[O-])c3)c(=O)n2[C@@H]1c1cc(OC)ccc1OC	409092606	XGYAWNRJDAIYNT-LAUBZIAYSA-N	634.759	2.781	10	40	KFCB	
CN(c1nc2ccccn2c(=O)c1/C=C1\SC(=S)N([C@H]2CCS(=O)(=O)C2)C1=O)C1CCCCC1	8781012	BIKUNLHRKBCUHS-CQUHBBLWSA-N	518.686	2.852	10	40	KFCB	
Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]3CCCN43)C(=O)N=C2O)c(C)c1	97968150	HISIBDXFXOVFTN-POEBIKTISA-N	555.591	2.736	10	40	KFCB	
O=C(CN1C(=O)/C(=C2/SC(=S)N(CCS(=O)(=O)O)C2=O)c2ccccc21)Nc1cccc(Br)c1	1904075	IQWKHNPYLCUEJX-ISLYRVAYSA-N	582.479	2.894	10	40	KFCB	
COc1ccc(N2CCN(C(=O)COC(=O)COc3ccc(I)cc3)CC2)cc1	72331024	MXAOGFQXJITNLN-UHFFFAOYSA-N	510.328	2.571	10	40	KFCB	
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CSC(=O)c1ccccc1)C[C@H]3O[C@H]1C[C@@H](N)[C@H](O)[C@H](C)O1	150388716	JJXYGMBBVYMPBI-QKLMOIAFSA-N	663.701	2.583	10	40	KFCB	
CCn1c(=O)/c(=C2/Sc3ccc(OC)cc3N2C)s/c1=C1/C(=O)N(c2ccc(S(=O)(=O)O)cc2Cl)N=C1C	100521018	VQVKWYKBMAEHIQ-CBAIGBLSSA-N	593.108	2.720	10	40	KFCB	
CCOC(=O)COc1c(I)cc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)cc1OC	408692495	NTJNQMJEYOBYQG-RIYZIHGNSA-N	542.326	2.646	10	40	KFCB	
CCc1nn2c(=O)cc(COc3ccc(/C=C4/C(=N)N5N=C(C)SC5=NC4=O)cc3OC)nc2s1	41107975	AAEUNBVHVXJBRE-PASMBLJUSA-N	509.573	2.940	10	40	KFCB	
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H](Cc4ccc(O)c(O)c4)N[C@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1	101334857	KXFBVFVJPXOQQG-BMEWAZJXSA-N	547.951	2.844	10	40	KFCB	
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NCCOC)c2ccc(N(C)C)cc2)cc1	6134774	JYKDHFWVYBWOMD-JOCHJYFZSA-N	524.647	2.603	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N(C)C)cc3)c(=O)n2[C@H]1c1ccc(OC)cc1OC	6354116	UMNDFHWTALFGQT-XPCGLTFESA-N	507.612	2.882	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	408735340	NOYZYGSEVCRMKG-UHFFFAOYSA-N	507.209	2.816	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OC)c(OC)c3OC)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	8450450	WISRDYRPLKAWCE-QFVBLGFASA-N	537.638	2.890	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(Br)c1OCC(=O)Nc1ccc(F)cc1	408912611	RHARAHJHOPUBSR-VGOFMYFVSA-N	522.352	2.871	10	40	KFCB	
COCCN1C(=O)/C(=C/c2c(N3CCN(c4ccccc4)CC3)nc3ccccn3c2=O)SC1=S	8827825	VFXUVCKDZDBLHU-JZJYNLBNSA-N	507.641	2.869	10	40	KFCB	
COc1c2c(cc3c1[C@H](CN/C=C1\C(=O)NC(=S)N(c4ccc(Br)cc4)C1=O)N(C)CC3)OCO2	70673678	CPGSATOWKWGYHF-KGZWWPETSA-N	559.442	2.637	10	40	KFCB	biogenic
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CSC(=O)c1ccccc1)C[C@H]3O[C@H]1C[C@@H](N)[C@@H](O)[C@@H](C)O1	150388713	JJXYGMBBVYMPBI-LTMDWZNUSA-N	663.701	2.583	10	40	KFCB	
COc1c(C=C2C(=O)N(C)C(=O)N(C)C2=O)c(CCN(C)C(=S)NC2CCCCC2)cc2c1OCO2	2152737	DIGJKPFAVITJTB-UHFFFAOYSA-N	516.620	2.539	10	40	KFCB	biogenic
COC(=O)c1ccc(N2C(=O)NC(=O)/C(=C/c3cccc(OS(=O)(=O)c4ccccc4)c3)C2=O)cc1	409075473	ZBVWLANBGFIWIC-QNGOZBTKSA-N	506.492	2.907	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1cc(C)ccc1C	409261024	ADPROEXLOZIQMJ-UHFFFAOYSA-N	502.321	2.841	10	40	KFCB	
CS(=O)(=O)C1=NSC2=NC(=O)/C(=C\c3ccc(OS(=O)(=O)c4ccccc4)c(Cl)c3)C(=N)N21	97964520	SYXFCYAZIXNTCH-XCGHDDSDSA-N	524.989	2.729	10	40	KFCB	
Cc1c(Br)ccc(N2C(=O)NC(=O)/C(=C\Nc3cc4c(cc3[N+](=O)[O-])n(C)c(=O)n4C)C2=O)c1C	408536776	XZFIPEWWFYMSPB-FMIVXFBMSA-N	543.334	2.743	10	40	KFCB	
O=C(NC[C@@H]1CCCO1)[C@H](c1ccc(N2CCOCC2)cc1)N(Cc1ccco1)C(=O)Cn1nnc2ccccc21	100336663	FCLNGUQOXUOSQY-OUTSHDOLSA-N	558.639	2.926	10	40	KFCB	
NC(=O)COc1c(Br)cc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O	409265239	TYIHYIWCTFPBQA-MLPAPPSSSA-N	568.134	2.650	10	40	KFCB	
COc1ccc(N2CCN(C(=O)CSc3nnc4c(=O)n(Cc5ccc(F)cc5)ccn34)CC2)cc1	49421441	XYNIRYHTBPSTBM-UHFFFAOYSA-N	508.579	2.528	10	40	KFCB	
COc1ccc(N2CCN(c3nc4c(c(=O)n(C)c(=O)n4C)n3CCSc3nc4ccccc4o3)CC2)cc1	97957508	RFFCQYFJEDFFCA-UHFFFAOYSA-N	547.641	2.702	10	40	KFCB	
COc1cc(/C=C2/C(=O)NC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(I)c1O	575443458	FOTRRONFKBICTR-XGICHPGQSA-N	509.212	2.580	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1c1ccc2c(c1)OCO2	101329795	ACZWXHOAECGOCZ-SCPSAXBQSA-N	533.924	2.648	10	40	KFCB	
CCc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C2=O)cc1	409375297	IOWPNDPXDCYWRM-CPNJWEJPSA-N	542.386	2.916	10	40	KFCB	
CCOc1cccc(N2C(=O)NC(=O)/C(=C/c3cn(CC(=O)N4CCOCC4)c4ccccc34)C2=O)c1	9259935	FPGBOAFEBLHQHK-HMAPJEAMSA-N	502.527	2.565	10	40	KFCB	
Cc1cc(S(N)(=O)=O)ccc1N/C=C1\C(=O)NC(=O)N(c2ccc(Br)c(C)c2C)C1=O	408527956	GWCMLXFSNRXUSD-NTEUORMPSA-N	507.366	2.601	10	40	KFCB	
COC(=O)c1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Br)c(OCC(N)=O)c(Br)c3)C2=O)cc1	409227307	UXDZYBBSKSRFNT-AWNIVKPZSA-N	581.173	2.529	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1ccc(C)cc1C	409263641	NIASTLRLPDTSQW-UHFFFAOYSA-N	549.321	2.684	10	40	KFCB	
NC(=O)C1CCN(c2nc3ccccn3c(=O)c2/C=C2/SC(=S)N(Cc3ccccc3)C2=O)CC1	33363958	ZSYZMGDBFXWHFD-XMHGGMMESA-N	505.625	2.798	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCC(N(C)C)CC4)o3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	105499862	HTODPSHSLGITBB-UXAZKMGBSA-N	563.724	2.988	10	40	KFCB	
CNS(=O)(=O)c1ccc(N/C=C2\C(=O)NC(=O)N(c3ccc(Br)c(C)c3C)C2=O)cc1	408530722	JMDJGDPQJATUBY-XNTDXEJSSA-N	507.366	2.553	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(NCCO)nc4c(C)cccn4c3=O)SC2=S)cc1OC	44460014	STHMJRUMVRDNEN-ZHZULCJRSA-N	526.640	2.868	10	40	KFCB	
Cc1c(C(=O)N2CCOCC2)sc2[nH]cnc(=NC3CCN(Cc4ccc(O)c(CN(C)C)c4)CC3)c12	585293473	XWGYJZSAIKPSTG-UHFFFAOYSA-N	524.691	2.738	10	40	KFCB	
Cc1ccc(N2C(=O)[C@H](/C=C3\C(=O)NC(=O)N(c4ccc(C)c(Cl)c4)C3=O)C(=O)NC2=S)cc1C	408989218	SONHQBPZYAJLIT-BRVCPTFNSA-N	510.959	2.839	10	40	KFCB	
NC(=O)COc1c(Br)cc(/C=C2/C(=O)NC(=S)N(c3ccccc3)C2=O)cc1Br	409252079	SCVRWBRXUUFYHC-SDQBBNPISA-N	539.205	2.907	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1cc(C)ccc1C	409255868	LNMHREBKAPAGJB-UHFFFAOYSA-N	549.321	2.684	10	40	KFCB	
CCCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Br)c(OCC(N)=O)c(OC)c3)C2=O)cc1OC	409225915	SSFMXDZKSLQSHY-OVCLIPMQSA-N	562.373	2.786	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(Br)c1OCC(=O)O	409045575	ZJINUKCCUQZLJC-MKMNVTDBSA-N	534.275	2.886	10	40	KFCB	
O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(OCC(=O)N2CCOCC2)cc1	409231179	IODMKLXXJZWVBR-FOWTUZBSSA-N	504.326	2.897	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(Cc4ccc(F)cc4)C3=O)c(N3CCN(CCO)CC3)nc12	100849253	JILGZMSHBLOMRY-QNGOZBTKSA-N	539.658	2.658	10	40	KFCB	
COC(=O)C1=C(C)N(Cc2cccnc2)C(=O)/C1=C\c1ccc(CNC(=O)C(=O)Nc2ccccc2)o1	409185834	QZKHFCREUKACJQ-XKZIYDEJSA-N	500.511	2.802	10	40	KFCB	
Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]3CCCN43)C(=O)N=C2O)c(C)c1	97968151	HISIBDXFXOVFTN-YSSBIZNGSA-N	555.591	2.736	10	40	KFCB	
CCOC(=O)C1CCN(c2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(CCCC(=O)O)C2=O)CC1	97946771	OMOKHHNYJMEQEN-JXAWBTAJSA-N	544.655	2.848	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc(OC(C)=O)cc4)C(=O)[C@H]31)C(=O)N2	70701248	DEYSWADUDUVMAW-SHJMPOBASA-N	541.560	2.753	10	40	KFCB	biogenic
COc1ccc(CCN2C(=O)[C@@H]3[C@H](Cc4ccc(O)c(O)c4)N[C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@H]3C2=O)cc1OC	247894861	OHEMAVIQDGBOJN-FMNOFHGLSA-N	578.021	2.974	10	40	KFCB	
COc1ccc(N2CCN(C(=O)[C@@H](Cc3ccccc3)NS(=O)(=O)c3ccc(OC)c(OC)c3)CC2)cc1	59929408	VRQCNTSTDYVMEJ-RUZDIDTESA-N	539.654	2.951	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(CCc4ccc(OC)c(OC)c4)C(=O)[C@H]31)C(=O)N2	70705927	KJDQGMIITGVSAH-IVIDABRESA-N	571.630	2.883	10	40	KFCB	biogenic
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc(I)c1OCC(=O)O	408767793	OJAGLNPLPAYJGU-VGOFMYFVSA-N	536.278	2.738	10	40	KFCB	
NC(=O)COc1c(Br)cc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2)C1=O	409255738	IOFWPNGRHNDLDM-QPEQYQDCSA-N	523.137	2.742	10	40	KFCB	
Cc1ccc(N2C(=O)NC(=O)/C(=C/[C@@H]3C(=O)NC(=S)N(c4ccc(Cl)cc4)C3=O)C2=O)cc1Cl	409335086	JSKNZNMVTAAQMT-KQGZCTBQSA-N	517.350	2.875	10	40	KFCB	
COC(=O)C[C@@H](c1ccc2c(c1)n(C)c(=O)n2C)c1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc12	97972042	RSNQAKWUNCACST-AWEZNQCLSA-N	548.504	2.873	10	40	KFCB	biogenic
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1CC(OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)O)C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1O	195856178	MSKVJEAKVWAQTA-JFPZSYFPSA-N	678.599	2.705	10	40	KFCB	biogenic,in-vitro
COC(=O)c1cc(C(=O)OC)cc(N2C(=O)[C@@H]3[C@@H](c4ccccc4)OC4(C(=O)c5ccccc5C4=O)[C@H]3C2=O)c1	250365742	JLRILKQBCDQYDO-YTFSRNRJSA-N	539.496	2.955	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(I)c1O	408934608	BKPBKGJDRMJTRD-WUXMJOGZSA-N	509.212	2.580	10	40	KFCB	
COC(=O)c1ccc(CN2C(=O)N/C(=C\c3cc(C)n(-c4ccc(OCC(=O)N5CCOCC5)cc4)c3C)C2=O)o1	409402523	WDJCNQRPEVZGSX-IWIPYMOSSA-N	562.579	2.804	10	40	KFCB	
COc1ccc(Cn2c(=O)[nH]c3cc(C(=O)NCCCN4CCN(c5ccc(OC)cc5)CC4)ccc3c2=O)cc1	4766451	XYKVSCGPUKCRQV-UHFFFAOYSA-N	557.651	2.697	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2	26490624	XFZJEEAOWLFHDH-PWWSGAPCSA-N	578.526	2.995	10	40	KFCB	
CCOC(=O)c1ccc(N2C(=O)NC(=O)/C(=C\c3cc(I)c(O)c(OC)c3)C2=O)cc1	408899470	PRCJDTMYWNWNOM-RIYZIHGNSA-N	536.278	2.849	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CC(=O)O)C3=O)c(N3CCN(c4ccccc4F)CC3)nc12	97947282	UKSOSMMPAVEXCM-UYRXBGFRSA-N	539.614	2.754	10	40	KFCB	
O=C(CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)Nc3cccnc3)C2=O)SC1=S)Nc1cccnc1	100431243	OWFPKWDUGPSSKM-ISLYRVAYSA-N	558.692	2.766	10	40	KFCB	
O=c1c(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)coc2c(CN3CCCCCC3)c(O)c(CN3CCCCCC3)c(O)c12	150345052	LBACSYOIVLDBSI-BEYFWPOZSA-N	654.757	2.802	10	40	KFCB	
Cc1ccc(N2C(=O)NC(=O)/C(=C\NN3C(=O)c4cccc5c(N6CCOCC6)ccc(c45)C3=O)C2=O)c(C)c1	408530103	LCEDXPISZBNUOK-RCCKNPSSSA-N	539.548	2.561	10	40	KFCB	
COc1cc(/C=C2/SC(=S)N(CC(=O)O)C2=O)ccc1OS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1	409333766	VQOQTYHFKSHVHI-CAOOACKPSA-N	524.554	2.965	10	40	KFCB	
O=C(COC(=O)/C=C/c1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O	97979396	NCTFFRFRUSRKJP-KPKJPENVSA-N	560.584	2.678	10	40	KFCB	
O=C1NC(=S)N(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(OCC(=O)N2CCOCC2)cc1	409235625	COVHGLWQDUKGMG-CPNJWEJPSA-N	530.400	2.518	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc(OC)c(OC)cc3OC)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	8450452	AWHFLDQEBGAICK-ZDGAQAAHSA-N	537.638	2.890	10	40	KFCB	
CCN1C(=O)/C(=C\c2cn(CC(=O)NC[C@H]3CCCO3)c3ccccc23)c2cc(S(=O)(=O)N3CCOCC3)ccc21	8778050	CXXNPTBXOJFVRZ-JMTCZITHSA-N	578.691	2.865	10	40	KFCB	
Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)c(C)n1-c1cc(C(=O)O)cc(C(=O)O)c1	408818700	QEWSCHGNNGRRQY-DJKKODMXSA-N	517.450	2.886	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc(Br)c1OCC(=O)O	409059703	XEYSAMVBKOYXGC-VGOFMYFVSA-N	505.277	2.683	10	40	KFCB	
Nc1nc(N)c(/N=N\c2ccc(S(=O)(=O)c3ccc(/N=N\c4c(N)nc(N)nc4O)cc3)cc2)c(O)n1	104090966	UNBYTCZXPDCWTG-SZDCHMHBSA-N	522.511	2.670	10	40	KFCB	
CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc(Br)c1OCC(=O)N1CCOCC1	409404501	DITHAMZCMLPRQZ-PDGQHHTCSA-N	530.375	2.547	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(I)c(OCC(N)=O)c(OCC)c3)C2=O)cc1	409223255	GJDWFXHRHOMAQE-CXUHLZMHSA-N	579.347	2.619	10	40	KFCB	
CCOc1ccc(N2C(=O)/C(=C/c3cn(CC(=O)NCCOC)c4ccccc34)C(=O)NC2=S)cc1	6089857	JHFGCUDNDIKOER-KGENOOAVSA-N	506.584	2.634	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc(OC(C)=O)cc4)C(=O)[C@H]31)C(=O)N2	70701242	DEYSWADUDUVMAW-QXQHHZKDSA-N	541.560	2.753	10	40	KFCB	biogenic
Cc1ccc2nc(N3CCN(CCO)CC3)c(/C=C3\SC(=S)N(CCc4ccccc4)C3=O)c(=O)n2c1	100861774	PZNIHUSVTUIDDK-XLNRJJMWSA-N	535.695	2.561	10	40	KFCB	
CCOC(=O)COc1ccc(/C=c2\sc3n(c2=O)[C@@H](c2ccc(N(C)C)cc2)C(C(=O)OCC)=C(C)N=3)cc1	408921402	BYEZICQJBCIJQC-VFHYMGCCSA-N	549.649	2.806	10	40	KFCB	
CCOc1ccccc1N1C(=O)/C(=C/c2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@H]2CCCN32)C(=O)N=C1O	97967839	IDSLIDSIAHXGRD-QYAIIROKSA-N	571.590	2.518	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(Cc2ccccc2)C(=O)c2snc(C(N)=O)c2N)cc1	6135873	KCTAERDGUNBAKQ-OFNKIYASSA-N	536.658	2.569	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/[C@@H]3C(=O)N(c4ccccc4)N=C3C)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409018319	UJACRZPYKZVRPV-QEPKQSKUSA-N	543.649	2.855	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4cc(C)ccc4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19826199	VGCIZXMTXLOGCZ-JYFHCDHNSA-N	515.618	2.922	10	40	KFCB	
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H](Cc4ccc(O)c(O)c4)N[C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1	101334853	KXFBVFVJPXOQQG-GXCDUKDASA-N	547.951	2.844	10	40	KFCB	
CC1CCN(Cc2c(O)c(CN3CCC(C)CC3)c3occ(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)c(=O)c3c2O)CC1	79209890	QAJXTOOWSRMGOV-BEYFWPOZSA-N	654.757	2.514	10	40	KFCB	biogenic
CCc1nnc(NS(=O)(=O)c2ccc(N/C=C3/C(=O)NC(=O)N(c4cccc(C)c4)C3=O)cc2)s1	95471568	XMFIWLDRHUPPHN-ATVHPVEESA-N	512.573	2.789	10	40	KFCB	
CCCCCCN1C(=O)/C(=C/c2c(N3CCNC(=O)[C@@H]3CC(=O)OC)nc3ccc(C)cn3c2=O)SC1=S	97967697	IEQUZPWQNQBCAE-UZNZLNSGSA-N	557.698	2.652	10	40	KFCB	
COC(=O)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)cc1OC	408762077	MSTHJTRWDGFDCS-OQLLNIDSSA-N	503.305	2.984	10	40	KFCB	
C[C@@H](OC(=O)NCCOCCOCCOCCN=[N+]=[N-])c1cc(CNC(=O)CCOCCOCCOCCOCCNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)ccc1[N+](=O)[O-]	1848432507	APXHNGAQDHMBFB-PNLVOXHDSA-N	914.049	2.657	10	40	KFCB	
C[C@H]1COCCCCC2(CCN(C(=O)Cn3c4c(c5ccccc53)CCC4)CC2)C(=O)N[C@@H](C)C(=O)N1	643564082	FMILWXLDDKCCSZ-SFTDATJTSA-N	508.663	2.949	10	40	KFCB	
CC(C)[C@H](NS(=O)(=O)c1ccccc1)C(=O)OCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O	12542144	HZLBTQMHPBDEGE-DEOSSOPVSA-N	520.563	2.947	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc(I)c(OCC(=O)O)c(OC)c3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	408828641	IJVONULGHCLODQ-NIQJEMAJSA-N	677.517	2.941	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc(Br)c1OCC(N)=O	409217334	BLKOLCLOGVJKME-VGOFMYFVSA-N	506.284	2.517	10	40	KFCB	
COc1ccc(N2CCN(C(=O)CN3CCN(S(=O)(=O)c4ccc(C(C)(C)C)cc4)CC3)CC2)cc1	12550499	CVXVEZDHIUJRRE-UHFFFAOYSA-N	514.692	2.648	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4ccc(C)cc4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19940602	XQROCJMXCGCQBS-JYFHCDHNSA-N	515.618	2.922	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc(OC(C)=O)cc4)C(=O)[C@H]31)C(=O)N2	70701240	DEYSWADUDUVMAW-ZCTJEENXSA-N	541.560	2.753	10	40	KFCB	biogenic
CCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(/C=C3/C(=O)N(Cc4cccnc4)C(C)=C3C(=O)OC)o2)cc1	408910506	WYHGXOXDGOGRMF-ZVHZXABRSA-N	572.574	2.979	10	40	KFCB	
CCNC(=O)C[C@@H]1CCN2C[C@@H]1C=CCOc1ccc(N(C)CCc3ccccn3)cc1CNCC2=O	958317641	AWPQLJOGIUTHIM-GOTSBHOMSA-N	505.663	2.790	10	40	KFCB	
Cc1cc(C(=O)COC(=O)CNS(=O)(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)c(C)n1-c1ccccc1	12546886	WMJDBVINOJUDML-UHFFFAOYSA-N	514.560	2.773	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OCC(=O)N4CCCC4)cc3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409165147	TVYRSUHZAIAAFO-RFZPLYKNSA-N	574.703	2.866	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)cc(I)c1OCC(=O)O	409043818	ASMOATACMVCGCH-OVCLIPMQSA-N	566.304	2.828	10	40	KFCB	
O=C1NC2(CCOc3cc(-c4cccnc4)ccc3S(=O)(=O)N3C[C@H](O)C[C@@H]13)CCN(Cc1ccccc1O)CC2	1548890542	RXJBIMBRYPCATD-RPBOFIJWSA-N	578.691	2.512	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(N4CCOCC4)nc4ccccn4c3=O)SC2=S)cc1OC	29747429	IQXVOZFMPBKRIK-PGMHBOJBSA-N	538.651	2.992	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N([C@@H]4CCS(=O)(=O)C4)C3=O)c(NCCCOC(C)C)nc12	101002948	OCSMODLSGAFSKS-UWCCDQBKSA-N	536.701	2.618	10	40	KFCB	
CC(C)OC(=O)[C@@H](C(=O)C(F)(F)F)c1cc(NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)ccc1O	6142832	QGXLOGAUGAFKPL-QGZVFWFLSA-N	516.450	2.805	10	40	KFCB	
Oc1c(I)cc(I)cc1CNC[C@H](O)CN1CCCCC1	48277682	KEWDGKZLJQPOGB-ZDUSSCGKSA-N	516.161	2.538	10	40	KFCB	
CN1CCN(C(=O)C[C@@H]2CCN3C[C@@H]2CCCOc2ccc(N(C)CCc4ccccn4)cc2CNCC3=O)CC1	72320729	CISPRTVEXMZHEV-UIOOFZCWSA-N	562.759	2.652	10	40	KFCB	
COCCCN1C(=O)/C(=C/c2ccc(CNC(=O)C(=O)Nc3ccc(C)c(C)c3)o2)C(C(=O)OC)=C1C	408871507	GYHDKZZGGOFNJS-HYARGMPZSA-N	509.559	2.860	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3ccc(C(=O)N4CCOCC4)cc3)C2=O)ccc1Br	408529115	IHURTOOXEGHQTO-QGOAFFKASA-N	513.348	2.809	10	40	KFCB	
COc1ccc(N2CCN(Cc3cc(=O)c(OC)cn3CC(=O)Nc3cccc([N+](=O)[O-])c3)CC2)cc1	22698789	SNTRQOQACHZYKU-UHFFFAOYSA-N	507.547	2.735	10	40	KFCB	
CN1CCN(c2ccc(CNS(=O)(=O)c3nnc(NC(=O)c4ccccc4Cl)s3)cc2)CC1	225148332	JWAQVBRSJQZBJO-UHFFFAOYSA-N	507.041	2.674	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(N4CCOCC4)nc4ccccn4c3=O)SC2=S)cc1	1482220	MKHYEZOMZTZTPA-SILNSSARSA-N	508.625	2.984	10	40	KFCB	
COc1cc(/C=C2/C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc(I)c1OCC(=O)O	408919613	ZBIVBPFWWITDMQ-MLPAPPSSSA-N	556.309	2.734	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3/C(=O)N(CC)c4ccccc43)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409161741	PHJFECRESLBLQN-AYWGPLOBSA-N	516.623	2.601	10	40	KFCB	
CN(C)c1ccc(/C=c2\sc3n(c2=O)N[C@]2(c4ccccc4)N(C)C(=O)N(C)[C@@]2(c2ccccc2)N=3)cc1	8690324	JETDYKDVQXDARZ-ASNYDUROSA-N	524.650	2.685	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)ccc1OCc1ccc2c(c1)OCO2	41077815	SGQRZKNSWPCLHY-PASMBLJUSA-N	514.541	2.624	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	70705366	HPHNEOJMOVENCK-HZOXQMALSA-N	561.978	2.999	10	40	KFCB	biogenic
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3cc4nc(O)[nH]c4cc3N3CCN(C)CC3)C2=O)c(C)cc1Br	408532440	MRKAEVCERIHLRH-NTCAYCPXSA-N	568.432	2.978	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(CCc4ccc(OC)c(OC)c4)C(=O)[C@H]31)C(=O)N2	70705931	KJDQGMIITGVSAH-YPZQFWFNSA-N	571.630	2.883	10	40	KFCB	biogenic
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	101572364	WVRUVXYKXRESME-MCSHSMJGSA-N	577.633	2.527	10	40	KFCB	
Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3C[C@@H](O)CN3S(=O)(=O)c3ccccc3[N+](=O)[O-])c2C)cc1	103128848	FWEYHHWNNREBBK-OFNKIYASSA-N	541.582	2.861	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C/c3ccc(Br)s3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	150390312	INTTWHIIIGFJPG-UEVWUPRXSA-N	636.520	2.795	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1ccc(OC)c(OC)c1	409065968	GNOMCVIQRHOFAG-OCEWKHMESA-N	549.649	2.652	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc(I)c1OCC(N)=O	409222519	DOTMJFWPTPTROD-VGOFMYFVSA-N	614.190	2.983	10	40	KFCB	
COc1ccc(/C=C/c2ccnc(NS(=O)(=O)c3ccc(NC=C4C(=O)N(C)C(=O)N(C)C4=O)cc3)n2)cc1OC	100424701	WYBUWMNPSWJSPI-FNORWQNLSA-N	578.607	2.811	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)c(Br)cc1OCc1ccc(C(=O)O)cc1	408910458	KJHSIEOSWFNYDO-VGOFMYFVSA-N	505.346	2.991	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCc1ccc(C(=O)O)cc1	409073999	PASQWMLRZCHCMN-UHFFFAOYSA-N	552.346	2.881	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)ccc1OC(=O)c1ccc(F)cc1	41077848	BPYCZAFUGDHYEP-WMYZHHRISA-N	502.505	2.675	10	40	KFCB	
COC(=O)C[C@H](c1ccc2c(c1)n(C)c(=O)n2C)c1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc12	97972041	RSNQAKWUNCACST-CQSZACIVSA-N	548.504	2.873	10	40	KFCB	biogenic
CCOCCCN1C(=O)/C(=C/c2c(NCCCN3CCOCC3)nc3c(C)cccn3c2=O)SC1=S	16701159	WKBXUNRXPZEKLL-JZJYNLBNSA-N	531.704	2.765	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@@H]31)C(=O)N2	229992117	HPHNEOJMOVENCK-YRROMXRBSA-N	561.978	2.999	10	40	KFCB	
Cc1ccc2nc(NCCCOC(C)C)c(/C=C3\SC(=S)N([C@@H]4CCS(=O)(=O)C4)C3=O)c(=O)n2c1	101008321	ZJYJJJLNUALBJR-CJMVGXJBSA-N	536.701	2.618	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc(Br)c1OCC(=O)O	103842685	ZAYWJOZGEMWFGM-WLRTZDKTSA-N	533.287	2.706	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc4c(cc3[N+](=O)[O-])OCO4)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	408723303	QHDJVORMQZDGLP-YOURIZNBSA-N	536.566	2.501	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2	70699502	VVAJHKDQYMGEMR-WAWVIVDZSA-N	541.560	2.552	10	40	KFCB	biogenic
CCOc1ccccc1N1C(=O)NC(=O)/C(=C\c2c(CCN(C)C(C)=O)cc3c(c2OC)OCO3)C1=O	85896107	XHTUELHEYDUVKU-QGOAFFKASA-N	509.515	2.510	10	40	KFCB	biogenic
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1C(=O)OCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O	102401979	WUXCFXPORKZPMR-UHFFFAOYSA-N	560.559	2.837	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OS(=O)(=O)c1ccc(Cl)cc1	409072694	CZOMMWSGMJLUAB-UHFFFAOYSA-N	578.793	2.635	10	40	KFCB	
CCOC(=O)C1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)CC1	100860983	IUBFOMNDWSBHKN-SQFNAUOLSA-N	528.656	2.854	10	40	KFCB	
CS(=O)(=O)C1=NSC2=NC(=O)/C(=C\c3ccc(OC(=O)c4ccco4)c(Br)c3)C(=N)N21	38148321	QIWDORPAKUKKSO-IHCXJTTMSA-N	523.346	2.883	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc(OC)c(O)c(OC)c3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	408983965	LMQIMSRVKJSBEC-XOYGFPHKSA-N	523.611	2.587	10	40	KFCB	
COC(=O)c1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OS(=O)(=O)c4ccccc4)cc3)C2=O)cc1	409063918	ATGKWDPWGSMSIQ-RCCKNPSSSA-N	506.492	2.907	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc(N(C)C)cc3)c(=O)n2[C@H]1c1ccc(OCC(=O)OC)c(OCC)c1	409032327	CPXGSHKILVKZCM-LKWZWFHSSA-N	579.675	2.815	10	40	KFCB	
COc1cccc(N2C(=O)N=C(O)/C(=C\c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]3CCCN43)C2=O)c1	97967882	NTNMIPQDOQQOQK-WVWKGNOCSA-N	557.563	2.764	10	40	KFCB	
COc1ccc(C(=O)NN2C(=O)/C(=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)SC2=S)cc1	409333511	SMWOVTZDARGPGZ-UYRXBGFRSA-N	500.558	2.986	10	40	KFCB	
COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)c1C	20206445	QROCSFNNIBFJRV-ZSCJGDHMSA-N	502.534	2.632	10	40	KFCB	
O=C(/C=C/c1ccc(O)c2c1[C@@H](C(=O)O)[C@H](c1ccc(O)c(O)c1)O2)O[C@@H](Cc1ccc(O)c(O)c1)C(=O)O	67913699	UJZQBMQZMKFSRV-FXWSMFJBSA-N	538.461	2.769	10	40	KFCB	biogenic,in-vitro
Cc1cnn(CC(=O)N2CCOc3ccc(N4CCOCC4)cc3Cc3cccc(c3)C(=O)N(C)CC2)c1	643567957	BTBIKZICMJRYNH-UHFFFAOYSA-N	517.630	2.612	10	40	KFCB	
CC(C)(C)OC(=O)CCOCCOCCOCCN(CCOCCOCCOCCN=[N+]=[N-])CCOCCOCCOCCN=[N+]=[N-]	888086843	XBDDYUOODYDYTO-UHFFFAOYSA-N	679.813	2.790	10	40	KFCB	
CCS(=O)(=O)C1=NN2C(=N)/C(=C/c3ccc(OC(=O)c4cccc(OC)c4)c(OC)c3)C(=O)N=C2S1	97964753	QFNMTDMBZBKLNL-KMFLQCEESA-N	528.568	2.934	10	40	KFCB	
O=C(O)COc1c(Br)cc(I)cc1/C=C1\C(=O)NC(=O)N(c2ccc3c(c2)OCO3)C1=O	408953936	QOXCWZHWFJKYOH-UUILKARUSA-N	615.130	2.912	10	40	KFCB	
COc1ccc(N2C(=O)/C(=C/c3cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c3C)C(=O)NC2=S)cc1	408967444	ROJVFOMQJIDOJD-FYJGNVAPSA-N	510.597	2.581	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(F)c2)cc1	6135878	TUVUMIBOKXCOIB-KNQAVFIVSA-N	540.621	2.713	10	40	KFCB	
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C/c1cn(CC(=O)N2CCOCC2)c2ccccc12	408962952	WHEBNLYJGDTRBH-DEDYPNTBSA-N	537.370	2.929	10	40	KFCB	
CCCOc1c(I)cc(I)cc1C=C1C(=O)NC(=S)NC1=O	100164528	SZELZVKRYRFZBN-UHFFFAOYSA-N	542.136	2.599	10	40	KFCB	
COC(=O)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1I	103849735	OHZVVMUCSLFZAA-RIYZIHGNSA-N	524.242	2.649	10	40	KFCB	
Cc1cc(Br)c(N2C(=O)NC(=O)/C(=C/Nc3cc4nc(O)[nH]c4cc3N3CCN(C)CC3)C2=O)cc1C	408536011	VEQCDVHUUXBGKU-QINSGFPZSA-N	568.432	2.978	10	40	KFCB	
Cc1cc(Br)ccc1N1C(=O)/C(=C/c2ccc(OCC(=O)N3CCOCC3)cc2)C(=O)NC1=S	409235165	BFSLTHUGVDYJEZ-CPNJWEJPSA-N	544.427	2.826	10	40	KFCB	
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(N(C)C)cc2)c1	6442236	HIWZPNAOSVUXEC-NFBKMPQASA-N	536.658	2.882	10	40	KFCB	
COCCN1C(=O)/C(=C/c2c(N3CCN(Cc4ccc5c(c4)OCO5)CC3)nc3ccccn3c2=O)SC1=S	96022137	IDDUBQHFJLRGSC-JCMHNJIXSA-N	565.677	2.593	10	40	KFCB	
CCCN1C(=O)/C(=C2\SC(=S)N([C@H]3CCS(=O)(=O)C3)C2=O)c2cc(Br)ccc21	16733274	MFJPZMNGLKBMAZ-ICFTUWFRSA-N	501.449	2.964	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(Cc4ccc5c(c4)OCO5)C3=O)c(NCCOCCO)nc12	100892655	WTBPNDTUCSKCJK-NDENLUEZSA-N	540.623	2.554	10	40	KFCB	
CCCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Cl)c(OCC(N)=O)c(OC)c3)C2=O)cc1OC	409224147	IXTPGQKGWHVVNV-OVCLIPMQSA-N	517.922	2.677	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(F)cc43)[C@@H]2C(=O)N1Cc1ccc(F)cc1	16020680	QSOUOPFFXZGRBD-HGXGVQFASA-N	505.477	2.539	10	40	KFCB	
CCCCCCN1C(=O)/C(=C/c2c(N3CCNC(=O)[C@H]3CC(=O)OC)nc3ccc(C)cn3c2=O)SC1=S	97967698	IEQUZPWQNQBCAE-ZJYZBMPFSA-N	557.698	2.652	10	40	KFCB	
COc1nccnc1NS(=O)(=O)c1ccc(N/C=C2\C(=O)NC(=O)N(c3cc(C)c(Br)cc3C)C2=O)cc1	408530745	JMYCNNMVUUIANS-SFQUDFHCSA-N	601.439	3.244	10	40	KFCB	
Cc1ccc2nc(N3CCOCC3)c(/C=C3\SC(=S)N(Cc4ccc5c(c4)OCO5)C3=O)c(=O)n2c1	1099155	FVPFEWODIZGLMI-JAIQZWGSSA-N	522.608	2.970	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(I)c1OCC(=O)Nc1ccc(F)cc1	408913128	KXNUYMDCYDLKJU-VGOFMYFVSA-N	569.352	2.713	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3/C(=O)N(CC)c4ccccc43)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409161744	PHJFECRESLBLQN-ZHHPLPSFSA-N	516.623	2.601	10	40	KFCB	
CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc(I)c1OCC(=O)OC	409403558	ABMIQGXUIVOAPK-DHDCSXOGSA-N	522.295	2.703	10	40	KFCB	
CCc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NCCOC)c2ccc(N(C)C)cc2)cc1	6134747	JYKDHFWVYBWOMD-QFIPXVFZSA-N	524.647	2.603	10	40	KFCB	
COc1cc([C@H](CC(=O)NCCc2ccc(O)c(O)c2)c2c(O)nc3ccccn3c2=O)cc(OC)c1OC	108449470	UCUGEDKGOBIRBI-SFHVURJKSA-N	535.553	2.718	10	40	KFCB	biogenic
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OCC(=O)N4CCCC4)cc3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409165146	TVYRSUHZAIAAFO-MGXIGDRJSA-N	574.703	2.866	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)cc(OC)c1OCc1ccc2c(c1)OCO2	101394928	XRDDMTPOELFAOW-QSSJZMPKSA-N	544.567	2.633	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc(Br)c1OCC(=O)OC	409371226	BQYYJQWZELFQOQ-VGOFMYFVSA-N	507.293	2.655	10	40	KFCB	
COc1ccc(OC)c(N2C(=O)N=C(O)/C(=C\c3c(CCN(C)C(C)=O)cc4c(c3OC)OCO4)C2=O)c1	2129485	RWCBQEOMUUAHTJ-LDADJPATSA-N	525.514	2.969	10	40	KFCB	biogenic
CCOC(=O)C[C@@H]1C(=O)NCCN1c1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(Cc2ccc(C)cc2)C1=O	97957648	YTDZQZIKTGZOPL-PLDFPGSMSA-N	577.688	2.662	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4ccc(OC)cc4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19940448	MNTFFUJFVPWTIV-ZEQKJWHPSA-N	531.617	2.622	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(F)c2)cc1	6135969	TUVUMIBOKXCOIB-DENIHFKCSA-N	540.621	2.713	10	40	KFCB	
COc1c(I)cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1I	103856480	GFPOOKSSXALNOV-UHFFFAOYSA-N	542.136	2.503	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cccc(OC)c3OC)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	1217097	LKPFMEHYXDRZEK-RNHBDSLOSA-N	507.612	2.882	10	40	KFCB	
O=C1NC(=O)N(c2ccc(I)cc2)C(=O)/C1=C\NN1CCCC[C@H]1c1cccnc1	8740431	NTIIWAQYKGZSTR-FDWYHIAWSA-N	517.327	2.885	10	40	KFCB	biogenic
COc1ccc(N2C(=O)[C@@H]3[C@H](c4ccc(OC)cc4O)N[C@@](Cc4ccccc4)(C(=O)O)[C@@H]3C2=O)cc1	19848811	KFQUFMWWILUFGG-HXFQDRMMSA-N	502.523	2.926	10	40	KFCB	
COC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1OC	408912617	RHPGAXPHLMCXIC-MKMNVTDBSA-N	507.268	2.815	10	40	KFCB	
COc1cccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)c2C)c1	9292378	HPYPPEJKADXQFD-LUCDKTHESA-N	506.588	2.971	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc(F)cc4)C(=O)[C@H]31)C(=O)N2	16020000	HMFPPESKNCQDQF-CVRJGYJLSA-N	515.541	2.963	10	40	KFCB	
CCOc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc(I)c1OCC(=O)OC	409330691	MCUMDHIZHNAZQK-SDQBBNPISA-N	537.353	2.528	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@H]1c1cccc(OC)c1	100303329	FWBSMMCWYSTRQF-XXMKCSCWSA-N	564.620	2.552	10	40	KFCB	
Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]3CCCN43)C(=O)N=C2O)cc1C	97968171	XJXGPFZIQNKOSD-YJADQXIJSA-N	555.591	2.736	10	40	KFCB	
Cc1ccc2nc(N3CCN(c4ccccc4F)CC3)c(/C=C3/SC(=S)N(CC(=O)O)C3=O)c(=O)n2c1	100860401	IFWOPVZEEQDNDV-XDHOZWIPSA-N	539.614	2.754	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc(Br)c1OCC(N)=O	409220008	SPGVPUQHTUDBKR-WLRTZDKTSA-N	522.739	2.950	10	40	KFCB	
COC(=O)COc1c(I)cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1OC	103849952	LXJGXFUQRSCNLH-VGOFMYFVSA-N	554.268	2.657	10	40	KFCB	
COc1ccc(N2CCN(C(=O)[C@H](Cc3ccccc3)NS(=O)(=O)c3ccc(OC)c(OC)c3)CC2)cc1	59929411	VRQCNTSTDYVMEJ-VWLOTQADSA-N	539.654	2.951	10	40	KFCB	
COc1ccc(N2CCN(c3nc4c(c(=O)[nH]c(=O)n4C)n3CCSc3nc4ccccc4o3)CC2)cc1	97963862	NDFKJWNUJNRFIF-UHFFFAOYSA-N	533.614	2.692	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)c(Br)cc1OCC(=O)OC	408955373	UHJVKEYYTJATRZ-MKMNVTDBSA-N	547.314	2.795	10	40	KFCB	
O=C(CN1C(=O)S/C(=C/c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O)N1CCN(c2ccccc2)CC1	409012564	KILHTKAOVRNKNT-HAVVHWLPSA-N	537.598	2.817	10	40	KFCB	
COc1ccc(N2CCN(c3nc4c(c(=O)n(C)c(=O)n4C)n3Cc3ccc(Br)cc3)CC2)cc1	100432570	CTBJRTDEUGPOBX-UHFFFAOYSA-N	539.434	2.580	10	40	KFCB	
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(N(C)C)cc2)cc1	6089839	QYFVFBLZFPTWFB-ZJSXRUAMSA-N	566.684	2.972	10	40	KFCB	
Cc1cc(C)cc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]3CCCN43)C(=O)N=C2O)c1	97968167	OTFZEVXYQQWDNP-YJADQXIJSA-N	555.591	2.736	10	40	KFCB	
COc1ccc(N2CCN(CC(=O)N3CCNC(=O)[C@@H]3CC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)cc1	101264726	BQJAMIRLLFCFHD-NDEPHWFRSA-N	557.651	2.965	10	40	KFCB	
COCCCN1C(=O)/C(=C/c2ccc(CNC(=O)C(=O)Nc3cccc(Cl)c3)o2)C(C(=O)OC)=C1C	408868391	PZKUYABAMZFXLM-DEDYPNTBSA-N	515.950	2.897	10	40	KFCB	
COc1cc(/C=C2\SC(=S)N([C@@H]3CC(=O)N(CC(=O)O)C3=O)C2=O)ccc1OCc1ccc(F)cc1	100971788	AALBYRSWFFNMKB-OSSOMXAKSA-N	530.555	2.827	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc(F)cc4)C(=O)[C@H]31)C(=O)N2	16020002	HMFPPESKNCQDQF-PXMCIRSJSA-N	515.541	2.963	10	40	KFCB	
C[C@@H](c1ccccc1)N1C(=O)/C(=C\c2c(N3CCN(CCO)CC3)nc3ccccn3c2=O)SC1=S	26687053	DUIILMSOWFDLEB-KOXKPCSVSA-N	521.668	2.771	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N([C@H]4CCS(=O)(=O)C4)C3=O)c(NC[C@@H](O)c3ccccc3)nc12	101351418	LZDZDEUEKTXNJL-VBNMPBEYSA-N	556.691	2.537	10	40	KFCB	
O=C1/C(=C/c2c(N3CCN(CCO)CC3)nc3ccccn3c2=O)SC(=S)N1Cc1ccccc1Cl	2329139	DBZPWHSTVUNVHC-HKWRFOASSA-N	542.086	2.864	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)cc(I)c1OCC(=O)OC	408694183	DYBRJCQHHJSCQB-RIYZIHGNSA-N	542.326	2.646	10	40	KFCB	
CCS(=O)(=O)C1=NN2C(=N)/C(=C/c3ccc(OC(=O)c4ccc(OC)cc4)c(OC)c3)C(=O)N=C2S1	97964752	QDSIGMBMJIONDX-MLDLNWIHSA-N	528.568	2.934	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N([C@@H]4CCS(=O)(=O)C4)C3=O)c(NC[C@@H](O)c3ccccc3)nc12	101351414	LZDZDEUEKTXNJL-MVBZRGLFSA-N	556.691	2.537	10	40	KFCB	
O=C(O)CCCN1C(=O)/C(=C/c2c(NC[C@@H](O)c3ccccc3)nc3ccccn3c2=O)SC1=S	13806854	YIOOXBPAPJRQNB-GFWHJHDHSA-N	510.597	2.906	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1ccc(OC)cc1	78547123	ULUSQUNCWUULBS-QXHVWWCLSA-N	519.623	2.644	10	40	KFCB	
COc1ccc(CCN2C(=O)[C@H]3[C@@H](Cc4ccc(O)c(O)c4)N[C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1OC	103521093	OHEMAVIQDGBOJN-DSTBRJMRSA-N	578.021	2.974	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(C)cc1C	409258269	SLZFVFSJHVKLSL-UHFFFAOYSA-N	502.321	2.841	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1cc(OC)c(OC)c(OC)c1	409059399	MXJQFWXHBBONDI-GVMLUORFSA-N	579.675	2.661	10	40	KFCB	
CCCN1C(=O)/C(=C2\SC(=S)N([C@@H]3CCS(=O)(=O)C3)C2=O)c2cc(Br)ccc21	16733271	MFJPZMNGLKBMAZ-PHIZWAGYSA-N	501.449	2.964	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C[C@@H]4CCCO4)C3=O)c(N3C[C@@H](C)O[C@H](C)C3)nc12	27016510	PFMKXYKEVOBINJ-GEDGVXKFSA-N	500.646	2.997	10	40	KFCB	
COc1c(I)cc(/C=C2/C(=O)NC(=S)N=C2O)cc1I	33355313	YSZMQABPBSZHSB-UHFFFAOYSA-N	514.082	2.659	10	40	KFCB	
O=C(O)CCN1C(=O)/C(=C/c2c(N3CCN(Cc4ccccc4)CC3)nc3ccccn3c2=O)SC1=S	100761618	IPTIRIMAMWZYGE-SILNSSARSA-N	535.651	2.693	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)ccc1OC(=O)c1ccccc1F	41077843	CHNOQCJUTURGNK-MTLBIAMWSA-N	502.505	2.675	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(F)cc43)[C@@H]2C(=O)N1Cc1ccc(F)cc1	16020682	QSOUOPFFXZGRBD-JYYLQKJRSA-N	505.477	2.539	10	40	KFCB	
O=C1/C(=C/c2cn(-c3ccccc3)nc2-c2ccc(S(=O)(=O)N3CCOCC3)cc2)SC(=S)N1CCS(=O)(=O)O	49745270	ZDENYKJDBBSGDF-JWGURIENSA-N	620.756	2.649	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@@H]1c1ccccc1OC	409103940	XPJVVDNOWZORAM-HPFVHPJRSA-N	591.690	2.857	10	40	KFCB	
COc1cc(/C=C2/C(=O)NN(c3ccc(F)c(Cl)c3)C2=O)cc(Br)c1OCC(=O)N1CCOCC1	100951247	GPQXFUDXXGTOOG-NVNXTCNLSA-N	568.783	2.949	10	40	KFCB	
O=C(NC[C@H]1CCCO1)[C@@H](c1ccc(N2CCOCC2)cc1)N(Cc1ccco1)C(=O)Cn1nnc2ccccc21	100336674	FCLNGUQOXUOSQY-FUFSCUOVSA-N	558.639	2.926	10	40	KFCB	
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CSc1ccccc1)C[C@H]3O[C@H]1C[C@@H](N)[C@@H](O)[C@H](C)O1	150388720	WXRBTXBZCINPCH-CYROPTILSA-N	635.691	2.801	10	40	KFCB	
Cc1ccc(N2C(=O)NC(=O)/C(=C/Nc3ccc(S(=O)(=O)Nc4nc(C)cc(C)n4)cc3)C2=O)cc1	8989978	UNUCUEVXKLZGRX-MOSHPQCFSA-N	506.544	2.781	10	40	KFCB	
O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\NN1C(=O)c2cccc3c(Br)ccc(c23)C1=O	8424754	UQEXLKFTQQPHJS-WJDWOHSUSA-N	505.284	2.870	10	40	KFCB	
CCOC(=O)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1I	408947280	BSXHLBRLBNYPQI-VGOFMYFVSA-N	564.288	2.628	10	40	KFCB	
COC[C@@H]1CCCN1c1ccc2c(c1)CNCC(=O)N1CC[C@@H](CC(=O)NCc3ccccn3)[C@@H](C=CCO2)C1	2332241378	UGZTWBBNOYBSSH-QONNDPFASA-N	547.700	2.906	10	40	KFCB	
CCOC(=O)CNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1	6089327	SXGZDVHPGHZSHS-HSZRJFAPSA-N	552.657	2.574	10	40	KFCB	
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC[C@H]1CCCO1)c1ccc(N(C)C)cc1	6443967	VNGKFEPVHILHKS-XXBNENTESA-N	536.658	2.882	10	40	KFCB	
O=C(COC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)Nc1ccc2c(c1)OCCO2	102932151	FAVKLFLUJMLQID-UHFFFAOYSA-N	529.483	2.668	10	40	KFCB	
CCOc1ccc(NC(=O)[C@H](/N=N\c2ccc(S(=O)(=O)N[C@H]3ON[C@@H](C)[C@H]3C)cc2)C(C)=O)cc1	104124217	KOXFRJDYKODYFV-CCYVDECQSA-N	503.581	2.929	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCc1cccc([N+](=O)[O-])c1	408810670	JKHSUHGCMFPKKX-UHFFFAOYSA-N	537.266	2.927	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCc1ccc(F)cc1	408870007	UJZTYLQXVXTSGG-UHFFFAOYSA-N	512.300	2.932	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc(Br)c1OCC(N)=O	409225033	NZDBAKIDAVRZDQ-AWNIVKPZSA-N	553.163	2.751	10	40	KFCB	
Cc1cc(C(=O)COC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc3c(c2)OCCO3)c(C)n1-c1ccc(F)cc1	102778254	WLSRZIXQWKAJDK-OFNKIYASSA-N	558.584	2.554	10	40	KFCB	
COC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1OC	408851419	JWNHDWILLBSKQM-VGOFMYFVSA-N	507.268	2.815	10	40	KFCB	
CCc1ccc(N2C(=O)/C(=C/c3cn(CC(=O)N4CCOCC4)c4ccccc34)C(=O)NC2=S)cc1	408961562	NDUXHTXRBHTFDU-PXLXIMEGSA-N	502.596	2.894	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cccc(OC)c3OC)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	1217099	LKPFMEHYXDRZEK-FQWPPLDYSA-N	507.612	2.882	10	40	KFCB	
COC(=O)[C@@H](C)Oc1c(I)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1OC	409408918	SBUDZJOHBBZUEI-CDCQXCROSA-N	522.295	2.702	10	40	KFCB	
COCCn1nnnc1[C@@H](c1cc2cc(C)c(C)cc2[nH]c1=O)N1CCN(c2ccc(OC)cc2)CC1	20083680	KENXUZBHFVCCJR-RUZDIDTESA-N	503.607	2.698	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3/C(=O)N(C(C)C)c4ccccc43)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409149895	URHWPQSAOXJPLC-NXLSWJSLSA-N	530.650	2.990	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	97969045	PEFMGIDTVYFVCQ-VXLQEKCDSA-N	630.491	2.733	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N([C@@H]4CCS(=O)(=O)C4)C3=O)c(NC[C@H](O)c3ccccc3)nc12	101351406	LZDZDEUEKTXNJL-VPDXPZNTSA-N	556.691	2.537	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OS(=O)(=O)c1ccc(C)cc1	408763947	GUZKOPSZVUNFTG-UHFFFAOYSA-N	572.402	2.680	10	40	KFCB	
CCc1ccc2[nH]c(=O)c([C@@H](c3nnnn3CCOC)N3CCN(c4ccc(OC)cc4)CC3)cc2c1	19972957	MEOICWCHPRAGFT-VWLOTQADSA-N	503.607	2.644	10	40	KFCB	
CC(=O)NC1=NC(=O)/C(=C/c2cc(I)cc(I)c2OC(C)=O)S1	408917488	VLOAQBUSNRMPEV-WCIBSUBMSA-N	556.119	2.928	10	40	KFCB	
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@@](O)(C(=O)O)C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1OC(=O)/C=C/c1ccc(O)c(O)c1	2061000555	OAFXTKGAKYAFSI-QCRXNAIWSA-N	678.599	2.705	10	40	KFCB	
COc1ccc(N2CCN(CC(=O)N3CCNC(=O)[C@H]3CC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)cc1	101264728	BQJAMIRLLFCFHD-MUUNZHRXSA-N	557.651	2.965	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc2c(c1O)C[C@@H](O)[C@@H](c1ccc(O)c(O)c1)O2	42835384	GMISZFQPFDAPGI-CVJZBMGUSA-N	578.526	2.995	10	40	KFCB	biogenic,in-vitro
COCCN1C(=O)/C(=C/c2ccc(CNS(=O)(=O)c3ccc(Br)cc3)o2)C(C(=O)OC)=C1C	100229191	NEPOVDADHWNJRB-XDHOZWIPSA-N	539.404	2.840	10	40	KFCB	
Cc1c(N/C=C2\C(=O)NC(=O)N(c3ccc(I)cc3)C2=O)c(=O)n(-c2ccccc2)n1C	100794557	RBJPNQVFSZBIQN-SFQUDFHCSA-N	543.321	2.668	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Br)c(OCC(N)=O)c(OCC)c3)C2=O)cc1	409224707	NHBMNFCJYKXSEG-CXUHLZMHSA-N	532.347	2.777	10	40	KFCB	
CN(C)CCN(C)C(=O)C[C@@H]1CCN2C[C@@H]1C=CCOc1ccc(N(C)CCc3ccccn3)cc1CNCC2=O	958317649	KUWVYAGQQUNLMJ-UIOOFZCWSA-N	562.759	2.674	10	40	KFCB	
COCCn1nnnc1[C@@H](c1cc2c(C)ccc(C)c2[nH]c1=O)N1CCN(c2ccc(OC)cc2)CC1	20083382	KAFBCKVQDKJEEI-RUZDIDTESA-N	503.607	2.698	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3\C(=O)N(C)c4ccc(Br)cc43)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409118284	ZJUPDKNVWOAMRB-VFJWVMJUSA-N	581.492	2.973	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C2=O)cc1	409381982	JLNADXYRYCUODA-CPNJWEJPSA-N	558.385	2.752	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C(=O)OC)cc3)C2=O)cc(I)c1O	408889790	JDSQNPCFMQMFRW-RIYZIHGNSA-N	536.278	2.849	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)ccc1OCc1ccc([N+](=O)[O-])cc1	20206326	GVLOKOVBLFPCEE-PRZRADHTSA-N	515.529	2.804	10	40	KFCB	
NC(=O)COc1cccc([C@H]2CC(=O)Oc3cc(O)c4c(=O)c(O)c(-c5ccc(O)c(O)c5)oc4c32)c1	96221138	IXMRVIBHYUCERV-CQSZACIVSA-N	505.435	2.588	10	40	KFCB	biogenic
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCC(=O)O)C3=O)c(NC[C@H](O)c3ccccc3)nc12	1885434	WANOVQFEUNAHFM-KMTKGMGQSA-N	510.597	2.824	10	40	KFCB	
CC(C)OC(=O)[C@H](C(=O)C(F)(F)F)c1cc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)ccc1O	6023940	GCPJAOGXQAWWAA-SFHVURJKSA-N	529.493	2.550	10	40	KFCB	
CN(C)CCNC(=O)C[C@@H]1CCN2C[C@@H]1CCCOc1ccc(N(C)CCc3ccccn3)cc1CNCC2=O	72320728	UMTZKVQBOWCVEJ-DQEYMECFSA-N	550.748	2.555	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1ccc(C)cc1	409225516	PCEOOIQUXNMNAW-UHFFFAOYSA-N	549.321	2.765	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc(I)c1OCC(=O)O	103849949	ADXFHPRSBKZHHQ-AWNIVKPZSA-N	540.241	2.569	10	40	KFCB	
Cc1ccc2nc(NCCOCCO)c(/C=C3\SC(=S)N(Cc4ccc5c(c4)OCO5)C3=O)c(=O)n2c1	100863861	IYEJBBFJYSITOB-JAIQZWGSSA-N	540.623	2.554	10	40	KFCB	
Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3C[C@@H](O)CN3S(=O)(=O)c3ccccc3[N+](=O)[O-])c2C)cc1	103128853	FWEYHHWNNREBBK-NFBKMPQASA-N	541.582	2.861	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCC(N(C)C)CC4)o3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	105499866	HTODPSHSLGITBB-HCWVEKLQSA-N	563.724	2.988	10	40	KFCB	
Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]3CCCN43)C(=O)N=C2O)cc1C	97968170	XJXGPFZIQNKOSD-XOYGFPHKSA-N	555.591	2.736	10	40	KFCB	
Cc1cc(C)c(N2C(=O)NC(=O)/C(=C\NN3C(=O)c4cccc5c(N6CCOCC6)ccc(c45)C3=O)C2=O)c(C)c1	408534366	QRTTXTWIBVZEEC-PXLXIMEGSA-N	553.575	2.869	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc(OC)c(OC)cc3[N+](=O)[O-])c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	408723533	YMTUABJXDVQKCD-RWTNITNYSA-N	552.609	2.790	10	40	KFCB	
COc1ccc(N2CCN(CCNC(=O)CCc3nnc4n(CCCOC(C)C)c(=O)c5ccccc5n34)CC2)cc1	29749213	HZCRKXRLUBLGBW-UHFFFAOYSA-N	575.714	2.739	10	40	KFCB	
CCOCCCN1C(=O)/C(=C/c2c(N3CCN(C(=O)OCC)CC3)nc3c(C)cccn3c2=O)SC1=S	100863786	ZCPMJJSSYCUKBJ-MNDPQUGUSA-N	545.687	2.909	10	40	KFCB	
COC(=O)COc1ccc(/C=C2/C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1I	408917317	QYVXNIGQMOPUJR-ZSOIEALJSA-N	540.310	2.813	10	40	KFCB	
COc1c2c(cc3c1[C@H](CN/C=C1/C(=O)NC(=S)N(c4ccccc4Cl)C1=O)N(C)CC3)OCO2	20410718	ZSLFRYBKYJNVJZ-QXSWTLKVSA-N	514.991	2.528	10	40	KFCB	biogenic
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCc1cccc([N+](=O)[O-])c1	408881613	LIXKRPLHBXBRNK-UHFFFAOYSA-N	539.307	2.701	10	40	KFCB	
COc1c2c(cc3c1[C@@H](CN/C=C1\C(=O)NC(=S)N(c4ccc(Br)cc4)C1=O)N(C)CC3)OCO2	70673681	CPGSATOWKWGYHF-BRVCPTFNSA-N	559.442	2.637	10	40	KFCB	biogenic
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(C4CCCCC4)C3=O)c(N3CCN(CCO)CC3)nc12	20103123	DQPGENILZIEQJS-SILNSSARSA-N	513.689	2.651	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(F)cc43)[C@@H]2C(=O)N1Cc1ccc(F)cc1	16020684	QSOUOPFFXZGRBD-KKBCGBJISA-N	505.477	2.539	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C\c3ccc(Br)s3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	150390310	INTTWHIIIGFJPG-BMKHJULHSA-N	636.520	2.795	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc4c(cc3C)OCO4)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	693904	VATQZPQDAIPFME-MFUBYVTQSA-N	505.596	2.901	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	408734771	DKLBJXGMGCNZKE-UHFFFAOYSA-N	554.209	2.658	10	40	KFCB	
CN(C)c1ccc(/C=c2/sc3n(c2=O)N[C@]2(c4ccccc4)N(C)C(=O)N(C)[C@]2(c2ccccc2)N=3)cc1	12416613	JETDYKDVQXDARZ-CFAYAFMOSA-N	524.650	2.685	10	40	KFCB	
COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C/c1ccc(CNS(=O)(=O)c2ccc(C)cc2)o1	408905489	ATKIXSJTHFECMG-BOURKTIISA-N	500.573	2.918	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1Cc1ccccc1	16020929	CZTOQNOGECBLFJ-HGXGVQFASA-N	503.942	2.915	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3/C(=O)N(C(C)C)c4ccccc43)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409149896	URHWPQSAOXJPLC-SBXHHDGASA-N	530.650	2.990	10	40	KFCB	
O=C1/C(=C/c2c(N3CCN(CCO)CC3)nc3ccccn3c2=O)SC(=S)N1CCCc1ccccc1	100912686	RCPPMPADYAHFBQ-QOCHGBHMSA-N	535.695	2.643	10	40	KFCB	
CCOC(=O)N1CCN(c2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)CC1	100863824	HWDANXIOZZJUIY-SQFNAUOLSA-N	543.671	2.662	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(I)c1O	408895739	LUIJDVRBOUKQCO-AWNIVKPZSA-N	523.239	2.970	10	40	KFCB	
Cc1cc(C(=O)COC(=O)CCNC2=NS(=O)(=O)c3ccccc32)c(C)n1-c1ccc2c(c1)OCCO2	3428054	BOIVULZWCRCQDE-UHFFFAOYSA-N	523.567	2.720	10	40	KFCB	
O=C(COC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1cc2c(cc1Cl)C(=O)c1ccccc1C2=O	103113522	QZCBPZWDDJFNPZ-UHFFFAOYSA-N	568.991	2.932	10	40	KFCB	
CCOc1cccc(N2C(=O)NC(=O)/C(=C\c3cn(CC(=O)N4CCOCC4)c4ccccc34)C2=O)c1	9892471	FPGBOAFEBLHQHK-HYARGMPZSA-N	502.527	2.565	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1cc(C)ccc1C	409257999	VNCHYQUUNJURJU-UHFFFAOYSA-N	565.389	2.848	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@@H](c1ccc(O)c(O)c1)[C@@H](O)C2	5085290	XFZJEEAOWLFHDH-YOELTNQESA-N	578.526	2.995	10	40	KFCB	endogenous,in-man
NS(=O)(=O)c1ccc(N2N=C(C(F)(F)F)/C(=C/c3ccc(-c4ccc5c(c4)C(=O)NC5=O)o3)C2=O)cc1	70462953	LGEIQZMEMRMJBZ-YVLHZVERSA-N	530.440	2.826	10	40	KFCB	
CCCCCN1C(=O)/C(=C/c2c(N3CCN(CCO)CC3)nc3c(C)cccn3c2=O)SC1=S	20080866	JWOBZHZZGZRCDS-MNDPQUGUSA-N	501.678	2.509	10	40	KFCB	
CCOC(=O)CC1=NN(c2ccccc2)C(=O)/C1=c1/s/c(=C2\Sc3ccccc3N2C)c(=O)n1CC	33907825	MHPKAERVHYRGKS-AERNQAQFSA-N	520.636	2.744	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(N4CCC(C(N)=O)CC4)nc4ccccn4c3=O)SC2=S)cc1	100918432	UESQYNFWVDJZQO-PGMHBOJBSA-N	549.678	2.849	10	40	KFCB	
O=C(COC(=O)CNC(=O)c1cccc(OC(F)F)c1)Nc1cccc2c1C(=O)c1ccccc1C2=O	15981540	VMWHFXBENLTYSO-UHFFFAOYSA-N	508.433	2.975	10	40	KFCB	
COc1cc(N(C(=O)Cn2nnc3ccccc32)[C@@H](C(=O)NC[C@H]2CCCO2)c2ccc(N(C)C)cc2)ccc1-n1cnnn1	100626418	LLSNDFSZEGXCSV-AYWVHJORSA-N	610.679	2.551	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(F)cc1	409363180	KCPJJIIKQBYDOA-UHFFFAOYSA-N	522.352	2.919	10	40	KFCB	
Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C2=O)cc1	409383430	UXYHYTPIUJRZCT-LDADJPATSA-N	528.359	2.662	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	408735171	KZTIMDXTNLDQCP-UHFFFAOYSA-N	570.277	2.823	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4cccc(C)c4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19826422	IHDPARKNSIPZAR-OZXSUGGESA-N	515.618	2.922	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4cc(C)ccc4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19826211	VGCIZXMTXLOGCZ-BVAGGSTKSA-N	515.618	2.922	10	40	KFCB	
COc1ccc(N2CCN(CCCNC(=O)CCc3nnc4n(CC(C)C)c(=O)c5ccccc5n34)CC2)cc1	101533149	LPFLVEWDOGYSSJ-UHFFFAOYSA-N	545.688	2.970	10	40	KFCB	
CCOC(=O)CNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccccc1CC	6135413	YFGIBVUMYKNCIE-QHCPKHFHSA-N	552.657	2.520	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(/C=C3\C(=O)N(C[C@H]4CCCO4)C(C)=C3C(=O)OC)o2)cc1	409184093	FADGKWYEZWEBSY-QPHMKDBKSA-N	565.579	2.563	10	40	KFCB	
CCn1c(=O)/c(=C2/Sc3ccccc3N2C)s/c1=C1/C(=O)N(c2ccc(S(=O)(=O)O)cc2Cl)N=C1C	100496591	ZPNQHKFDRBJEMY-YLRGQORSSA-N	563.082	2.711	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	70705356	HPHNEOJMOVENCK-UTGDAKJESA-N	561.978	2.999	10	40	KFCB	biogenic
COc1ccc(Oc2nc3ccccn3c(=O)c2/C=C2\SC(=S)N([C@H]3CCS(=O)(=O)C3)C2=O)cc1	97947375	ROZINMWMHBLQJR-HIXWQLQUSA-N	529.621	2.884	10	40	KFCB	
COC(=O)COc1c(I)cc(/C=C2\C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1OC	103852159	WRSJQKQFBOTGQX-KPKJPENVSA-N	570.336	2.822	10	40	KFCB	
COC(=O)COc1c(I)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1OC	408783556	OQWTZZUIPAAQRZ-OVCLIPMQSA-N	550.305	2.826	10	40	KFCB	
Cc1ccc2nc(N3CCN(C)CC3)c(/C=C3\SC(=S)N(CCCCCC(=O)O)C3=O)c(=O)n2c1	16805825	ORYQQRIMNOXWQY-JXAWBTAJSA-N	515.661	2.601	10	40	KFCB	
COCCN1C(=O)/C(=C\c2ccc(CNS(=O)(=O)c3ccc(Br)cc3)o2)C(C(=O)OC)=C1C	97960456	NEPOVDADHWNJRB-UNOMPAQXSA-N	539.404	2.840	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@H]1c1ccccc1OC	409103943	XPJVVDNOWZORAM-WHNPURCTSA-N	591.690	2.857	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1	6135876	VFXBEHCMMVXNET-KNQAVFIVSA-N	540.621	2.713	10	40	KFCB	
COc1ccc(Oc2nc3ccccn3c(=O)c2/C=C2/SC(=S)N([C@H]3CCS(=O)(=O)C3)C2=O)cc1	102993410	ROZINMWMHBLQJR-QCUKBLKESA-N	529.621	2.884	10	40	KFCB	
CCc1ccccc1N1C(=O)/C(=C/c2cn(CC(=O)N3CCOCC3)c3ccccc23)C(=O)NC1=S	12363702	DEXGSZXUAMEZOI-RCCKNPSSSA-N	502.596	2.894	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc([N+](=O)[O-])ccc3N3CCN(C)CC3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	104607840	LKINLZDUZGCKBE-NTWBUQQASA-N	590.706	2.524	10	40	KFCB	
O=C(O)CCN1C(=O)/C(=C\c2c(N3CCN(c4ccccc4)CC3)nc3ccccn3c2=O)SC1=S	26532923	KYMQOTKSALJZDJ-KNTRCKAVSA-N	521.624	2.697	10	40	KFCB	
C[C@H]1CCCCN1Cc1c(O)c(CN2CCCC[C@H]2C)c(O)c2c(=O)c(-c3ccc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3)coc12	79209906	VPHGNASNUHAYHV-QMGZIDCMSA-N	654.757	2.799	10	40	KFCB	biogenic
COc1ccc([C@@H](CC(=O)NCCc2ccc(O)c(O)c2)c2c(O)nc3ccccn3c2=O)cc1OC	96221390	IHZHENSDJPWTSW-GOSISDBHSA-N	505.527	2.709	10	40	KFCB	biogenic
COCCn1nnnc1[C@H](c1cc2c(C)ccc(C)c2[nH]c1=O)N1CCN(c2ccc(OC)cc2)CC1	20083379	KAFBCKVQDKJEEI-VWLOTQADSA-N	503.607	2.698	10	40	KFCB	
CCOc1cc(/C=C2/C(=O)NC(=S)N(c3ccccc3)C2=O)cc(Br)c1OCC(N)=O	409264419	KDSJNEGNTIJZQK-ZSOIEALJSA-N	504.362	2.543	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2	70701131	VHUFKLNZFVLLNM-OMZITNSBSA-N	527.533	2.557	10	40	KFCB	biogenic
COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C\c1ccc(CNC(=O)C(=O)Nc2ccc(C)cc2)o1	409183774	DIFZGLGHMPGPJW-OKIKLVOASA-N	507.543	2.695	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccc(F)cc1	409365074	SNUNZURSZWJSTD-UHFFFAOYSA-N	569.352	2.761	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)CN2C(=O)/C(=C3\SC(=S)N(CC(=O)O)C3=O)c3ccccc32)cc1	97946423	HPZRCSKPRASYIO-VXPUYCOJSA-N	525.564	2.505	10	40	KFCB	
CN1C(=O)/C(=C/c2ccc(OCc3ccc(C(=O)O)cc3)c(I)c2)C(=O)NC1=S	408915791	YRJHDGUWUFMWLK-RIYZIHGNSA-N	522.320	2.825	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)ccc1OCc1ccc(C(=O)O)o1	409384461	CIKQLKIAYISHOD-LZYBPNLTSA-N	506.423	2.961	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2	5085289	XFZJEEAOWLFHDH-UMUOWMJJSA-N	578.526	2.995	10	40	KFCB	endogenous,in-man
COCCN1C(=O)/C(=C/c2c(N3CCN(Cc4ccc5c(c4)OCO5)CC3)nc3ccc(C)cn3c2=O)SC1=S	100763080	UEAHKXTVUKPSFH-UCQKPKSFSA-N	579.704	2.901	10	40	KFCB	
CCCCCCN1C(=O)/C(=C/Nc2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@H]2CCCN32)C(=O)N=C1S	101375229	LKAVKKQHLVNHLM-WEIUTZTHSA-N	566.684	2.779	10	40	KFCB	
C[N+]1=C(/C=C/C=C2/N(CCCCC(=O)NCCOCCOCCNCCO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)c3ccccc3C2(C)C)C(C)(C)c2ccccc21	94303313	SSFADTFCQMBTSO-VRGRYHIJSA-O	779.996	2.656	10	40	KFCB	in-vitro
O=C(CSc1nnnn1-c1ccccc1)NCCN1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S	102896829	OJYNQRXHACZXLG-WQRHYEAKSA-N	526.625	2.501	10	40	KFCB	
COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(Br)c(Br)c1OCC(N)=O	409398387	AGGBAQIOOPJPOM-GHXNOFRVSA-N	525.153	2.546	10	40	KFCB	
Cc1ccc2nc(N3C[C@H](C)O[C@@H](C)C3)c(/C=C3\SC(=S)N(C[C@@H]4CCCO4)C3=O)c(=O)n2c1	105313437	WRBQEILSEGXANK-DPRVKOSLSA-N	500.646	2.997	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(c3ccc(C)cc3)C2=O)cc(I)c1OCC(=O)O	408904173	FWHACFRQAKCVCC-VGOFMYFVSA-N	552.346	2.903	10	40	KFCB	
CCOC(=O)COc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2ccc3c(c2)OCO3)C1=O	408947338	CCARCSKPMPJWHN-OVCLIPMQSA-N	517.288	2.786	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C(=O)O)cc3)C2=O)cc(I)c1O	408942226	YGHXCNFKPUJCRX-NTUHNPAUSA-N	522.251	2.760	10	40	KFCB	
COC(=O)c1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(OS(=O)(=O)c4ccccc4)c(OC)c3)C2=O)cc1	409069057	VSUWJXBJZYXBNR-XSFVSMFZSA-N	536.518	2.916	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)cc(OC)c1OCc1ccc2c(c1)OCO2	97964462	MPVRRYDQBJSFAJ-QSSJZMPKSA-N	544.567	2.633	10	40	KFCB	
Cc1ccc(N2C(=O)/C(=C/c3cn(CC(=O)N4CCOCC4)c4ccccc34)C(=O)NC2=S)cc1C	408960660	HRJZPZZOWSAJEZ-HYARGMPZSA-N	502.596	2.948	10	40	KFCB	
COc1cc(N2C(=O)/C(=C\Nc3ccccc3NC(=O)C(F)(F)F)C(=O)NC2=S)cc(OC)c1OC	100954456	XVKMTDXYWUIFEJ-BENRWUELSA-N	524.477	2.957	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1cccc(C)c1C	409268641	WZLZAOPOHCIXOW-UHFFFAOYSA-N	565.389	2.848	10	40	KFCB	
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1	6280322	MNKOCIQVQSPMIC-QFIPXVFZSA-N	524.647	2.658	10	40	KFCB	
CCNc1nc(NCC)n2c(SCC(=O)Nc3ccc(C)c(S(=O)(=O)N4CCCCC4)c3)nnc2n1	103079484	DWHHCTICUIWWTF-UHFFFAOYSA-N	533.684	2.597	10	40	KFCB	
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1CC(OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)O)C[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1O	202854476	MSKVJEAKVWAQTA-LTNHYYHKSA-N	678.599	2.705	10	40	KFCB	biogenic,in-vitro
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccccc1C	409262634	IKZJVELFHYHLTM-UHFFFAOYSA-N	551.362	2.540	10	40	KFCB	
COc1ccc2c(c1)c(C)c(C(=O)N1CCC3(CCCCOCCCNC(=O)[C@H](C)NC3=O)CC1)n2C	643564148	OVEQQNMLWHJEGF-FQEVSTJZSA-N	512.651	2.929	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(=O)(=O)C(C)C)ccc1OC(=O)c1ccco1	15936876	NCRNZTCQJVWITL-ANVLOLRKSA-N	502.530	2.907	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1cccc(C)c1	409040182	FVUNTRWLEFORJX-UHFFFAOYSA-N	502.321	2.923	10	40	KFCB	
O=C(OCC(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O	12657472	PTXRMWQGYVWKTC-UHFFFAOYSA-N	506.898	2.850	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C(=O)OC)cc3)C2=O)cc(I)c1OCC(=O)O	409046488	KWMHWUZWIGZJED-OVCLIPMQSA-N	594.314	2.606	10	40	KFCB	
CCOC(=O)/C=c1\s/c(=C\c2ccc(N(C)C)cc2)c(=O)n1Cc1cc(Cl)cc2c1OCOC2	13027204	AGZLQIYGDFUZKP-ZCNOQTDVSA-N	501.004	2.716	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C/NN3C(=O)c4cccc5cc(O)cc(c45)C3=O)C2=O)ccc1Br	100959056	MUWZIOBRCXZFIO-YVLHZVERSA-N	535.310	2.884	10	40	KFCB	
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](N)[C@@H](O)[C@H](C)O2)C1)C(=O)c1c(OCc2ccccc2)cccc1C3=O	104196917	SRILNPQAKDAONQ-QTUBSNNUSA-N	603.624	2.599	10	40	KFCB	
CCOC(=O)COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1OC	408951104	LFTAPEODVPRNMU-MKMNVTDBSA-N	502.863	2.686	10	40	KFCB	
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CSc1ccccc1)C[C@H]3O[C@H]1C[C@@H](N)[C@H](O)[C@@H](C)O1	150388722	WXRBTXBZCINPCH-FILVOZCSSA-N	635.691	2.801	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1Cc1ccccc1Cl	16021700	UYYOJRBRGCNQTK-YRCDICCDSA-N	503.942	2.915	10	40	KFCB	
COc1c2c(cc3c1[C@@H](CN/C=C1/C(=O)NC(=S)N(c4ccc(Cl)cc4)C1=O)N(C)CC3)OCO2	2091272	FBJUFGDGFZANNP-LPPOOGIUSA-N	514.991	2.528	10	40	KFCB	biogenic
CCOc1ccc(NC(=O)CN2C(=O)/C(=C3/SC(=S)N([C@@H]4CCS(=O)(=O)C4)C3=O)c3ccccc32)cc1	2588681	PLHLWEUZHJBPGH-VNRULFPQSA-N	557.675	2.829	10	40	KFCB	
CCN(C(=O)COC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O	32667625	HVVICXWIHJLYLK-UHFFFAOYSA-N	515.570	2.785	10	40	KFCB	
COc1ccc(N2CCN(C(=O)COc3ccc(S(=O)(=O)NCCc4ccccc4)cc3)CC2)cc1	8430112	JFFYUEQJMMTCOX-UHFFFAOYSA-N	509.628	2.944	10	40	KFCB	
CN(c1nc2ccccn2c(=O)c1/C=C1\SC(=S)N([C@@H]2CCS(=O)(=O)C2)C1=O)C1CCCCC1	8781011	BIKUNLHRKBCUHS-OKSBFYSISA-N	518.686	2.852	10	40	KFCB	
CC(=O)CCc1ccc(O[C@H]2O[C@@H](COC(=O)/C=C/c3ccccc3)[C@H](O)[C@@H](O)[C@@H]2OC(=O)c2cc(O)c(O)c(O)c2)cc1	257376127	AHLBWJHZDLMJOJ-XEAXVBDESA-N	608.596	2.633	10	40	KFCB	endogenous,in-man
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc(I)c(OCC(=O)O)c(OC)c3)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	408828639	IJVONULGHCLODQ-DNQIBQKISA-N	677.517	2.941	10	40	KFCB	
CCc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\Nc2cc3c(cc2N2CCOCC2)n(C)c(=O)n3C)C1=O	408533654	OSLWPUQXSQSJDU-SAPNQHFASA-N	583.443	2.617	10	40	KFCB	
COC(=O)c1ccc(N2C(=O)NC(=O)/C(=C\c3ccccc3OS(=O)(=O)c3ccccc3)C2=O)cc1	409070605	CQSDFLNOFYAOAA-HMMYKYKNSA-N	506.492	2.907	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4cc(C)ccc4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19826207	VGCIZXMTXLOGCZ-ZEQKJWHPSA-N	515.618	2.922	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C[C@H]4CCCO4)C3=O)c(N3C[C@@H](C)O[C@H](C)C3)nc12	27016520	PFMKXYKEVOBINJ-YVLPMYQXSA-N	500.646	2.997	10	40	KFCB	
O=C1/C(=C2\SC(=S)N(CCC(=O)N(CCO)c3ccccc3)C2=O)SC(=S)N1CCC(=O)N(CCO)c1ccccc1	150469216	OVLAPGZRIMREHG-WCWDXBQESA-N	644.822	2.750	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OS(=O)(=O)c1ccc(C)cc1	408761790	HPEOWPAIAGYPAN-UHFFFAOYSA-N	525.402	2.838	10	40	KFCB	
COc1cc(N(C(=O)Cn2nnc3ccccc32)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(N(C)C)cc2)ccc1-n1cnnn1	100626414	LLSNDFSZEGXCSV-NGQVCNFZSA-N	610.679	2.551	10	40	KFCB	
O=C1NC(=S)NC(=O)C1=Cc1cc(Br)c(OS(=O)(=O)c2ccccc2)c(Br)c1	408889443	HBCKHEGQQGNQAC-UHFFFAOYSA-N	546.218	2.894	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1ccccc1OC	409108364	WRKMLXVWWQDMFP-QHEKLXHTSA-N	546.693	2.949	10	40	KFCB	
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)O)C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1O	1565749095	MSKVJEAKVWAQTA-HFFDWAFISA-N	678.599	2.705	10	40	KFCB	biogenic,in-vitro
CCOc1cc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)c(Br)cc1OCC(=O)OC	409373365	HYRPXPWUPFKDSM-VGOFMYFVSA-N	507.293	2.655	10	40	KFCB	
Cc1ccccc1N1C(=O)/C(=C/c2ccc(OCC(=O)N3CCOCC3)c(Br)c2)C(=O)NC1=S	409383366	WRQZZCZKJNQRSZ-SFQUDFHCSA-N	544.427	2.826	10	40	KFCB	
O=C1N=C(N2CCOCC2)S/C1=C/c1cc(I)c(O)c(I)c1	59093000	PWSRLUODWCPYQC-YRNVUSSQSA-N	542.136	2.904	10	40	KFCB	
COc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc(Oc4nc(N5CCOCC5)nc(N5CCOCC5)n4)c(OC)c3)C2=O)cc1	97962175	UDHXIJVBCWUDRE-XLNRJJMWSA-N	617.619	2.861	10	40	KFCB	
O=C(CN1C(=O)S/C(=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O)Nc1ccc2c(c1)OCO2	409159101	YWWZNOBRSRYCMR-JMIUGGIZSA-N	512.500	2.835	10	40	KFCB	
COc1cccc(-n2c(C)cc(/C=C3/C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)c2C)c1	102463916	HPYPPEJKADXQFD-JRRXTTBFSA-N	506.588	2.971	10	40	KFCB	
COC(=O)COc1c(I)cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1I	408949570	IJSTWEDSGCJEHX-UUILKARUSA-N	676.157	2.843	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1cc(OC)ccc1OC	409093731	ASTQVILOAKJHNS-OXWVMCNISA-N	576.719	2.957	10	40	KFCB	
CN(C)c1ccc(/C=c2/sc3n(c2=O)N[C@@]2(c4ccccc4)N(C)C(=O)N(C)[C@]2(c2ccccc2)N=3)cc1	12416616	JETDYKDVQXDARZ-RQOBVMAJSA-N	524.650	2.685	10	40	KFCB	
CC1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)/C1=C/C=C/C=C\[C@H]1C(=O)N(c2ccc(S(=O)(=O)O)cc2)N=C1C	72099783	ZYEKPKUEHLUSET-AVYQFLCFSA-N	570.605	2.980	10	40	KFCB	
COc1c2c(cc3c1[C@H](CN/C=C1\C(=O)NC(=S)N(c4ccc(Cl)cc4)C1=O)N(C)CC3)OCO2	104011255	FBJUFGDGFZANNP-KGZWWPETSA-N	514.991	2.528	10	40	KFCB	
Cc1ccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3C[C@H](O)CN3S(=O)(=O)c3ccccc3[N+](=O)[O-])c2C)cc1	103128843	FWEYHHWNNREBBK-REWPJTCUSA-N	541.582	2.861	10	40	KFCB	
COc1ccc(-c2cc(=O)oc3cc(O[C@@H]4O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)ccc23)cc1	70699822	NLTZHTNYGKGSQR-LXRLAABLSA-N	598.557	2.931	10	40	KFCB	biogenic
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1ccccc1OC	140583151	PLDHDHLRMAHQGO-LBKCIFGTSA-N	519.623	2.644	10	40	KFCB	
CCc1ccc(N2C(=O)NC(=O)/C(=C/c3cc(I)c(OCC(=O)O)c(OC)c3)C2=O)cc1	408982892	ITPXRDGWFMXJFD-NVNXTCNLSA-N	550.305	2.992	10	40	KFCB	
COc1ccc(N2C(=O)/C(=C/c3cc(I)c(O)c(OC)c3)C(=O)NC2=S)c(OC)c1	409084495	CYAJZCIGGLTWDG-WUXMJOGZSA-N	540.335	2.854	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1ccc(F)cc1	409056131	FFGTYKVLNWCCGY-KZVLXBEFSA-N	507.587	2.774	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc(Cl)c1OCC(N)=O	409224377	JPZFXXHTCJBHGE-AWNIVKPZSA-N	508.712	2.642	10	40	KFCB	
COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccc(NS(C)(=O)=O)cc4)o3)CC2)cc1	13496169	IYRNRPRAAUQDSC-UHFFFAOYSA-N	503.606	2.558	10	40	KFCB	
COc1ccc(C(=O)Oc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(C)(=O)=O)cc2OC)cc1	20206221	QBYQWWLYWRKDJY-IQGAPNPZSA-N	514.541	2.544	10	40	KFCB	
O=[N+]([O-])C(Br)(Br)/[N+]([O-])=N/c1nonc1/N=[N+](\[O-])C(Br)(Br)[N+](=O)[O-]	102826204	WYYYPLWAGSHLNW-FOIMCPNXSA-N	591.709	2.613	10	40	KFCB	
CCOC(=O)c1ccc(N2CCN(C(=S)NC(=O)/C=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)CC2)c([N+](=O)[O-])c1	408571459	BUKKZHYIJWQCDB-XBXARRHUSA-N	598.638	2.753	10	40	KFCB	
CCc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1=O	408527222	FMSOUHOXPUXCSH-XMHGGMMESA-N	563.430	2.611	10	40	KFCB	
CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C\c1ccc(CNC(=O)C(=O)Nc2cccc(Cl)c2)o1	9553947	AWSXLPFZZVQMJY-MOSHPQCFSA-N	515.950	2.897	10	40	KFCB	
CN(C)CCN(C)c1ccc2c(c1)CNCC(=O)N1CC[C@@H](CC(=O)NCCc3cccc(O)c3)[C@@H](CCCO2)C1	72320720	PIPNEQZEYWEHBO-UIOOFZCWSA-N	565.759	2.866	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc(I)c1OC	408846278	IEANYZBDVBPQAK-LFYBBSHMSA-N	522.251	2.704	10	40	KFCB	
NC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1Br	409224937	OAIQJARQAQZKLR-UUILKARUSA-N	568.134	2.650	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3ccc(S(=O)(=O)N4CCOCC4)cc3C)C2=O)c(C)cc1Br	408526660	CXBTYDSOZOSAKA-QGOAFFKASA-N	577.457	2.974	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc([N+](=O)[O-])ccc3OC)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	408724728	BEZSTECYVSKBFG-XOYGFPHKSA-N	522.583	2.781	10	40	KFCB	
CCc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(OCC(=O)O)c(I)c3)C2=O)cc1	408982070	FLXBBNQLIFFTGJ-DHDCSXOGSA-N	520.279	2.983	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2)cc1	6135971	DIYJAWIFXCMYIO-DENIHFKCSA-N	522.631	2.574	10	40	KFCB	
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	97969044	PEFMGIDTVYFVCQ-SXVVZBAKSA-N	630.491	2.733	10	40	KFCB	
CCOc1cccc(N2C(=O)/C(=C\c3cn(CC(=O)N4CCOCC4)c4ccccc34)C(=O)NC2=S)c1	8843326	KCXPKYVSLBXVMH-HMAPJEAMSA-N	518.595	2.730	10	40	KFCB	
COCCCNC(=O)Cn1cc(/C=C2/C(=O)NC(=O)N(C3CCCC3)C2=O)c2cc(Br)ccc21	409194243	INOPVRZSOHMQSO-ODLFYWEKSA-N	531.407	2.961	10	40	KFCB	
COc1ccc(CN2C(=O)/C(=C/c3c(N4CCC(C(N)=O)CC4)nc4ccccn4c3=O)SC2=S)cc1	1805209	UCUZEVFOTFQFAC-ZHZULCJRSA-N	535.651	2.806	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC2CCCC2)N(Cc2cccnc2)C(=O)c2snc(C(N)=O)c2N)cc1	6135921	BQKZRBFYGMWXSE-JOCHJYFZSA-N	521.647	2.728	10	40	KFCB	
CCOC(=O)C1CCN(c2nc3c(C)cccn3c(=O)c2/C=C2/SC(=S)N(CCCC(=O)O)C2=O)CC1	97957623	OMOKHHNYJMEQEN-NBVRZTHBSA-N	544.655	2.848	10	40	KFCB	
COc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)c2C)c(OC)c1	101176778	UNGQJMYXYSMIPT-NMESBGBPSA-N	536.614	2.979	10	40	KFCB	
Cc1c(Br)ccc(N2C(=O)NC(=O)/C(=C\Nc3cc4c(cc3N3CCN(C)CC3)n(C)c(=O)n4C)C2=O)c1C	408534296	QEMOQLSQHOOBJZ-SAPNQHFASA-N	596.486	2.587	10	40	KFCB	
CCOC(=O)COc1c(I)cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1OC	409338541	LSQCDYUZPPVYTJ-SDQBBNPISA-N	537.353	2.528	10	40	KFCB	
Cc1ccc2nc(NCCOCCO)c(/C=C3\SC(=S)N(Cc4ccc(F)cc4)C3=O)c(=O)n2c1	8858382	LYBLQTPOTFJZQM-UNOMPAQXSA-N	514.604	2.964	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1cccc(C)c1	409044786	DHPFERKCEZWGPI-UHFFFAOYSA-N	504.362	2.698	10	40	KFCB	
CCc1ccccc1NC(=O)CN1C(=O)N/C(=C/c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)C1=O	409251620	VAOLRVSZPAJPHT-OEAKJJBVSA-N	521.599	2.835	10	40	KFCB	
CCOc1ccc([C@H]2C(C(=O)OC)=CN=c3s/c(=C\c4ccc(N(C)C)cc4)c(=O)n32)cc1OCC	408933232	IQWOWFRHVXEDTQ-BJYRUZDYSA-N	507.612	2.882	10	40	KFCB	
COC[C@@H]1CCCN1c1ccc2c(c1)CNCC(=O)N1CC[C@@H](CC(=O)NCc3ccncc3)[C@@H](/C=C/CO2)C1	100035032	XMXKELGDWWERQE-QEHVKJNZSA-N	547.700	2.906	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(Cc4ccco4)C3=O)c(N3CCC(C(N)=O)CC3)nc12	2417039	FDFQXEVCLGWPCU-PDGQHHTCSA-N	509.613	2.699	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	70705358	HPHNEOJMOVENCK-UTHFEYLPSA-N	561.978	2.999	10	40	KFCB	biogenic
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1OC	409380818	AXIADBUEUDGKNS-UHFFFAOYSA-N	518.320	2.623	10	40	KFCB	
O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc(Br)c(OCC(=O)N2CCOCC2)c(Br)c1	409399792	MKRMHABFSZCPMC-YBEGLDIGSA-N	565.218	2.911	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1Cc1ccccc1	16020935	CZTOQNOGECBLFJ-YRCDICCDSA-N	503.942	2.915	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc4c(cc3C)OCO4)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	693910	VATQZPQDAIPFME-RWTNITNYSA-N	505.596	2.901	10	40	KFCB	
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(N(C)C)cc2)c1	6442195	HIWZPNAOSVUXEC-OFNKIYASSA-N	536.658	2.882	10	40	KFCB	
COc1ccc([C@H](CC(=O)NCCc2ccc(O)c(O)c2)c2c(O)nc3ccccn3c2=O)cc1OC	96221392	IHZHENSDJPWTSW-SFHVURJKSA-N	505.527	2.709	10	40	KFCB	biogenic
COCCNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)cc1C	6195257	VIEIGAIZOIERSJ-JOCHJYFZSA-N	524.647	2.658	10	40	KFCB	
COc1cccc(N2C(=O)N=C(O)/C(=C\c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]3CCCN43)C2=O)c1	97967883	NTNMIPQDOQQOQK-IMEWXKHHSA-N	557.563	2.764	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@@H]1c1cc(OC)ccc1OC	409094867	GLCPYGDKZWINFS-YNMQQHPQSA-N	621.716	2.866	10	40	KFCB	
Cc1cc(NC(=O)CCN2C(=O)/C(=C3\SC(=S)N(CCC(=O)Nc4cc(C)on4)C3=O)SC2=S)no1	11852374	AKFXLKNFTNJDFS-FOCLMDBBSA-N	566.668	2.569	10	40	KFCB	
C[C@H](CCc1ccccc1)N1C(=O)NC(=O)/C(=C\c2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]2CCCN32)C1=O	97967962	FYZXSIGZVOXJIX-CNJVFQIESA-N	583.645	2.731	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3\C(=O)Nc4ccc(Cl)cc43)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409110390	VPIJBVWKZNQTJO-SADKCHQCSA-N	523.014	2.840	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1	6135972	SEWNDRMHHBRPMX-VGOFRKELSA-N	540.621	2.713	10	40	KFCB	
COc1ccc(S(=O)(=O)N2CCOCC2)cc1CCC(=O)NCc1ccc(N2CCCCC2)cc1	225686720	JOTBTPSZKQITAF-UHFFFAOYSA-N	501.649	2.955	10	40	KFCB	
CCOC(=O)c1ccc(N2CCN(C(=O)/C=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)CC2)c([N+](=O)[O-])c1	408572270	HYCSOOLPUSMGRX-XBXARRHUSA-N	539.545	2.878	10	40	KFCB	
CCOC(=O)COc1ccc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)cc1I	408692907	YCTKVDMODVURJS-NTEUORMPSA-N	512.300	2.638	10	40	KFCB	
CS(=O)(=O)C1=NN2C(=N)/C(=C/c3ccc(OS(=O)(=O)c4ccccc4)c(Cl)c3)C(=O)N=C2S1	97964474	KIAFCDKOPRLTEF-XCGHDDSDSA-N	524.989	2.729	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C/c3ccc(Cl)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	5396023	OPMJIWCAYZDKKJ-VXLQEKCDSA-N	586.040	2.624	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1	409044224	UOFXFJYOCQACJS-UHFFFAOYSA-N	504.362	2.780	10	40	KFCB	
COc1ccc(N2C(=O)/C(=C/c3ccc(O)c(I)c3)C(=O)NC2=S)c(OC)c1	409073126	VCGODLHEXURNCB-KPKJPENVSA-N	510.309	2.845	10	40	KFCB	
COc1ccc(C(=O)NN2C(=O)/C(=C3\SC(=S)N(NC(=O)c4ccc(OC)cc4)C3=O)SC2=S)cc1	101016962	VANKLZRTMUQWSY-FOCLMDBBSA-N	560.660	2.626	10	40	KFCB	
CCN1C(=O)/C(=C\c2cn(CC(=O)NCCCOC)c3ccccc23)c2cc(S(=O)(=O)N3CCOCC3)ccc21	8778017	HXNOXZFHOYZGLF-UQQQWYQISA-N	566.680	2.722	10	40	KFCB	
COc1ccc(N2CCC(O)(CN3CCN(C(C)=O)C[C@](O)(COc4cc(C)cc(C)c4)C3)CC2)cc1	585287360	NHBVRLLHGSFIMT-LJAQVGFWSA-N	511.663	2.618	10	40	KFCB	
COc1ccc(CN2C(=O)/C(=C/c3c(NCCOCCO)nc4ccccn4c3=O)SC2=S)cc1	9019374	YTQPTLNDKWRLBM-RGEXLXHISA-N	512.613	2.525	10	40	KFCB	
O=C1CN(Cc2ccccc2O)Cc2ccccc2OCC=C[C@H]2CN1CC[C@H]2CC(=O)N1CC[C@@H](O)C1	958317776	MFVYSTDNWLVUDU-JCYRPKCISA-N	519.642	2.791	10	40	KFCB	
COc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(I)c(O)c([N+](=O)[O-])c3)C2=O)cc1	408740213	JHGYGIYZAFXNOT-WUXMJOGZSA-N	509.212	2.580	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccc(Cl)cc1	409227203	UFCNDBPXKITBPG-UHFFFAOYSA-N	571.780	2.885	10	40	KFCB	
CCOc1ccc(N2C(=O)/C(=C/c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C(=O)NC2=S)cc1	409386114	LFJQMFWJNCYKIA-CPNJWEJPSA-N	574.453	2.917	10	40	KFCB	
COc1ccc(N2CCN(C(=S)NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)CC2)c([N+](=O)[O-])c1	14273738	SIDANHLHDMWDLY-UHFFFAOYSA-N	514.564	2.949	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1Cc1ccccc1Cl	16021699	UYYOJRBRGCNQTK-KKBCGBJISA-N	503.942	2.915	10	40	KFCB	
COCCN1C(=O)/C(=C\c2c(N3CCN(Cc4ccccc4)CC3)nc3ccccn3c2=O)SC1=S	27016324	PCWZQZRICYUHLO-HEHNFIMWSA-N	521.668	2.864	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	101462033	OPMJIWCAYZDKKJ-LLIRCPGMSA-N	586.040	2.624	10	40	KFCB	
COc1ccc(N2C(=O)[C@H]3[C@H](C2=O)C2(N[C@@H]3Cc3ccccc3)C(=O)c3ccccc3C2=O)c([N+](=O)[O-])c1	110564809	QLIYSITUZMKHNC-UEVCKROQSA-N	511.490	2.742	10	40	KFCB	
COc1cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc(I)c1OCC(=O)Nc1ccccc1	408964062	FNSRTFKHPQTNLX-UHFFFAOYSA-N	565.389	2.916	10	40	KFCB	
COCCNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C	6442790	YKCXFVTVGCNGNA-QFIPXVFZSA-N	524.647	2.658	10	40	KFCB	
O=C(CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1	13671225	HOFKOKQDUGWSIX-UHFFFAOYSA-N	510.572	2.943	10	40	KFCB	
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)N/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O	2375760	RFNFKFPCOYYTFA-XYSGSMRZSA-N	511.332	2.771	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	70701379	RKVSPMXKWFVSSN-RBEXELFYSA-N	541.560	2.599	10	40	KFCB	biogenic
CC1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)/C1=C/C=C/C=C\[C@@H]1C(=O)N(c2ccc(S(=O)(=O)O)cc2)N=C1C	256016968	ZYEKPKUEHLUSET-RYXMBWSDSA-N	570.605	2.980	10	40	KFCB	
CCOc1cc(/C=C2\SC(=S)N(NC(=O)c3cccs3)C2=O)ccc1OCC(=O)N1CCOCC1	409204588	ASSCAPKCQFSZNE-UYRXBGFRSA-N	533.653	2.931	10	40	KFCB	
O=C1/C(=C/c2c(NCCCN3CCOCC3)nc3ccccn3c2=O)SC(=S)N1Cc1ccc2c(c1)OCO2	2668270	IYFMWHYNBZDVLE-JCMHNJIXSA-N	565.677	2.959	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(/C=C3/C(=O)N(C(C)C)C(C)=C3C(=O)OC)o2)cc1	409004776	RELWWHKGRDFYGT-FYJGNVAPSA-N	523.542	2.792	10	40	KFCB	
Cc1cccc(N2C(=O)/C(=C/c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C(=O)NC2=S)c1	409382554	OTHHLTQDYCNDAU-LDADJPATSA-N	544.427	2.826	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@H](O[C@]1(c3ccc(O)c(O)c3)Oc3cc(O)cc(O)c3[C@H](O)[C@H]1O)C2	584567037	HGVVOUNEGQIPMS-JOFXVPDFSA-N	594.525	2.733	10	40	KFCB	
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)cc1	3360356	IXPICJBZEQHSMZ-UHFFFAOYSA-N	555.609	2.870	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccccc1	409046681	LEFUWPMXQAAQGU-UHFFFAOYSA-N	551.362	2.622	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc(Br)c1OCC(N)=O	409226820	VYKCKNWJIPSAIO-WUXMJOGZSA-N	522.739	2.950	10	40	KFCB	
CN(C)c1ccc(/C=c2\sc3n(c2=O)N[C@]2(c4ccccc4)N(C)C(=O)N(C)[C@]2(c2ccccc2)N=3)cc1	8686406	JETDYKDVQXDARZ-RQESVVFUSA-N	524.650	2.685	10	40	KFCB	
O=c1cc(CN(Cc2ccc(N3CCOCC3)c(F)c2)Cc2ccc(N3CCOCC3)c(F)c2)nc(N2CCOCC2)[nH]1	59531209	CLTOJGDNOWQUBD-UHFFFAOYSA-N	596.679	2.760	10	40	KFCB	
O=C(O)CN1C(=O)/C(=C\c2cc(I)cc(I)c2O)SC1=S	29491953	RSORDVYPEDPXIA-KRXBUXKQSA-N	547.133	2.887	10	40	KFCB	
CCS(=O)(=O)C1=NN2C(=N)/C(=C/c3ccc(OS(=O)(=O)c4ccc(C)cc4)c(OC)c3)C(=O)N=C2S1	97964744	URYOKBSBEZNZET-GJXXPDGXSA-N	548.624	2.783	10	40	KFCB	
COC(=O)C[C@@H](c1ccc(OCC(N)=O)cc1)c1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc12	97971969	OVIYREYKTPRMLS-HNNXBMFYSA-N	537.477	2.547	10	40	KFCB	biogenic
O=C(O)COc1ccc(/C=C2\C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1I	103851939	ZBKCFCQEKJWOBF-YRNVUSSQSA-N	526.283	2.725	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@@H](c1ccc(O)c(O)c1)[C@H](O)C2	85644761	XFZJEEAOWLFHDH-VLEWNFEKSA-N	578.526	2.995	10	40	KFCB	biogenic,in-vitro
CC(=O)OC[C@@H]1O[C@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O	257346814	WVRUVXYKXRESME-YMHNJPIKSA-N	577.633	2.527	10	40	KFCB	
COC(=O)c1ccc(N2NC(=O)/C(=C\c3cc(I)cc(I)c3O)C2=O)cc1	100165562	GXRDZZDHUCTVAH-NTUHNPAUSA-N	590.111	2.849	10	40	KFCB	
O=C1NC(=O)N(Cc2ccco2)C(=O)/C1=C/c1cc(I)c(O)c(I)c1	409373400	RLUVDQDRCNXLAM-ONNFQVAWSA-N	564.073	2.856	10	40	KFCB	
CCOc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C2=O)c1	409386845	NTNZETXJEXWERV-XDHOZWIPSA-N	558.385	2.752	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(F)c2)cc1	6135960	TUVUMIBOKXCOIB-SIKLNZKXSA-N	540.621	2.713	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C(=O)OC)cc3)C2=O)cc(Br)c1OCC(=O)O	409044312	BDOGBHOHQBEKCN-OVCLIPMQSA-N	547.314	2.764	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3\C(=O)N(C)c4ccc(Br)cc43)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409118279	ZJUPDKNVWOAMRB-RKKARLDVSA-N	581.492	2.973	10	40	KFCB	
COc1ccccc1OCCOc1ccc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)cc1	20205641	RCXIXVFLVJWOSB-NRFXXVESSA-N	500.558	2.774	10	40	KFCB	
N=C(N/C=C1\C(=O)NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2Br)C1=O)N[N+](=O)[O-]	408526694	DDAQRTHGJKEFEB-XNTDXEJSSA-N	531.367	2.689	10	40	KFCB	
COc1ccc(/C=C2\C(=O)NC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc1I	409191542	YRWBYRSLKBCAAS-MDWZMJQESA-N	508.293	2.829	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc(Br)c1OCC(N)=O	409226707	RQOHIDXGTLYVCC-VIZOYTHASA-N	502.321	2.605	10	40	KFCB	
COc1ccc(N2CCN([C@H](CNC(=O)C(=O)NCCc3ccc(OC)c(OC)c3)c3ccco3)CC2)cc1	97990814	GOZURICWNUXQTD-XMMPIXPASA-N	536.629	2.644	10	40	KFCB	
COC(=O)c1ccc(-c2ccc(/C=C3/C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)o2)cc1	101151657	BTPBUZDLCKJVGD-VFHVDCSJSA-N	507.528	2.601	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCCc4ccccc4)C3=O)c(N3CCN(CCO)CC3)nc12	100913171	DPWQZUILHYFUOH-NMWGTECJSA-N	549.722	2.951	10	40	KFCB	
CCOc1ccc(NC(=O)[C@H](/N=N/c2ccc(S(=O)(=O)N[C@H]3ON[C@@H](C)[C@H]3C)cc2)C(C)=O)cc1	104124222	KOXFRJDYKODYFV-XOLREESZSA-N	503.581	2.929	10	40	KFCB	
Cc1cc(C(=O)COC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc3c(c2)OCCO3)c(C)n1-c1ccc(F)cc1	102778251	WLSRZIXQWKAJDK-REWPJTCUSA-N	558.584	2.554	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc(I)c1OCC(N)=O	409223943	HTHXFJYEEMYUFX-AWNIVKPZSA-N	600.163	2.593	10	40	KFCB	
COc1c2c(cc3c1[C@@H](CN/C=C1/C(=O)NC(=S)N(c4ccccc4Cl)C1=O)N(C)CC3)OCO2	20410719	ZSLFRYBKYJNVJZ-OOXMNIKJSA-N	514.991	2.528	10	40	KFCB	biogenic
CC(=O)OC[C@@H]1O[C@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	257346813	WVRUVXYKXRESME-PNBPWNQHSA-N	577.633	2.527	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(N4CCN(C)CC4)nc4ccccn4c3=O)SC2=S)cc1	9411949	WLEWIAAZNUTLNG-FXBPSFAMSA-N	521.668	2.899	10	40	KFCB	
COc1ccc(-n2c(C)cc(/C=C3/C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)c2C)cc1	103596403	OWQNCBZMPAVGKB-ZQCYNNBZSA-N	506.588	2.971	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc(I)c1OCC(N)=O	409227371	YASWLULJJRJGRA-WLRTZDKTSA-N	569.739	2.792	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1Cc1ccc2c(c1)OCO2	101337743	ZNSVCGMGGRDYOL-VLRVBGRWSA-N	547.951	2.643	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OC)c(OC)c3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	8435154	QYYRTFLBQRQDGV-WLGHQHAYSA-N	507.612	2.882	10	40	KFCB	
Cc1c(Br)ccc(N2C(=O)NC(=O)/C(=C\Nc3cc4c(cc3N(C)C)n(C)c(=O)n4C)C2=O)c1C	408537179	ZJQKJWMLFSKAMF-SDNWHVSQSA-N	541.406	2.901	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3cc4c(cc3N(C)C)n(C)c(=O)n4C)C2=O)ccc1Br	408534219	PSCRBEUDPNUNBI-SDNWHVSQSA-N	527.379	2.593	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N(C)C)cc3)c(=O)n2[C@H]1c1ccc(OC(C)=O)cc1	8934367	RGQKPLINGCLMJI-NLZIUFDSSA-N	505.596	2.790	10	40	KFCB	
CCOc1cc(/C=C2\SC(=S)N(CCC(=O)O)C2=O)cc(Br)c1OCC(=O)N1CCOCC1	206828005	AIXVGGBTWUDABK-WJDWOHSUSA-N	559.460	2.761	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc([N+](=O)[O-])ccc3OC)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	408724731	BEZSTECYVSKBFG-YJADQXIJSA-N	522.583	2.781	10	40	KFCB	
COc1cc(/C=C2\SC(=S)N(NC(=O)c3cccs3)C2=O)ccc1OCC(=O)N1CCOCC1	409200274	KNPWNNCOWVVUOM-PDGQHHTCSA-N	519.626	2.541	10	40	KFCB	
O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc(I)c(OCC(=O)N2CCOCC2)c(I)c1	409399581	JUQRVUVPCVGCKH-YBEGLDIGSA-N	659.218	2.595	10	40	KFCB	
CN(C)c1ccc(/C=c2\sc3n(c2=O)N[C@@]2(c4ccccc4)N(C)C(=O)N(C)[C@@]2(c2ccccc2)N=3)cc1	8686408	JETDYKDVQXDARZ-ZAOWZGNRSA-N	524.650	2.685	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@]1(c3ccc(O)c(O)c3)Oc3cc(O)c4c(c3[C@H]2[C@@H]1O)O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C4	95619977	NSEWTSAADLNHNH-VCFSXNJSSA-N	576.510	2.794	10	40	KFCB	endogenous,in-man
CCC(COC(=O)COc1ccc(N)cc1)(COC(=O)COc1ccc(N)cc1)COC(=O)COc1ccc(N)cc1	263583608	NEXKIRLLNDHJFI-UHFFFAOYSA-N	581.622	2.996	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(C)C2=O)cc(I)c1OCc1cccc(C(=O)O)c1	100236909	UUXUGJLHSZYYGH-VGOFMYFVSA-N	552.346	2.834	10	40	KFCB	
O=C(CCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2	100744943	WCAAKXYKKCDSNY-CZNNXAQKSA-N	509.609	2.814	10	40	KFCB	biogenic
Cc1c(Br)ccc(N2C(=O)NC(=O)/C(=C\Nc3cc4c(cc3N3CCOCC3)n(C)c(=O)n4C)C2=O)c1C	408536355	WFUUGGKQSUKMMD-DTQAZKPQSA-N	583.443	2.672	10	40	KFCB	
COCCNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(C)c(C)c1	6280345	MNKOCIQVQSPMIC-JOCHJYFZSA-N	524.647	2.658	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1c1ccc2c(c1)OCO2	101329797	ACZWXHOAECGOCZ-XZDVHOLPSA-N	533.924	2.648	10	40	KFCB	
CCCCCCN1C(=O)/C(=C/Nc2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]2CCCN32)C(=O)N=C1S	101375233	LKAVKKQHLVNHLM-HCUHUEOSSA-N	566.684	2.779	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3cc4c(cc3[N+](=O)[O-])n(C)c(=O)n4C)C2=O)c(C)cc1Br	408534234	PTUAQHVXSORLEI-FMIVXFBMSA-N	543.334	2.743	10	40	KFCB	
O=C1NC(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1cn(CC(=O)N2CCOCC2)c2ccccc12	408961213	LIQYXTWIATVSSA-UDWIEESQSA-N	508.987	2.985	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2	1560403843	RXHPRHKHJDHUOI-QZNVCQCUSA-N	577.518	2.834	10	40	KFCB	
COc1ccc(N2CCN(CCCNC(=O)c3ccc4c(=O)n(CCc5ccccc5)c(=O)[nH]c4c3)CC2)cc1	4766498	NXJFKZJOMPHDIX-UHFFFAOYSA-N	541.652	2.883	10	40	KFCB	
COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C/c1ccc(CNS(=O)(=O)c2ccc(C)cc2)o1	408905490	ATKIXSJTHFECMG-CCULFSDZSA-N	500.573	2.918	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1	6135881	SEWNDRMHHBRPMX-VGSWGCGISA-N	540.621	2.713	10	40	KFCB	
Cc1ccc2nc(N3C[C@@H](C)O[C@H](C)C3)c(/C=C3\SC(=S)N(C[C@@H]4CCCO4)C3=O)c(=O)n2c1	9019847	WRBQEILSEGXANK-ZETHUUBFSA-N	500.646	2.997	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	70701373	RKVSPMXKWFVSSN-ZLEDHLGDSA-N	541.560	2.599	10	40	KFCB	biogenic
O=C(CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)Nc3ccccn3)C2=O)SC1=S)Nc1ccccn1	100431249	NUELBJGWFBFWFD-ISLYRVAYSA-N	558.692	2.766	10	40	KFCB	
NC(=O)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1Br	409227269	YTOGOEXTRLAXOQ-NTUHNPAUSA-N	523.137	2.742	10	40	KFCB	
O=C1NC(=S)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc(OCC(=O)N2CCOCC2)cc1	409242913	PRMJFRXENLSUDF-XDHOZWIPSA-N	530.400	2.518	10	40	KFCB	
O=C(C[C@@H]1CCN2C[C@@H]1CCCOc1ccc(N3CCNCC3)cc1CNCC2=O)NCc1ccccc1F	67879049	WYVZTIJIVGAPDG-UPVQGACJSA-N	537.680	2.669	10	40	KFCB	
CC(C)CC(=O)O[C@@H]1[C@H](N2CCOCC2)c2c(ccc(/C=C/C(=O)N3CCOCC3)c2O)OC1(C)C	19229460	HABFVMRKJUPSNL-MCUHZYOPSA-N	502.608	2.766	10	40	KFCB	biogenic
C[C@H]1CCCN(Cc2c(O)c(CN3CCC[C@@H](C)C3)c(O)c3c(=O)c(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)coc23)C1	150344932	JWVPRIUMDUETIT-QMGZIDCMSA-N	654.757	2.514	10	40	KFCB	
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(N(C)C)cc2)c1	6442194	HIWZPNAOSVUXEC-REWPJTCUSA-N	536.658	2.882	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc(Br)c1OCC(N)=O	409224573	KUOBSVBAYREZEW-AWNIVKPZSA-N	508.712	2.642	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc(OC(C)=O)cc4)C(=O)[C@H]31)C(=O)N2	70701245	DEYSWADUDUVMAW-AKKJASCUSA-N	541.560	2.753	10	40	KFCB	biogenic
CCOC(=O)C[C@H]1C(=O)NCCN1c1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(Cc2ccc(C)cc2)C1=O	97957649	YTDZQZIKTGZOPL-RUAJRXAUSA-N	577.688	2.662	10	40	KFCB	
CCOc1cccc(N2C(=O)/C(=C/c3cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c3C)C(=O)NC2=S)c1	408967985	WFVJXEMENWCZJR-LPYMAVHISA-N	524.624	2.972	10	40	KFCB	
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OCc2ccccc2)cccc1C3=O	104196925	SRILNPQAKDAONQ-GLEYTSKXSA-N	603.624	2.599	10	40	KFCB	
COC(=O)COc1c(I)cc(/C=C2/C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1OC	408919276	VTMKHNATXZMJJF-AUWJEWJLSA-N	570.336	2.822	10	40	KFCB	
Cc1cc(/C=C2\SC(=O)N(CC(=O)N3CCOCC3)C2=O)c(C)n1-c1ccc(N2CCOCC2)cc1	106709598	AJBOKNAQLIACMZ-KQWNVCNZSA-N	510.616	2.826	10	40	KFCB	
COc1ccc(N2CCN(CCCNC(=O)CCn3c(=S)[nH]c4cc5c(cc4c3=O)OCO5)CC2)cc1	20644456	UHIOUDLCXFIERX-UHFFFAOYSA-N	525.631	2.515	10	40	KFCB	
CC(=O)NS(=O)(=O)c1ccc(-c2ccc(/C=C3/C(=O)NN(c4ccc(Br)cc4)C3=O)o2)cc1	100165897	ZFQPFZMSDBEHSF-UNOMPAQXSA-N	530.356	2.995	10	40	KFCB	
CCN1C(=O)/C(=C\c2ccc(Oc3nc(N4CCOCC4)nc(N4CCOCC4)n3)c(OC)c2)SC1=S	113830763	IGTOLVUHCOANLH-XDJHFCHBSA-N	544.659	2.567	10	40	KFCB	
O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	408902891	NBGILQNZSZWGGO-LFIBNONCSA-N	501.293	2.860	10	40	KFCB	
O=C(O[C@H](Cc1ccc(O)c(O)c1)C(=O)O)C1=Cc2ccc(O)c(O)c2[C@@H](c2ccc(O)c(O)c2)[C@@H]1C(=O)O[C@@H](Cc1ccc(O)c(O)c1)C(=O)O	514287826	CWAPEEAMMSAHDI-VVFTXPSUSA-N	718.620	2.955	10	40	KFCB	biogenic,in-vitro
COc1ccc(Cn2c(=O)[nH]c3cc(C(=O)N4CCN(c5ccc(OC)cc5)CC4)ccc3c2=O)cc1	4766463	XDIDOMHMMPEAEZ-UHFFFAOYSA-N	500.555	2.718	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N(C)C)cc3)c(=O)n2[C@@H]1c1ccc(OC)cc1OC	6354103	UMNDFHWTALFGQT-MGSPXPDISA-N	507.612	2.882	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCN(C)CC4)c([N+](=O)[O-])c3)c(=O)n2[C@@H]1c1ccccc1OC	409099244	KIHHWWBHIHXKPS-RBRLEXCSSA-N	604.733	2.772	10	40	KFCB	
CCCCCCN1C(=O)/C(=C/c2c(N3CCN(CCO)CC3)nc3c(C)cccn3c2=O)SC1=S	20080585	WCPFFXSSBHICLJ-JZJYNLBNSA-N	515.705	2.899	10	40	KFCB	
CCOC(=O)CC1=NN(c2ccccc2)C(=O)/C1=c1/s/c(=C2\SC(C)=C(C)N2CC)c(=O)n1CC	28615417	MZWDRDCVBKCAIB-AIMKKSDKSA-N	512.657	2.822	10	40	KFCB	
COc1c2c(cc3c1[C@H](CN/C=C1/C(=O)NC(=S)N(c4ccc(Cl)cc4)C1=O)N(C)CC3)OCO2	20410711	FBJUFGDGFZANNP-RNIVLKNTSA-N	514.991	2.528	10	40	KFCB	biogenic
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCc1ccccc1F	113832643	YVASMHUARYHILQ-UHFFFAOYSA-N	512.300	2.932	10	40	KFCB	
CCOC(=O)/C=c1\s/c(=C/c2ccc(N(C)C)cc2)c(=O)n1Cc1cc(Cl)cc2c1OCOC2	97993886	AGZLQIYGDFUZKP-XFMFAQHNSA-N	501.004	2.716	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cn(CC(=O)N4CCOCC4)c4ccccc34)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409175400	RGEFVDNEKXMSKW-AHNSQEAUSA-N	613.740	2.678	10	40	KFCB	
Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C2=O)c1C	409379587	XZBZZJLJOMMAMQ-LDADJPATSA-N	542.386	2.970	10	40	KFCB	
CCOc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]3CCCN43)C(=O)N=C2O)cc1	97968054	HVEYVVJMWORFFO-JDCXBEBJSA-N	571.590	2.518	10	40	KFCB	
CCOC(=O)CNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C	6089360	IFYNXRJQLQNXCQ-QHCPKHFHSA-N	552.657	2.574	10	40	KFCB	
Cc1cc(S(=O)(=O)N2CCOCC2)ccc1N/C=C1\C(=O)NC(=O)N(c2ccc(Br)c(C)c2C)C1=O	408526137	ADUDJIFHKMPKMQ-QGOAFFKASA-N	577.457	2.974	10	40	KFCB	
COCCNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1C	6195591	WMSFFFQUAUULND-JOCHJYFZSA-N	524.647	2.658	10	40	KFCB	
CCCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Br)ccc3OCC(N)=O)C2=O)cc1OC	409223711	IATVULLGVIYNDB-MHWRWJLKSA-N	532.347	2.777	10	40	KFCB	
COC(=O)c1cc(C(=O)OC)cc(N2C(=O)[C@@H]3[C@H](c4ccccc4)OC4(C(=O)c5ccccc5C4=O)[C@@H]3C2=O)c1	101993319	JLRILKQBCDQYDO-VABKMULXSA-N	539.496	2.955	10	40	KFCB	
CCN1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)CC1	100763706	BZQWXPLYLPYHFZ-STZFKDTASA-N	535.651	2.967	10	40	KFCB	
CCOCCCN1C(=O)/C(=C/c2c(N3CCN(CC)CC3)nc3ccc(C)cn3c2=O)SC1=S	8858044	DUVIJGRVTQTHCQ-CYVLTUHYSA-N	501.678	2.773	10	40	KFCB	
Cc1ccc(C)c(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@H]3CCCN43)C(=O)N=C2O)c1	97968312	QDAOMBVLIZUCNM-POEBIKTISA-N	555.591	2.736	10	40	KFCB	
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	101572358	WVRUVXYKXRESME-GZTGVDHOSA-N	577.633	2.527	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(Cc4ccc5c(c4)OCO5)C3=O)c(NCCCO)nc12	2321671	PSVUPKRQECPHMS-ODLFYWEKSA-N	510.597	2.927	10	40	KFCB	
COc1cc([C@@H](CC(=O)NCCc2ccc(O)c(O)c2)c2c(O)nc3ccccn3c2=O)cc(OC)c1OC	108449474	UCUGEDKGOBIRBI-GOSISDBHSA-N	535.553	2.718	10	40	KFCB	biogenic
COC[C@@H](C)NC1=NN=C(c2cc(C)n(-c3cccc(S(=O)(=O)N4CCOCC4)c3)c2C)CS1	12542350	BYUSDRFYXNZUMQ-MRXNPFEDSA-N	505.666	2.546	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)COC(=O)[C@H](Cc2ccccc2)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1	408679009	CAJACENNBSFFLX-VABKMULXSA-N	504.539	2.908	10	40	KFCB	
CN1C(=O)/C(=C\c2cn(CC(=O)N3CCCC3)c3ccccc23)c2cc(S(=O)(=O)N3CCOCC3)ccc21	8778010	BCJYGBJHMCVDMW-JLPGSUDCSA-N	534.638	2.802	10	40	KFCB	
COc1ccccc1OCCOc1ccc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)cc1	41077759	SVDLNXUUCNUOAJ-NRFXXVESSA-N	500.558	2.774	10	40	KFCB	
COc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)c2C)cc1	9191944	OWQNCBZMPAVGKB-FEGZGKEQSA-N	506.588	2.971	10	40	KFCB	
CC[C@]1(O)C[C@H](O[C@@H]2C[C@H](N(C)C)[C@H](O[C@@H]3C[C@H](O)[C@H](O[C@@H]4CCC(=O)[C@H](C)O4)[C@H](C)O3)[C@@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)ccc(O)c2C3=O)[C@H]1C(=O)OC	257546043	STUJMJDONFVTGM-ZVNPBEBASA-N	827.877	2.863	10	40	KFCB	
NS(=O)(=O)c1ccc(-c2ccc(/C=C3\C(=O)N(c4ccc(S(N)(=O)=O)cc4)N=C3C(F)(F)F)o2)cc1	2168733	ZBGJYRLZFWKQTM-BOPFTXTBSA-N	540.501	2.590	10	40	KFCB	
C[C@H](OC(=O)CNS(=O)(=O)/C=C/c1ccccc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O	13129465	UAAXRQZRJHOBTF-CLVCIHKQSA-N	518.547	2.923	10	40	KFCB	
COC[C@@H]1CCCN1c1ccc2c(c1)CNCC(=O)N1CC[C@@H](CC(=O)NCc3ccncc3)[C@@H](/C=C\CO2)C1	67878963	XMXKELGDWWERQE-VEHNPLLJSA-N	547.700	2.906	10	40	KFCB	
Cc1cc(C(=O)COC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccccc2[N+](=O)[O-])c(C)n1-c1ccc(F)cc1	102778380	CNLAGWGHPSEQMI-UGKGYDQZSA-N	545.545	2.691	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1cc(OC)ccc1OC	138386631	MIQGUDIOKKESJB-MKWGYRPRSA-N	549.649	2.652	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@H]1c1ccc(OCC)cc1	409007644	PZXVDXFSANDIAV-ASSGYOTOSA-N	578.647	2.942	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCN(C)CC4)c([N+](=O)[O-])c3)c(=O)n2[C@H]1c1cc(OC)ccc1OC	409092603	XGYAWNRJDAIYNT-HDFSHUSISA-N	634.759	2.781	10	40	KFCB	
COCCn1nnnc1[C@H](c1cc2c(C)cc(C)cc2[nH]c1=O)N1CCN(c2ccc(OC)cc2)CC1	20083567	KGDRBUWGKYTKOR-VWLOTQADSA-N	503.607	2.698	10	40	KFCB	
Cc1ccc2nc(N3CCN(c4ccccc4F)CC3)c(/C=C3\SC(=S)N(CC(=O)O)C3=O)c(=O)n2c1	97947301	IFWOPVZEEQDNDV-UNOMPAQXSA-N	539.614	2.754	10	40	KFCB	
CCOc1cccc(N2C(=O)NC(=O)/C(=C\c3cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c3C)C2=O)c1	408965063	GCSFVBBYIHLQBB-LPYMAVHISA-N	508.556	2.807	10	40	KFCB	
CCOC(=O)C[C@@H]1C(=O)NCCN1C(=O)CCN1C(=O)/C(=C/c2ccc(C(C)(C)C)cc2)SC1=S	26688791	LIIHHEMXBMCJSL-GXYBQNOFSA-N	517.673	2.856	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1c1ccc2c(c1)OCO2	101329802	ACZWXHOAECGOCZ-RVMXKSSSSA-N	533.924	2.648	10	40	KFCB	
COc1ccc(CCN2C(=O)[C@@H]3[C@@H](Cc4ccc(O)c(O)c4)N[C@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1OC	70707320	OHEMAVIQDGBOJN-RBEXELFYSA-N	578.021	2.974	10	40	KFCB	biogenic
CCOC(=O)N1CCN(C(=O)CCCN2C(=O)/C(=C/c3ccc(C(=O)OC)cc3)SC2=S)CC1	8819571	XBVMRJVMDHOXPQ-SDXDJHTJSA-N	505.618	2.755	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	70701377	RKVSPMXKWFVSSN-SJEQQYOWSA-N	541.560	2.599	10	40	KFCB	biogenic
CC(C)C(=O)O[C@H](C(=O)O)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O	253390630	RIVNVLITMUKUQK-GQYYHSHMSA-N	766.661	2.833	10	40	KFCB	biogenic,in-vitro
NC(=O)COc1c(Br)cc(Br)cc1/C=C1/C(=O)NC(=S)N(c2ccccc2)C1=O	409270093	CAWSIVFFIMINMF-QPEQYQDCSA-N	539.205	2.907	10	40	KFCB	
O=C(CCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O	12659663	WCAAKXYKKCDSNY-UTWFGLGRSA-N	509.609	2.814	10	40	KFCB	
O=P(O)(O)c1cc(Cl)ccc1N=Nc1c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c2c1O	604972773	MEAUOUSSRBVKRD-UHFFFAOYSA-N	538.836	2.616	10	40	KFCB	
COc1c(/C=C2/C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)c(CCN(C)C(C)=O)cc2c1OCO2	70686841	CHEQEKDFHVIFOO-WQRHYEAKSA-N	544.358	2.874	10	40	KFCB	biogenic
O=C1CCCCCN2C(=O)/C(=C3\SC(=S)N(CCCCCC(=O)N4CCN1CC4)C3=O)SC2=S	101002502	ZEISWAXMOBETDW-ISLYRVAYSA-N	540.758	2.724	10	40	KFCB	
COc1ccc(N2CCN(CCNC(=O)CCc3nnc4n(CCC(C)C)c(=O)c5ccccc5n34)CC2)cc1	585148594	QJNMYIUBIOAAOT-UHFFFAOYSA-N	545.688	2.970	10	40	KFCB	
O=C(O)COc1c(I)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1I	409401498	YSYRLWNZAVKLJT-SDQBBNPISA-N	590.111	2.821	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)[C@@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2	5085286	XFZJEEAOWLFHDH-DNQXJSMESA-N	578.526	2.995	10	40	KFCB	endogenous,in-man
CCc1ccc2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(Cc4ccc(F)cc4)C(=O)[C@H]31)C(=O)N2	16020003	HMFPPESKNCQDQF-XOSJJEKJSA-N	515.541	2.963	10	40	KFCB	
COc1ccc(N2CCN([C@@H](c3cc4cc5c(cc4[nH]c3=O)OCO5)c3nnnn3C(C)(C)C)CC2)cc1	20084292	NLKNIXKGHKYSGJ-DEOSSOPVSA-N	517.590	2.919	10	40	KFCB	
O=C(CN1C(=O)S/C(=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O)Nc1ccc2c(c1)OCCO2	409205581	QVDWEYFIIAULGQ-MTJSOVHGSA-N	526.527	2.878	10	40	KFCB	
O=C1NC(=S)NC(=O)C1=Cc1cc(Br)ccc1OS(=O)(=O)c1ccc(Cl)cc1	409070563	ZORXKINUOZCYKN-UHFFFAOYSA-N	501.767	2.785	10	40	KFCB	
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CSc1ccccc1)C[C@H]3O[C@H]1C[C@@H](N)[C@@H](O)[C@@H](C)O1	150388718	WXRBTXBZCINPCH-NEMSRTFTSA-N	635.691	2.801	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1ccc(OC)cc1OC	166816996	VOWGKZHTYODPMR-OCEWKHMESA-N	549.649	2.652	10	40	KFCB	
O=C1/C(=C/c2c(N3CCc4ccccc4C3)nc3ccccn3c2=O)SC(=S)N1[C@H]1CCS(=O)(=O)C1	101231065	FZIJJKBDLJWLMG-YNGKYYQNSA-N	538.676	2.646	10	40	KFCB	
Cc1ccc(N2C(=O)/C(=C/c3cn(CC(=O)N4CCOCC4)c4ccccc34)C(=O)NC2=S)c(C)c1	408959983	BLBQAENJOZMYGY-KGENOOAVSA-N	502.596	2.948	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(CCc4ccccc4)C3=O)c(NCCOCCO)nc12	8834816	FSCBRAURVDXRQS-SILNSSARSA-N	510.641	2.868	10	40	KFCB	
O=C1/C(=C/c2c(N3CCN(c4ccc(F)cc4)CC3)nc3ccccn3c2=O)SC(=S)N1[C@@H]1CCS(=O)(=O)C1	97946762	VLOSGYIYJKAFHQ-CBAAQYGVSA-N	585.708	2.549	10	40	KFCB	
O=C(O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1I	408952344	NJXWRKTVGDSRFU-QDEBKDIKSA-N	615.130	2.912	10	40	KFCB	
COc1ccc(CCN2C(=O)N=C(O)/C(=C/Nc3c(C)n(C)n(-c4ccccc4)c3=O)C2=O)cc1OC	102560854	RJVZFTWXHLLSNV-CYVLTUHYSA-N	505.531	2.959	10	40	KFCB	
Cc1ccc2nc(N3C[C@H](C)O[C@H](C)C3)c(/C=C3\SC(=S)N(C[C@H]4CCCO4)C3=O)c(=O)n2c1	9358415	WRBQEILSEGXANK-XKNINFAASA-N	500.646	2.997	10	40	KFCB	
COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1	9354702	GEICZAPQVFMVBF-UHFFFAOYSA-N	522.579	2.998	10	40	KFCB	
COC(=O)c1ccc(N2C(=O)NC(=O)/C(=C/c3cc(Br)cc(Br)c3OCC(N)=O)C2=O)cc1	409259968	ILWQMOXOYZIUQF-AUWJEWJLSA-N	581.173	2.529	10	40	KFCB	
COc1cc(C=C2C(=O)N(C)C(=O)N(C)C2=O)cc(Br)c1OS(=O)(=O)c1ccc(C)cc1	59222220	QQGXWTBVMVOIPV-UHFFFAOYSA-N	523.361	2.968	10	40	KFCB	
CC(=O)CCc1ccc(O[C@@H]2O[C@H](COC(=O)/C=C/c3ccccc3)[C@@H](O)[C@H](O)[C@H]2OC(=O)c2cc(O)c(O)c(O)c2)cc1	139674745	AHLBWJHZDLMJOJ-SIHJTGPPSA-N	608.596	2.633	10	40	KFCB	biogenic,in-vitro
O=C1CCCCCN2C(=O)C(=C3SC(=S)N(CCCCCC(=O)N4CCN1CC4)C3=O)SC2=S	585680220	ZEISWAXMOBETDW-UHFFFAOYSA-N	540.758	2.724	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2)cc1	6135962	DIYJAWIFXCMYIO-SIKLNZKXSA-N	522.631	2.574	10	40	KFCB	
COCCn1nnnc1[C@H](c1cc2cc(C)c(C)cc2[nH]c1=O)N1CCN(c2ccc(OC)cc2)CC1	20083676	KENXUZBHFVCCJR-VWLOTQADSA-N	503.607	2.698	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1c1ccc2c(c1)OCO2	101329800	ACZWXHOAECGOCZ-BPTZTRGCSA-N	533.924	2.648	10	40	KFCB	
CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C/NCCN1CCN(C(=O)Cc2ccc(Cl)cc2)CC1	101392061	OKNCUROTWIKHIH-HAVVHWLPSA-N	510.982	2.831	10	40	KFCB	
Cc1ccc(CN2C(=O)/C(=C/c3c(N4CCN(CCO)CC4)nc4ccccn4c3=O)SC2=S)cc1	20080971	MWPSGOPGPYFQLV-PGMHBOJBSA-N	521.668	2.519	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(OC)cc1	409389412	YSPDTDKOADJQTD-UHFFFAOYSA-N	518.320	2.623	10	40	KFCB	
O=C(CN(c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1	13670263	NROOVSLCQXFCLN-UHFFFAOYSA-N	510.572	2.943	10	40	KFCB	
O=C1NC(=O)N(c2cccc(Br)c2)C(=O)/C1=C/c1cn(CC(=O)N2CCOCC2)c2ccccc12	101504416	AKVKHZNKSNCKCR-UDWIEESQSA-N	537.370	2.929	10	40	KFCB	
CCOC(=O)COc1c(I)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1OC	409405535	HQDYOZLSACOOGM-DHDCSXOGSA-N	522.295	2.703	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4cc(OC)ccc4[nH]c3=O)c3nnnn3C[C@H]3CCCO3)CC2)cc1	19940672	VGPDJZRKTGNLHW-ZEQKJWHPSA-N	531.617	2.622	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc(I)c1OC	409189719	NJLDQEUPSCNZJH-NTUHNPAUSA-N	538.319	2.838	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cc(OC)c(OC)cc3OC)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	8450451	AWHFLDQEBGAICK-AQIZGWBQSA-N	537.638	2.890	10	40	KFCB	
Cn1c(=O)n(C)c2cc([C@@H]3CC(=O)Oc4cc(O)c5c(=O)c(O)c(-c6ccc(O)c(O)c6)oc5c43)ccc21	96221847	WSYVLGSHJXBAMJ-ZDUSSCGKSA-N	516.462	2.914	10	40	KFCB	biogenic
CCOc1cc(/C=C2\SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)ccc1OCC(=O)N1CCOCC1	409206349	VBTBOYXGDMJUJN-JCMHNJIXSA-N	557.650	2.878	10	40	KFCB	
CN(C)c1ccc(/C=c2\s/c(=C\C(=O)C(C)(C)C)n(CC(=O)Nc3cccc(S(=O)(=O)N4CCCC4)c3)c2=O)cc1	97982256	HCILWTOYFLQOTJ-UXXYHWAYSA-N	596.775	2.624	10	40	KFCB	
COc1ccc(CN2C(=O)/C(=C/c3c(NCCOCCO)nc4ccc(C)cn4c3=O)SC2=S)cc1	100863815	MEJDIVMNPCZHIK-MOSHPQCFSA-N	526.640	2.834	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)CN2C(=O)C[C@H](N3C(=O)/C(=C\c4ccccc4)SC3=S)C2=O)cc1	101174824	ZAFLMZXTGGBXQJ-LPGQDOADSA-N	523.592	2.831	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1c1ccc2c(c1)OCCO2	101335325	ZEVLNQPGMPTENN-JFRXHZBCSA-N	547.951	2.690	10	40	KFCB	
CN1CCN(C(=O)CCn2ccnc2)CCOc2ccc(N3CCOCC3)cc2Cc2cccc(c2)C1=O	643589047	PQPHEFCSEHFUAY-UHFFFAOYSA-N	517.630	2.694	10	40	KFCB	
CN1C(=O)C(=CNc2ccc(S(=O)(=O)Nc3nccc(/C=C/c4cccc([N+](=O)[O-])c4)n3)cc2)C(=O)N(C)C1=O	100424690	CXCLLCQUURTZFT-VOTSOKGWSA-N	563.552	2.702	10	40	KFCB	
O=C(COC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	102937166	GIQCHVXSLKUUFA-UHFFFAOYSA-N	616.095	2.724	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccc(N(C)C)cc3)c(=O)n2[C@@H]1c1ccc(OCC(=O)OC)c(OCC)c1	409032326	CPXGSHKILVKZCM-KLKBWYFJSA-N	579.675	2.815	10	40	KFCB	
CCOCCCN1C(=O)/C(=C/c2c(N3CCN(CC)CC3)nc3c(C)cccn3c2=O)SC1=S	12112400	JRWMVRDORSLFDX-MNDPQUGUSA-N	501.678	2.773	10	40	KFCB	
Cc1cc(C(=O)COC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c(C)n1-c1ccc(Cl)c(Cl)c1	12542438	QHTKABNVVNJTGW-UHFFFAOYSA-N	518.357	2.574	10	40	KFCB	
COc1c2c(cc3c1[C@@H](CN/C=C1\C(=O)N=C(S)N(c4ccc(Cl)cc4)C1=O)N(C)CC3)OCO2	104148310	FBJUFGDGFZANNP-BRVCPTFNSA-N	514.991	2.939	10	40	KFCB	
CN1C(=O)N(C)C(=O)C2(Cc3cc(/C=C4\C(=O)N=C(O)N(c5ccc(Cl)cc5)C4=O)ccc3N3CCC[C@H]32)C1=O	97968175	DRKBQPRJNFZVJT-YMFQVDJJSA-N	561.982	2.773	10	40	KFCB	
Cn1c(=O)n(C)c2cc([C@H]3CC(=O)Oc4cc(O)c5c(=O)c(O)c(-c6ccc(O)c(O)c6)oc5c43)ccc21	96221848	WSYVLGSHJXBAMJ-CYBMUJFWSA-N	516.462	2.914	10	40	KFCB	biogenic
CN(C)c1ccc(/C=c2/s/c(=C\C(=O)C(C)(C)C)n(CC(=O)Nc3cccc(S(=O)(=O)N4CCCC4)c3)c2=O)cc1	102959269	HCILWTOYFLQOTJ-ZADLHCRYSA-N	596.775	2.624	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N(C)C)cc3)c(=O)n2[C@@H]1c1ccc(OC(C)=O)cc1	8934366	RGQKPLINGCLMJI-WLGHQHAYSA-N	505.596	2.790	10	40	KFCB	
COc1cccc(OCCOc2ccc(/C=C3/C(=N)N4N=C(S(C)(=O)=O)SC4=NC3=O)cc2OC)c1	97964394	FEUPBUHRZKHAMB-GQZSXMDHSA-N	530.584	2.783	10	40	KFCB	
COc1ccc(C(=O)Oc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(C)(=O)=O)cc2OC)cc1OC	97964517	DZIBCRQSMDMEQH-LGAXMMIFSA-N	544.567	2.553	10	40	KFCB	
CCc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	408528131	FGYRVPGGCOPXRA-GANRHZMWSA-N	503.309	2.710	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc(I)c1OCC(N)=O	409220413	YXSSOAZDZHTKTK-WLRTZDKTSA-N	569.739	2.792	10	40	KFCB	
CC(C)(C)NC(=O)CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)NC(C)(C)C)C2=O)SC1=S	8819080	TZJQFSZZPLDMEJ-BUHFOSPRSA-N	516.736	2.528	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccc(C)cc1C	409267224	MOYSIFDQMFKTFL-UHFFFAOYSA-N	565.389	2.848	10	40	KFCB	
COC(=O)C1=C(C(=O)OC)C2(O[C@H]1c1ccc(I)cc1)C(=O)c1ccccc1C2=O	97951600	OOABMVHELSINOX-KRWDZBQOSA-N	518.259	2.823	10	40	KFCB	
CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C/c1ccc(CNC(=O)C(=O)Nc2cccc(Cl)c2)o1	100233320	AWSXLPFZZVQMJY-DEDYPNTBSA-N	515.950	2.897	10	40	KFCB	
O=C(CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)NC3CCCC3)C2=O)SC1=S)NC1CCCC1	101002406	ZJOZIMICADEOQE-ISLYRVAYSA-N	540.758	2.816	10	40	KFCB	
O=C(CN1C(=O)S/C(=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O)Nc1ccccc1N1CCOCC1	409205046	NPAJKCCLZOQBOH-KQWNVCNZSA-N	553.597	2.943	10	40	KFCB	
C[C@H](c1ccccc1)N1C(=O)/C(=C\c2c(N3CCN(CCO)CC3)nc3ccccn3c2=O)SC1=S	26687057	DUIILMSOWFDLEB-DTBMRADHSA-N	521.668	2.771	10	40	KFCB	
NC(=O)C1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(Cc3ccc(F)cc3)C2=O)CC1	100923212	BSPDQOXCVWEYNF-UYRXBGFRSA-N	523.615	2.937	10	40	KFCB	
Cc1ccc(N2C(=O)[C@@H](/C=C3/C(=O)NC(=O)N(c4ccc(Br)c(C)c4)C3=O)C(=O)NC2=S)cc1C	408764411	RUPVGAKLBLQLDJ-RNIVLKNTSA-N	555.410	2.948	10	40	KFCB	
O=C(O)CN1C(=O)/C(=C/c2cc(I)c(O)c(I)c2)SC1=S	409329214	CEJVFBUEFLTKBO-BAQGIRSFSA-N	547.133	2.887	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1Cc1ccc2c(c1)OCO2	101337731	ZNSVCGMGGRDYOL-HUDHWQHISA-N	547.951	2.643	10	40	KFCB	
COc1ccc(N2CCN([C@@H](CNC(=O)C(=O)NCCc3ccc(OC)c(OC)c3)c3ccco3)CC2)cc1	97990813	GOZURICWNUXQTD-DEOSSOPVSA-N	536.629	2.644	10	40	KFCB	
COc1ccc(CCN2C(=O)[C@@H]3[C@@H](Cc4ccc(O)c(O)c4)N[C@@]4(C(=O)Nc5ccc(Cl)cc54)[C@@H]3C2=O)cc1OC	70707316	OHEMAVIQDGBOJN-SJEQQYOWSA-N	578.021	2.974	10	40	KFCB	biogenic
COC(=O)[C@H](Cc1c[nH]c2ccccc12)N/C=C1/C(=O)N=C(S)N(c2cc(OC)ccc2OC)C1=O	102620616	RMJJGJQQXXAXLZ-LYDJUCFBSA-N	508.556	2.602	10	40	KFCB	
O=C(O)CCN1C(=O)/C(=C/c2c(N3CCN(c4ccc(F)cc4)CC3)nc3ccccn3c2=O)SC1=S	97947611	VEEHILDCYSKASI-CYVLTUHYSA-N	539.614	2.836	10	40	KFCB	
CNC(=O)Cc1ccc(N2C(=O)/C(=C3\SC(=S)N(c4ccc(CC(=O)NC)cc4)C3=O)SC2=S)cc1	101017049	XOYBTTYDHAUPTM-FMQUCBEESA-N	556.716	2.905	10	40	KFCB	
CCOC(=O)c1ccc(OC)c2[nH]c3c(c(=O)c12)C(=O)c1[nH]c2c(OC)ccc(C(=O)OCC)c2c(=O)c1C3=O	5386040	FMXPWJSXEAFLAN-UHFFFAOYSA-N	546.488	2.516	10	40	KFCB	
CCOC(=O)N1CCN(C(=O)CCCN2C(=O)/C(=C/c3ccc(OC)c(OC)c3)SC2=S)CC1	8819485	FGOHWBWCPFZOEU-CYVLTUHYSA-N	507.634	2.986	10	40	KFCB	
CC(/C=C1\SC(=S)N([C@@H]2CC(=O)N(CCC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2=O)C1=O)=C\c1ccccc1	101113445	LJRQXGPOXLAZHZ-QUOFVODYSA-N	584.701	2.638	10	40	KFCB	
Cc1ccc2nc(N3C[C@H](C)O[C@H](C)C3)c(/C=C3\SC(=S)N(C[C@@H]4CCCO4)C3=O)c(=O)n2c1	9358412	WRBQEILSEGXANK-QJFZEWLLSA-N	500.646	2.997	10	40	KFCB	
CCOC(=O)CNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)ccc1C	6089352	HTRDNLNCBGIZFP-QHCPKHFHSA-N	552.657	2.574	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2	70701136	VHUFKLNZFVLLNM-VAUVAMSESA-N	527.533	2.557	10	40	KFCB	biogenic
COc1ccc(S(=O)(=O)N2CCCCC2)cc1CCC(=O)NCc1ccc(N2CCN(C)CC2)cc1	223894800	RBDXEIYFUFAREJ-UHFFFAOYSA-N	514.692	2.871	10	40	KFCB	
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C\c3ccc(Br)s3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	150390308	INTTWHIIIGFJPG-LEAZPBBDSA-N	636.520	2.795	10	40	KFCB	
COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C\c1ccc(CNC(=O)C(=O)Nc2ccc(C)cc2)o1	409183766	DIFZGLGHMPGPJW-BHMTVCBESA-N	507.543	2.695	10	40	KFCB	
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@H](C(=O)NC[C@@H]1CCCO1)c1ccc(N(C)C)cc1	6443963	VNGKFEPVHILHKS-CVDCTZTESA-N	536.658	2.882	10	40	KFCB	
C[C@@H](OC(=O)CNS(=O)(=O)/C=C/c1ccccc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O	13129464	UAAXRQZRJHOBTF-TUQDCPSNSA-N	518.547	2.923	10	40	KFCB	
CCOC(=O)N1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(CC(C)C)C2=O)CC1	16734210	CXFBMSXEDPOWTM-LGMDPLHJSA-N	501.634	2.830	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(N4CCN(CCO)CC4)nc4c(C)cccn4c3=O)SC2=S)cc1	97947714	SOLYDWHQPCNOHW-NKFKGCMQSA-N	565.721	2.570	10	40	KFCB	
CCOC(=O)COc1c(Br)cc(C=C2C(=O)N(C)C(=S)N(C)C2=O)cc1I	103856357	NPSJHRBRRJUUKW-UHFFFAOYSA-N	567.199	2.594	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@H]1c1ccc(C)cc1	409008347	WFYVYXRQKDHRGO-ZMIGGIFCSA-N	548.621	2.852	10	40	KFCB	
CC(C)OC(=O)[C@H](C(=O)C(F)(F)F)c1cc(NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)ccc1O	6142831	QGXLOGAUGAFKPL-KRWDZBQOSA-N	516.450	2.805	10	40	KFCB	
COc1ccc(N2CCN(C(=O)CN3C(=O)NC(c4ccc(OC)cc4)(c4ccc(OC)cc4)C3=O)CC2)cc1	38152226	XXQKEGBBMUKFEH-UHFFFAOYSA-N	544.608	2.857	10	40	KFCB	
COc1cc(/C=C2/C(=O)NN(c3ccc(C)c(C)c3)C2=O)cc(Br)c1OCC(=O)N1CCOCC1	100165788	LVALNBZKZCZJEZ-ODLFYWEKSA-N	544.402	2.774	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1c1ccc2c(c1)OCCO2	101335321	ZEVLNQPGMPTENN-CKXGOFNASA-N	547.951	2.690	10	40	KFCB	
Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(/C=C3\SC(=S)N(NC(=O)c4ccc(Cl)cc4)C3=O)cc21	408534629	TWMHBQDPBPTVMF-PXNMLYILSA-N	503.949	2.985	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3F)C2=O)cc(I)c1OCC(=O)O	408903871	AQSAMVIECHQICF-IZZDOVSWSA-N	540.241	2.569	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1Cl	409273084	VGUIYYUJOZXYPE-UHFFFAOYSA-N	508.712	2.878	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(N4CCN(CCO)CC4)nc4c(C)cccn4c3=O)SC2=S)cc1OC	97947108	TYFTXUWKVOHXPM-MOHJPFBDSA-N	595.747	2.578	10	40	KFCB	
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	101572374	OPMJIWCAYZDKKJ-OCRRQNCRSA-N	586.040	2.624	10	40	KFCB	
CCc1ccc2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(CCc4ccc(OC)c(OC)c4)C(=O)[C@@H]31)C(=O)N2	103518789	KJDQGMIITGVSAH-KJOBAELXSA-N	571.630	2.883	10	40	KFCB	
CC(C)CC(=O)O[C@H]1[C@H](N2CCOCC2)c2c(ccc(/C=C/C(=O)N3CCOCC3)c2O)OC1(C)C	19229462	HABFVMRKJUPSNL-BFZYNENNSA-N	502.608	2.766	10	40	KFCB	biogenic
CN1C(=O)C(=Cc2ccc(Sc3nnc(COc4ccccc4)n3C)c([N+](=O)[O-])c2)C(=O)N(C)C1=O	59490110	VERUPYRSZAOWEV-UHFFFAOYSA-N	508.516	2.887	10	40	KFCB	
COc1ccc(S(=O)(=O)Oc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(=O)(=O)C(C)C)cc2)cc1	101396646	MFTRRNFYCZZPDX-BIWIXZEJSA-N	548.624	2.863	10	40	KFCB	
COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)CNS(=O)(=O)c3ccc(C)cc3)c2C)c1	8687785	HLXANGSSDKCQJV-UHFFFAOYSA-N	556.593	2.680	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(O)c(OCC)c3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	1022628	VOKUJTAVKQZGLS-WLGHQHAYSA-N	507.612	2.969	10	40	KFCB	
CN(CCCC(=O)N1CCN(c2ccccn2)CC1)S(=O)(=O)c1ccc2c(c1)C(=O)c1ccccc1C2=O	59528025	YINZWEAUUIAGFP-UHFFFAOYSA-N	532.622	2.607	10	40	KFCB	
Cc1c(N2C(=O)/C(=C3\C(=O)N(CC(=O)O)c4ccccc43)SC2=S)c(=O)n(-c2ccccc2)n1C	1799918	IMKPYTCMVJEEEH-CZIZESTLSA-N	506.565	2.692	10	40	KFCB	
O=C1[C@@H]2[C@@H](Cc3ccc(O)c(O)c3)N[C@@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1Cc1ccc2c(c1)OCO2	101337739	ZNSVCGMGGRDYOL-JFRXHZBCSA-N	547.951	2.643	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(CCc4ccc(OC)c(OC)c4)C(=O)[C@H]31)C(=O)N2	70705922	KJDQGMIITGVSAH-SQILKSJHSA-N	571.630	2.883	10	40	KFCB	biogenic
COC(=O)c1ccc(N2CCOCC2)c(NC(=S)NC(=O)/C=C/c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1	105356128	OVTHDNBXCDGSIJ-XVNBXDOJSA-N	555.613	2.581	10	40	KFCB	
C[C@@H]1CCCN(Cc2c(O)c(CN3CCC[C@@H](C)C3)c3occ(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)c(=O)c3c2O)C1	226744427	JWVPRIUMDUETIT-QBRYNYCPSA-N	654.757	2.514	10	40	KFCB	
COc1c2c(cc3c1[C@@H](CN/C=C1/C(=O)NC(=S)N(c4ccc(C(C)C)cc4)C1=O)N(C)CC3)OCO2	20410726	STGCPQUPUMETKG-NURJGKTBSA-N	522.627	2.998	10	40	KFCB	biogenic
COc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)ccc1OCc1ccccc1[N+](=O)[O-]	41077812	LFIGQACYFPLFQC-AIPGXAOUSA-N	515.529	2.804	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3\C(=O)Nc4ccc(Br)cc43)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409120132	VHLMJMCCHLOUQR-SADKCHQCSA-N	567.465	2.949	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OS(=O)(=O)c1ccc(C)cc1	408766435	QNSHRVQMNBCEMM-UHFFFAOYSA-N	556.334	2.515	10	40	KFCB	
CCOc1cccc(N2C(=O)/C(=C/c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C(=O)NC2=S)c1	409380654	ANNVIJYZLXLGMF-XDHOZWIPSA-N	574.453	2.917	10	40	KFCB	
NC(=O)c1c(NC(=S)NC(=O)/C=C/c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)sc2c1CCC2	57316653	MCXJNUFMUWMLMB-FNORWQNLSA-N	501.590	2.607	10	40	KFCB	
COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(Br)c(Cl)c1OCC(=O)N1CCOCC1	409400120	OYNNVIIJRAMXNB-WJDWOHSUSA-N	550.793	2.810	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1	6135967	VFXBEHCMMVXNET-DENIHFKCSA-N	540.621	2.713	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc(I)c1OCC(=O)O	409040028	FGPXPESZFIXWKI-RIYZIHGNSA-N	536.278	2.820	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OCC(=O)N4CCCC4)c(OC)c3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409169623	QIQCYZIMRAMROK-KEBLUXQBSA-N	604.729	2.874	10	40	KFCB	
COc1ccc(OC)c(-n2c(C)cc(/C=C3\C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)c2C)c1	100494181	UKHLBUXBJZBNOY-NMESBGBPSA-N	536.614	2.979	10	40	KFCB	
COc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Br)c(OCC(N)=O)c(Br)c3)C2=O)cc1	409218836	HNLPMQHWFDFVCN-AWNIVKPZSA-N	553.163	2.751	10	40	KFCB	
Cc1ccc2nc(N3C[C@@H](C)O[C@H](C)C3)c(/C=C3\SC(=S)N(C[C@H]4CCCO4)C3=O)c(=O)n2c1	9019848	WRBQEILSEGXANK-DGFCRNNRSA-N	500.646	2.997	10	40	KFCB	
CCOc1ccc(NC(=O)CN2C(=O)/C(=C3/SC(=S)N([C@H]4CCS(=O)(=O)C4)C3=O)c3ccccc32)cc1	97957627	PLHLWEUZHJBPGH-YWBAYFEHSA-N	557.675	2.829	10	40	KFCB	
COc1ccc(OC)c(-n2c(C)cc(/C=C3/C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)c2C)c1	103596399	UKHLBUXBJZBNOY-JOPZDBJVSA-N	536.614	2.979	10	40	KFCB	
COc1cccc(C(=O)Oc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(C)(=O)=O)cc2OC)c1	20206217	TXLHTHDRHUTYOO-WUVMMTAUSA-N	514.541	2.544	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OCC(=O)Nc1cccc(C)c1	409041496	JTYQYICGSYOENQ-UHFFFAOYSA-N	549.321	2.765	10	40	KFCB	
CCOc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)ccc1OS(=O)(=O)c1ccc(C)cc1	97964477	JFWZWHRGTMVZLK-GJXXPDGXSA-N	548.624	2.783	10	40	KFCB	
CCOC(=O)CNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cc(C)cc(C)c1	6089351	SXGZDVHPGHZSHS-QHCPKHFHSA-N	552.657	2.574	10	40	KFCB	
COC(=O)C[C@H](c1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc12)c1cnn2cccnc12	96221638	JEUCHJCHFIJADB-LBPRGKRZSA-N	505.439	2.726	10	40	KFCB	biogenic
CCNc1nc(NCC)n2c(SCC(=O)Nc3cccc(S(=O)(=O)N(C)c4ccccc4)c3)nnc2n1	103079497	KDOMUKOMEABRND-UHFFFAOYSA-N	541.663	2.939	10	40	KFCB	
CC1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)/C1=C/C=C/C=C/[C@H]1C(=O)N(c2ccc(S(=O)(=O)O)cc2)N=C1C	135964768	ZYEKPKUEHLUSET-AKWAMILKSA-N	570.605	2.980	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/[C@@H]3C(=O)N(c4ccccc4)N=C3C)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409018322	UJACRZPYKZVRPV-YHAKGZMASA-N	543.649	2.855	10	40	KFCB	
COC(=O)C[C@@H](c1c(O)cc(O)c2c(=O)c(O)c(-c3ccc(O)c(O)c3)oc12)c1cnn2cccnc12	96221639	JEUCHJCHFIJADB-GFCCVEGCSA-N	505.439	2.726	10	40	KFCB	biogenic
COc1ccc(N2C(=O)NC(=O)/C(=C/c3cc(Br)c(OCC(=O)O)c(OC)c3)C2=O)cc1	8432749	OOHOTHYBLCDOCW-AUWJEWJLSA-N	505.277	2.596	10	40	KFCB	
O=C1NC(=O)N(c2ccc3c(c2)OCO3)C(=O)/C1=C/c1cc(I)cc(I)c1O	408950379	JMOLRQGEHXTTRM-NYYWCZLTSA-N	604.094	2.997	10	40	KFCB	
COc1ccc(N2CCN(C(=O)CSc3nnc(-c4ccc(S(=O)(=O)N5CCCC5)cc4)o3)CC2)cc1	901905	YEAGXNPAOVARNO-UHFFFAOYSA-N	543.671	2.971	10	40	KFCB	
CCOC(=O)COc1ccc(/C=c2\sc3n(c2=O)[C@H](c2ccc(N(C)C)cc2)C(C(=O)OCC)=C(C)N=3)cc1	408921397	BYEZICQJBCIJQC-HZHYMEEXSA-N	549.649	2.806	10	40	KFCB	
COc1ccc(N2CCN(Cc3cc(=O)c(OC)cn3CC(=O)Nc3ccc4c(c3)OCO4)CC2)cc1	22698787	LQORKOLNWPWHMU-UHFFFAOYSA-N	506.559	2.555	10	40	KFCB	
COc1ccc(-n2c(C)cc(/C=C3/C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)c2C)c(OC)c1	103592334	UNGQJMYXYSMIPT-JOPZDBJVSA-N	536.614	2.979	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@]1(c3ccc(O)c(O)c3)Oc3cc(O)c4c(c3[C@H]2[C@@H]1O)O[C@@H](c1ccc(O)c(O)c1)[C@@H](O)C4	169395533	NSEWTSAADLNHNH-TWEJZXOZSA-N	576.510	2.794	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1ccc(F)cc1	409056120	FFGTYKVLNWCCGY-GOOXQAOHSA-N	507.587	2.774	10	40	KFCB	
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC[C@H]1CCCO1)c1ccc(N(C)C)cc1	6444002	VNGKFEPVHILHKS-AUSIDOKSSA-N	536.658	2.882	10	40	KFCB	
COc1cccc(OCCOc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(C)(=O)=O)cc2OC)c1	101393824	WBOSESXRJZYTEX-GQZSXMDHSA-N	530.584	2.783	10	40	KFCB	
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CSC(=O)c1ccccc1)C[C@H]3O[C@H]1C[C@@H](N)[C@@H](O)[C@H](C)O1	150388714	JJXYGMBBVYMPBI-HIVKVFQHSA-N	663.701	2.583	10	40	KFCB	
COCCCN1C(=O)/C(=C/c2c(N3CCN(Cc4ccc5c(c4)OCO5)CC3)nc3ccccn3c2=O)SC1=S	97946648	KWQIPWLVGDACFS-KQWNVCNZSA-N	579.704	2.983	10	40	KFCB	
CCOC(=O)c1ccc(NC(=O)COC(=O)[C@H](Cc2ccccc2)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1	408679013	CAJACENNBSFFLX-ZLNRFVROSA-N	504.539	2.908	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C\c3cc([N+](=O)[O-])c(OC)cc3OC)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	408718739	DNYDWNUTRKWXFG-MFUBYVTQSA-N	552.609	2.790	10	40	KFCB	
CN1CCN(C(=O)CCc2cnn(C)c2)CCOc2ccc(N3CCOCC3)cc2Cc2cccc(c2)C1=O	643589120	RTJNHWVRDBOQKS-UHFFFAOYSA-N	531.657	2.773	10	40	KFCB	
CCOC(=O)c1oc2c(CN3CCN(CCO)CC3)c(O)c(CC)cc2c(=O)c1-c1ccc2c(c1)OCCO2	22790466	HCMJPXKEGOMXFH-UHFFFAOYSA-N	538.597	2.786	10	40	KFCB	biogenic
COc1cc(/C=C2/SC(=S)N(Nc3nc4c(c(=O)n(C)c(=O)n4C)n3CCc3ccccc3)C2=O)ccc1O	102760934	IPMNWWCWWBBISO-XMHGGMMESA-N	564.649	2.619	10	40	KFCB	
Cc1cc(N2C(=O)NC(=O)/C(=C\Nc3ccc(S(N)(=O)=O)cc3C)C2=O)c(C)cc1Br	408526665	BXUMPTPUFJNISK-NTEUORMPSA-N	507.366	2.601	10	40	KFCB	
COc1ccc([N+](=O)[O-])c(NC(=O)COC(=O)[C@H](Cc2ccccc2)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1	408691204	YURRUKCVTUVARK-JQVVWYNYSA-N	507.499	2.648	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4cc5c(cc4[nH]c3=O)OCO5)c3nnnn3C(C)(C)C)CC2)cc1	20084289	NLKNIXKGHKYSGJ-XMMPIXPASA-N	517.590	2.919	10	40	KFCB	
Cc1cc(/C=C2\SC(=O)N(CC(=O)N3CCOCC3)C2=O)c(C)n1-c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	106709489	IMOIBWYXTUPHIQ-UCQKPKSFSA-N	555.613	2.734	10	40	KFCB	
C[C@H]1CN(c2cc3c(cc2[N+](=O)[O-])c(=O)c(C(=O)O)cn3C2CC2)CCN1/N=N/c1ccc(S(N)(=O)=O)cc1	100032716	YVHJBZKSISIGNR-XFJJUJPYSA-N	555.573	2.800	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)cc(I)c1OCC(=O)O	408695748	YEPHLWDYSVPKMY-NTUHNPAUSA-N	528.299	2.558	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(NC[C@H](C)O)nc4ccccn4c3=O)SC2=S)cc1OC	97946725	NQNHFUARTHTTST-HYTQYMIGSA-N	526.640	2.948	10	40	KFCB	
O=C(CCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)Nc3ccc(O)c(C(=O)O)c3)C2=O)SC1=S)Nc1ccc(O)c(C(=O)O)c1	150469534	YTIKEBJIQQVXTA-FMQUCBEESA-N	676.732	2.784	10	40	KFCB	
COc1ccc(S(=O)(=O)N2CCCCC2)cc1CCC(=O)NCc1ccc(N2CCOCC2)cc1	223327189	WOOWMEWKRNQNCS-UHFFFAOYSA-N	501.649	2.955	10	40	KFCB	
Cn1ccnc1SCC(=O)NCc1cc(C(C)(C)C)cc(CNC(=O)CSc2nccn2C)c1O	12365000	JSUQQRWXMLIPQM-UHFFFAOYSA-N	516.693	2.974	10	40	KFCB	
COc1ccc(N2CCN(Cc3nc4c(c(=O)n(C)c(=O)n4C)n3Cc3cccc4ccccc34)CC2)cc1	62301225	XZAUEVQWUNFTBZ-UHFFFAOYSA-N	524.625	2.966	10	40	KFCB	
O=C(CCCN1C(=O)/C(=C2\SC(=S)N(CCCC(=O)N3CCCC3)C2=O)SC1=S)N1CCCC1	101002461	XZMXJKNQKDHJRT-ISLYRVAYSA-N	540.758	2.724	10	40	KFCB	
CC(C)Oc1c(I)cc(I)cc1C=C1C(=O)NC(=S)NC1=O	108423615	KYSRUFCKELUTHE-UHFFFAOYSA-N	542.136	2.597	10	40	KFCB	
CCn1c(=O)/c(=C2/Sc3ccc(OC)cc3N2C)s/c1=C1/C(=O)N(c2cccc([N+](=O)[O-])c2)N=C1C	100500024	LTKKDICTEBMBIP-CBAIGBLSSA-N	523.596	2.728	10	40	KFCB	
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1C[C@](O)(C(=O)O)C[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1OC(=O)/C=C/c1ccc(O)c(O)c1	2061000554	OAFXTKGAKYAFSI-CCYBODCPSA-N	678.599	2.705	10	40	KFCB	
COc1c(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)c(CCN(C)C(C)=O)cc2c1OCO2	85898450	CHEQEKDFHVIFOO-WOJGMQOQSA-N	544.358	2.874	10	40	KFCB	biogenic
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(N(C)C)cc2)cc1	6089838	QYFVFBLZFPTWFB-XUZZJYLKSA-N	566.684	2.972	10	40	KFCB	
COc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)ccc1OCc1ccccc1[N+](=O)[O-]	20206323	CQMOYVKAUZMYBI-AIPGXAOUSA-N	515.529	2.804	10	40	KFCB	
C[N+]1=C(/C=C/C=C2/N(CCCCC(=O)NCCOCCOCCNCCO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3ccccc3C2(C)C)C(C)(C)c2ccccc21	94303312	SSFADTFCQMBTSO-IKEDNOEFSA-O	779.996	2.656	10	40	KFCB	in-vitro
COc1cc(N(C(=O)Cn2nnc3ccccc32)[C@H](C(=O)NC[C@H]2CCCO2)c2ccc(N(C)C)cc2)ccc1-n1cnnn1	100626417	LLSNDFSZEGXCSV-HLADLETHSA-N	610.679	2.551	10	40	KFCB	
Cc1ccc2nc(N3CCN(CCO)CC3)c(/C=C3\SC(=S)N(CCCc4ccccc4)C3=O)c(=O)n2c1	100920296	LCYFANBXKHPAHZ-NKFKGCMQSA-N	549.722	2.951	10	40	KFCB	
CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@H](O[C@H]2C[C@@H](N)[C@H](O)[C@@H](C)O2)C1)C(=O)c1c(OCc2ccccc2)cccc1C3=O	104196922	SRILNPQAKDAONQ-GMEVFNFXSA-N	603.624	2.599	10	40	KFCB	
O=C(NC1CCCC1)[C@@H](c1ccc(O)c(O)c1)N(C(=O)CN1C(=O)c2ccccc2S1(=O)=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	150387012	CVYGPBWVRIACIY-SSEXGKCCSA-N	682.777	2.860	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(I)c1OCC(=O)O	409045752	HPSRPULHTXIEGX-VGOFMYFVSA-N	581.275	2.728	10	40	KFCB	
O=C1N[C@H]2C[C@@H](C(=O)NC[C@H]3O[C@H](CCOc4cc(-c5ccncc5)ccc41)CC[C@@H]3O)N(Cc1ccccc1O)C2	514287453	CXBXCXAOJBUVCL-PKLCKOPZSA-N	572.662	2.634	10	40	KFCB	
CCC(C)(C)NC(=O)[C@@H](c1ccc(N(C)C)cc1)N(Cc1cccnc1)C(=O)c1snc(C(N)=O)c1N	6077417	NAYQEEFKKIDELR-OAQYLSRUSA-N	523.663	2.974	10	40	KFCB	
O=C1/C(=C/c2c(NCCCN3CCOCC3)nc3ccccn3c2=O)SC(=S)N1Cc1ccco1	8857991	YUAZDPICOKFHBP-CYVLTUHYSA-N	511.629	2.823	10	40	KFCB	
COC(=O)c1ccc(N2C(=O)NC(=O)/C(=C\c3cc(I)c(OC)c(OC)c3)C2=O)cc1	408803632	RJRYYWWWMNLCNJ-RIYZIHGNSA-N	536.278	2.761	10	40	KFCB	
COc1ccc(N2CCC(O)(CN3CCN(C(C)=O)C[C@](O)(COc4ccc(C)c(C)c4)C3)CC2)cc1	585282467	KQXRYGTYTDGDQQ-LJAQVGFWSA-N	511.663	2.618	10	40	KFCB	
[N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)Oc1c(F)c(F)cc(F)c1F	110715754	ICPUCGMOWKDMAI-UHFFFAOYSA-N	615.574	2.982	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/[C@H]3C(=O)N(c4ccccc4)N=C3C)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409018327	UJACRZPYKZVRPV-ZRSRUUSMSA-N	543.649	2.855	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@]1(c3ccc(O)c(O)c3)Oc3cc(O)c4c(c3[C@H]2[C@@H]1O)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C4	95619717	NSEWTSAADLNHNH-JXCVSLFXSA-N	576.510	2.794	10	40	KFCB	endogenous,in-man
CN1C(=O)C(=Cc2sc(=O)n(Cc3ccccc3)c2N2CCN(c3ccccc3)CC2)C(=O)N(C)C1=O	2196724	VCUOXCJZWJLTEB-UHFFFAOYSA-N	517.611	2.719	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3\SC(=S)N(C[C@H]4CCCO4)C3=O)c(N3C[C@@H](C)O[C@H](C)C3)nc12	8915483	PFMKXYKEVOBINJ-KGMYCUHUSA-N	500.646	2.997	10	40	KFCB	
COCCNC(=O)Cn1cc(/C=C2/C(=O)NC(=O)N(C3CCCC3)C2=O)c2cc(Br)ccc21	409205498	NZDSNEJBVHHINT-ZDLGFXPLSA-N	517.380	2.571	10	40	KFCB	
COc1ccc2c3c(n(CCS(=O)(=O)N4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)c(=O)c2c1OC)-c1ccccc1C3=O	604404993	NVYIRROLRXGHFP-MOPGFXCFSA-N	587.654	2.841	10	40	KFCB	biogenic
COc1ccc(C(=O)Oc2ccc(/C=C3/C(=N)N4N=C(S(C)(=O)=O)SC4=NC3=O)cc2OC)cc1	41077849	YKQAERMUEKHRFG-IQGAPNPZSA-N	514.541	2.544	10	40	KFCB	
Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C2=O)c1	409380760	AFFFVCBEHCSECI-LDADJPATSA-N	528.359	2.662	10	40	KFCB	
COc1ccc(N2CCN(c3nc4c(c(O)nc(=O)n4C)n3C[C@@H](O)COc3ccc4ccccc4c3)CC2)cc1	102612717	LYTCAESNJVSIBQ-HSZRJFAPSA-N	556.623	2.764	10	40	KFCB	
CCOC(=O)COc1c(I)cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1OC	408956861	YVLFRYYJGKOHPA-MKMNVTDBSA-N	594.314	2.637	10	40	KFCB	
CN1C(=O)N(C)C(=O)C2(Cc3cc(/C=C4\C(=O)NC(=O)N(CCC5=CCCCC5)C4=O)ccc3N3CCC[C@@H]32)C1=O	97968250	CVRDOBSCIWWNLL-BTZCDPCDSA-N	559.623	2.601	10	40	KFCB	
O=C1NC(=O)N(c2ccc3c(c2)OCO3)C(=O)/C1=C/c1cc(I)c(O)c(I)c1	103846198	RZALPXIEPCIBSN-XCVCLJGOSA-N	604.094	2.997	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@]1(c3ccc(O)c(O)c3)Oc3cc(O)c4c(c3[C@H]2[C@@H]1O)O[C@@H](c1ccc(O)c(O)c1)[C@H](O)C4	212480201	NSEWTSAADLNHNH-BDHPMLJSSA-N	576.510	2.794	10	40	KFCB	
COc1ccc(N2CCC(O)(CN3CCN(C(C)=O)C[C@@](O)(COc4cc(C)cc(C)c4)C3)CC2)cc1	585287358	NHBVRLLHGSFIMT-GDLZYMKVSA-N	511.663	2.618	10	40	KFCB	
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C/c3ccc(Cl)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	5396022	OPMJIWCAYZDKKJ-SXVVZBAKSA-N	586.040	2.624	10	40	KFCB	
Cc1cccc(N(C(=O)c2snc(C(N)=O)c2N)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(N(C)C)cc2)c1	6442233	HIWZPNAOSVUXEC-NZQKXSOJSA-N	536.658	2.882	10	40	KFCB	
NC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1Br	409225176	PJGMXOAORIBYFA-LFYBBSHMSA-N	541.127	2.881	10	40	KFCB	
O=C(COc1c(Br)cc(C=C2C(=O)NC(=O)NC2=O)cc1Br)Nc1ccccc1	409268962	BZHPLDAIWFZOAR-UHFFFAOYSA-N	523.137	2.979	10	40	KFCB	
COc1ccc(CCN2C(=O)/C(=C/c3c(NCCCO)nc4ccccn4c3=O)SC2=S)cc1OC	100861723	RHJBEIXKRFELQX-HKWRFOASSA-N	526.640	2.950	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccc(Cl)cc43)[C@@H]2C(=O)N1Cc1ccc2c(c1)OCO2	101337735	ZNSVCGMGGRDYOL-CKXGOFNASA-N	547.951	2.643	10	40	KFCB	
Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3ccc(OCC(=O)N4CCOCC4)c(Br)c3)C2=O)c1	409378548	PZEAKQJLDMBEQS-XDHOZWIPSA-N	542.386	2.970	10	40	KFCB	
CC(C)C(=O)N1CC(C(=O)N2CCOc3ccc(N4CCOCC4)cc3Cc3cccc(c3)C(=O)N(C)CC2)C1	643589054	PTGRFMKVXASRNZ-UHFFFAOYSA-N	548.684	2.521	10	40	KFCB	
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C[C@H]4CCCO4)C3=O)c(N3C[C@H](C)O[C@H](C)C3)nc12	27016524	PFMKXYKEVOBINJ-VNIKWUISSA-N	500.646	2.997	10	40	KFCB	
CCN(CC)C(=O)Cn1cc(C(=O)C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c2ccccc21	56923775	OKKYMWVWDDRWSH-UHFFFAOYSA-N	519.646	2.639	10	40	KFCB	
N=C1/C(=C/c2ccc(OCc3ccc4c(c3)OCO4)cc2)C(=O)N=C2SC(CC(=O)N3CCOCC3)=NN12	101167746	GKMRWFSKCTZRRQ-VFWYHHDWSA-N	533.566	2.862	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccc(C)cc1	409224396	JVTRIWUASMQZNV-UHFFFAOYSA-N	565.389	2.930	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(Br)c1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	408735819	XDOUGEZPYUXHDY-UHFFFAOYSA-N	523.277	2.981	10	40	KFCB	
O=C(O)COc1c(I)cc(/C=C2/SC(=S)NC2=O)cc1I	408776570	WABMMZOKNWDFEJ-FPYGCLRLSA-N	547.133	2.848	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc(Br)c1OCC(N)=O	409227295	XUYYZASNBPLCPY-LZYBPNLTSA-N	516.348	2.995	10	40	KFCB	
Cc1cccc(NC(=O)CN2C(=O)N/C(=C/c3cc(C)n(-c4ccc(S(N)(=O)=O)cc4)c3C)C2=O)c1	9264821	XOVDOZQAABVPEQ-LPYMAVHISA-N	507.572	2.581	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc(Br)c1OCC(=O)OC	408950391	JRVXXVRNSVZGEX-MKMNVTDBSA-N	547.314	2.795	10	40	KFCB	
Nc1ccc(OCC(=O)OCC(COC(=O)COc2ccc(N)cc2)(COC(=O)COc2ccc(N)cc2)COC(=O)COc2ccc(N)cc2)cc1	2060993707	ZYOSGRRSXILRTK-UHFFFAOYSA-N	732.743	2.790	10	40	KFCB	
COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COC(=O)c3n[nH]c(=O)c4ccccc34)c2C)c1	13017552	XQXRQKYVXCMKGX-UHFFFAOYSA-N	517.494	2.944	10	40	KFCB	
Cc1ccc(CN2C(=O)/C(=C/c3c(N4CCN(CCO)CC4)nc4c(C)cccn4c3=O)SC2=S)cc1	2322438	LHJYLNPYOIHFNF-JWGURIENSA-N	535.695	2.827	10	40	KFCB	
Oc1cc(O)c2c(c1)O[C@@H](c1ccc(O)c(O)c1)[C@H](O)[C@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2	100826091	XFZJEEAOWLFHDH-KIBWQBKSSA-N	578.526	2.995	10	40	KFCB	endogenous,in-man
COc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)ccc1OCc1ccc([N+](=O)[O-])cc1	41077813	XSALHUATSKYOOT-PRZRADHTSA-N	515.529	2.804	10	40	KFCB	
COC(=O)COc1ccc(/C=C2\C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1I	103851944	LFJZEIYRZDJKGS-XYOKQWHBSA-N	540.310	2.813	10	40	KFCB	
COc1c2c(cc3c1[C@H](CN/C=C1/C(=O)NC(=S)N(c4ccc(C(C)C)cc4)C1=O)N(C)CC3)OCO2	20410725	STGCPQUPUMETKG-CBXNMNPBSA-N	522.627	2.998	10	40	KFCB	biogenic
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C[C@H]4CCCO4)C3=O)c(N3C[C@H](C)O[C@@H](C)C3)nc12	170602060	PFMKXYKEVOBINJ-ZSDPCQDXSA-N	500.646	2.997	10	40	KFCB	
CCOc1cc(/C=C2/C(=N)N3N=C(S(=O)(=O)CC(C)C)SC3=NC2=O)cc(Cl)c1OS(C)(=O)=O	97964838	PIHKBTWLUQXQEN-RHVZPXKPSA-N	549.052	2.725	10	40	KFCB	
Cc1cc([C@@]2(c3cc(C)c(O)c(CN(CC(=O)O)CC(=O)O)c3)CS(=O)(=O)c3ccccc32)ccc1O	98210710	LKOLMEGIJIQMAG-HHHXNRCGSA-N	525.579	2.808	10	40	KFCB	
Cc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\c2ccc(OCC(=O)N3CCOCC3)cc2)C1=O	409234518	LIQTTYBAARIBDG-CPNJWEJPSA-N	528.359	2.662	10	40	KFCB	
CCOc1cc(/C=C2/C(=N)N3N=C(S(C)(=O)=O)SC3=NC2=O)ccc1OC(=O)c1cccs1	41077850	ALEMIYJKIWFYKA-JXPCMBGASA-N	504.571	2.987	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccccc1C	409262816	HQWHQQANRLNNLX-UHFFFAOYSA-N	502.321	2.923	10	40	KFCB	
CCOc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)ccc1OC(=O)c1cccc(OC)c1	101394609	UNTFZCCHPJGXHV-KMFLQCEESA-N	528.568	2.934	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@@H]31)C(=O)N2	103530676	HPHNEOJMOVENCK-FULDZWAESA-N	561.978	2.999	10	40	KFCB	
COC(=O)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1I	408768800	JLWKTCWQQXDGOJ-OQLLNIDSSA-N	520.279	2.818	10	40	KFCB	
COC(=O)c1ccc(CN2C(=O)N/C(=C\c3cc(C)n(-c4cc(C(=O)O)cc(C(=O)O)c4)c3C)C2=O)o1	409399896	LVIRDDVDQHSMIK-GRSHGNNSSA-N	507.455	2.963	10	40	KFCB	
CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCN3CCN(c4ccc(OC)cc4)CC3)ccc2c1=O	4766374	FTVVFAOHAPSHGW-UHFFFAOYSA-N	507.635	2.831	10	40	KFCB	
CCOc1ccc(N(C(=O)c2snc(C(N)=O)c2N)[C@H](C(=O)NC[C@@H]2CCCO2)c2ccc(N(C)C)cc2)cc1	6089824	QYFVFBLZFPTWFB-URXFXBBRSA-N	566.684	2.972	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(c3ccccc3F)C2=O)cc(I)c1OCC(=O)O	103852155	CEFJXMBQXDJMKF-IZZDOVSWSA-N	556.309	2.734	10	40	KFCB	
COc1ccc(N2CCN([C@H](c3cc4cc(OC)ccc4[nH]c3=O)c3nnnn3C[C@@H]3CCCO3)CC2)cc1	19940670	VGPDJZRKTGNLHW-JYFHCDHNSA-N	531.617	2.622	10	40	KFCB	
CCOC(=O)C[C@H]1C(=O)NCCN1C(=O)CCN1C(=O)/C(=C/c2ccc(C(C)(C)C)cc2)SC1=S	26688785	LIIHHEMXBMCJSL-OWBBTNHHSA-N	517.673	2.856	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@]1(N[C@@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@@H]31)C(=O)N2	103530683	HPHNEOJMOVENCK-TXCBALMISA-N	561.978	2.999	10	40	KFCB	
CCOc1cc(/C=C2\SC(=S)N(NC(=O)c3ccccc3)C2=O)ccc1OCC(=O)N1CCOCC1	206886710	PNKOZAQIURSGQA-QNGOZBTKSA-N	527.624	2.869	10	40	KFCB	
COCCn1nnnc1[C@@H](c1cc2cc(C)cc(C)c2[nH]c1=O)N1CCN(c2ccc(OC)cc2)CC1	20083114	XCVJYPLYTLRMEG-RUZDIDTESA-N	503.607	2.698	10	40	KFCB	
CCOC(=O)c1cccc(-c2ccc(/C=C3\C(=N)N4N=C(CC(=O)N5CCOCC5)SC4=NC3=O)o2)c1	9281840	SWOPIJTVTOEIIC-DBQMFKLFSA-N	521.555	2.991	10	40	KFCB	
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	97969046	PEFMGIDTVYFVCQ-KWPRXZIPSA-N	630.491	2.733	10	40	KFCB	
CCOC(=O)C1CCN(c2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(CCCOC)C2=O)CC1	9319184	NMYAOFXGXUNCKS-SDXDJHTJSA-N	516.645	2.712	10	40	KFCB	
CCOC(=O)CNC(=O)[C@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1ccc(CC)cc1	6134743	DGFBAGLZTUOAGT-QHCPKHFHSA-N	552.657	2.520	10	40	KFCB	
COc1ccc(OCCOc2ccc(/C=C3/C(=N)N4N=C(S(C)(=O)=O)SC4=NC3=O)cc2)cc1	41077747	RGPLFQHVCAWXDC-JJEZRMFNSA-N	500.558	2.774	10	40	KFCB	
CCc1ccc2c(c1)[C@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCO5)C(=O)[C@H]31)C(=O)N2	70701133	VHUFKLNZFVLLNM-BYOSCJPYSA-N	527.533	2.557	10	40	KFCB	biogenic
Cc1cccn2c(=O)c(/C=C3/SC(=S)N(CC(=O)O)C3=O)c(N3CCN(c4ccccc4F)CC3)nc12	100843129	UKSOSMMPAVEXCM-CPNJWEJPSA-N	539.614	2.754	10	40	KFCB	
COC(=O)c1cc(C(=O)OC)cc(N2C(=O)[C@@H]3[C@@H](c4ccccc4)OC4(C(=O)c5ccccc5C4=O)[C@@H]3C2=O)c1	101993327	JLRILKQBCDQYDO-RJGXRXQPSA-N	539.496	2.955	10	40	KFCB	
Cc1ccc2nc(NCCOCCO)c(/C=C3\SC(=S)N(CCc4ccccc4)C3=O)c(=O)n2c1	8858367	ILPFQPFELOOVQN-HKWRFOASSA-N	510.641	2.868	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(I)c1OC	408938967	LMRKAJMUGIXMQV-NTUHNPAUSA-N	523.239	2.883	10	40	KFCB	
COc1ccc(N2CCN(CCCNC(=O)COCc3cc(-c4ccc5c(c4)OCO5)on3)CC2)cc1	20249076	ZJCQJTZGZXHCJX-UHFFFAOYSA-N	508.575	2.924	10	40	KFCB	
COC(=O)COc1cc(Br)c(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1OC	408773756	SIVRFJSRXBNQPK-OVCLIPMQSA-N	503.305	2.984	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C3\C(=O)Nc4ccc(Cl)cc43)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409110389	VPIJBVWKZNQTJO-AGGMBTAESA-N	523.014	2.840	10	40	KFCB	
O=C(O)/C=C/c1ccc(O)c2c1[C@H](C(=O)O[C@@H](Cc1ccc(O)c(O)c1)C(=O)O)[C@H](c1ccc(O)c(O)c1)O2	225096252	HHKGQYGYEDKXNE-UPHWEOCBSA-N	538.461	2.769	10	40	KFCB	biogenic,in-vitro
COCCNC(=O)Cn1cc(/C=C2\C(=O)N(C)c3ccc(S(=O)(=O)N4CCOCC4)cc32)c2cc(Br)ccc21	8777983	LAZWSSWPHZRJDM-QRVIBDJDSA-N	617.522	2.704	10	40	KFCB	
CN(C)CCN(C)C(=O)C[C@@H]1CCN2C[C@@H]1/C=C/COc1ccc(N(C)CCc3ccccn3)cc1CNCC2=O	100035330	KUWVYAGQQUNLMJ-LCEHABPXSA-N	562.759	2.674	10	40	KFCB	
Cc1cc(C(=O)OCC(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2N2CCOCC2)c(C)n1-c1ccccc1	103094414	AWNXZVCHRFYCSW-UHFFFAOYSA-N	582.679	2.747	10	40	KFCB	
Cc1cc(Br)c(N2C(=O)NC(=O)/C(=C/Nc3cc4[nH]c(=O)[nH]c4cc3[N+](=O)[O-])C2=O)cc1C	100959076	OBQWOXBXCYXZFM-YFHOEESVSA-N	515.280	2.723	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@H]1c1cccc(OC)c1	409061366	WMHJVSMIOIJLAL-ZMIGGIFCSA-N	519.623	2.644	10	40	KFCB	
CCc1cccc2c(/C=C3\C(=O)N(C)c4ccc(S(=O)(=O)N5CCOCC5)cc43)cn(CC(=O)N3CCOCC3)c12	8778000	GSQWVBNKSXDCSX-ONUIUJJFSA-N	578.691	2.600	10	40	KFCB	
CC(=O)OC[C@@H]1O[C@@H](N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O	97969047	PEFMGIDTVYFVCQ-KXUVMVDPSA-N	630.491	2.733	10	40	KFCB	
CCOc1ccc(NC(=O)[C@@H](/N=N/c2ccc(S(=O)(=O)N[C@H]3ON[C@@H](C)[C@H]3C)cc2)C(C)=O)cc1	104124229	KOXFRJDYKODYFV-LXXFUBGGSA-N	503.581	2.929	10	40	KFCB	
CCN(CC)C(=O)C1=C(C)N=c2s/c(=C\c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@H]1c1cc(OC)ccc1OC	409094862	GLCPYGDKZWINFS-ASZNLBCTSA-N	621.716	2.866	10	40	KFCB	
COC(=O)COc1ccc(/C=C2/C(=O)NC(=S)N(c3ccc(Br)cc3)C2=O)cc1OC	15012292	QZZSUZWKZBQMJO-DHDCSXOGSA-N	505.346	2.841	10	40	KFCB	
Cc1ccc(CN2C(=O)/C(=C/c3c(N4CCN(CCO)CC4)nc4ccc(C)cn4c3=O)SC2=S)cc1	2334568	SMIFQCWNQLCWRA-JCMHNJIXSA-N	535.695	2.827	10	40	KFCB	
COc1ccc(CN2C(=O)/C(=C/c3c(NCCN4CCOCC4)nc4ccccn4c3=O)SC2=S)cc1	100860135	UDQODRUJBXDNHL-PGMHBOJBSA-N	537.667	2.849	10	40	KFCB	
CN(C)c1ccc([C@@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2cccc(F)c2)cc1	6135869	TUVUMIBOKXCOIB-UGKGYDQZSA-N	540.621	2.713	10	40	KFCB	
COc1ccc(Oc2nc3ccccn3c(=O)c2/C=C2\SC(=S)N([C@@H]3CCS(=O)(=O)C3)C2=O)cc1	97947374	ROZINMWMHBLQJR-IIMQCXAKSA-N	529.621	2.884	10	40	KFCB	
Cc1ccc(N2C(=O)[C@@H](/C=C3\C(=O)NC(=O)N(c4ccc(C)c(Cl)c4)C3=O)C(=O)NC2=S)cc1C	408989220	SONHQBPZYAJLIT-KGZWWPETSA-N	510.959	2.839	10	40	KFCB	
Cn1c(=O)n(C)c2cc(N/C=C3/C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)c(Br)cc21	408535629	UBNRDSUUUJEMKE-XFXZXTDPSA-N	504.728	2.872	10	40	KFCB	
Cc1cccc(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]3CCCN43)C(=O)N=C2O)c1C	97967964	CUANXTZTXASFEI-YSSBIZNGSA-N	555.591	2.736	10	40	KFCB	
Cc1cc(C)nc(NS(=O)(=O)c2ccc(N/C=C3\C(=O)NC(=O)N(CCc4ccccc4)C3=O)cc2)n1	408526316	AXGHLIPGBUMOCZ-RCCKNPSSSA-N	520.571	2.511	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@@H]1c1ccc(OCC)cc1	409007649	PZXVDXFSANDIAV-OGRZUZBBSA-N	578.647	2.942	10	40	KFCB	
COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(/C)Nc1cc(C(=O)OC)cc(C(=O)OC)c1	103920234	BCMLQADAVUPYJJ-BKUYFWCQSA-N	510.459	2.820	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc(I)c1OCC(=O)O	408904897	QDIFSYVPDSSAIT-WLRTZDKTSA-N	540.241	2.569	10	40	KFCB	
O=C1CN(Cc2ccccc2O)Cc2ccccc2OC/C=C\[C@H]2CN1CC[C@H]2CC(=O)N1CC[C@@H](O)C1	253400986	MFVYSTDNWLVUDU-RJLMYAFLSA-N	519.642	2.791	10	40	KFCB	
O=C1NC(=S)NC(=O)C1=Cc1ccc(OS(=O)(=O)c2ccc(Cl)cc2)c(Br)c1	409065007	KBJMCIQAKFDXNJ-UHFFFAOYSA-N	501.767	2.785	10	40	KFCB	
COc1cccc(OCCOc2c(I)cc(C=C3C(=O)NC(=O)NC3=O)cc2OC)c1	408969960	XUZTVFQQKLUJFW-UHFFFAOYSA-N	538.294	2.516	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc(Br)c1OCC(N)=O	409226512	ULFGBJQBGYRPQM-WLRTZDKTSA-N	508.712	2.642	10	40	KFCB	
O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc(Cl)cc(Br)c1OCC(=O)N1CCOCC1	409401759	ZSMOVJKRUHPRAG-BOPFTXTBSA-N	520.767	2.802	10	40	KFCB	
O=C(NC[C@H]1CCCO1)[C@H](c1ccc(N2CCOCC2)cc1)N(Cc1ccco1)C(=O)Cn1nnc2ccccc21	100336669	FCLNGUQOXUOSQY-GIGWZHCTSA-N	558.639	2.926	10	40	KFCB	
COc1cc(N(C(=O)Cn2nnc3ccccc32)[C@@H](C(=O)NC[C@@H]2CCCO2)c2ccc(N(C)C)cc2)ccc1-n1cnnn1	100626416	LLSNDFSZEGXCSV-QABMSTFYSA-N	610.679	2.551	10	40	KFCB	
NC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1Br	409219449	QQLNLGSKVAVPME-LFYBBSHMSA-N	568.134	2.650	10	40	KFCB	
COCCn1nnnc1[C@@H](c1cc2c(C)cc(C)cc2[nH]c1=O)N1CCN(c2ccc(OC)cc2)CC1	20083571	KGDRBUWGKYTKOR-RUZDIDTESA-N	503.607	2.698	10	40	KFCB	
O=C1NC(=O)N(c2ccc(I)cc2)C(=O)/C1=C\NN1CCCC[C@@H]1c1cccnc1	8740432	NTIIWAQYKGZSTR-MTMYEVCSSA-N	517.327	2.885	10	40	KFCB	biogenic
CCOc1cc(/C=C2/C(=N)N3C(=NC2=O)SN=C3S(C)(=O)=O)ccc1OC(=O)c1cccs1	20206238	IHLMLVCJTVTFTI-JXPCMBGASA-N	504.571	2.987	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=S)N(c3cccc(C)c3)C2=O)cc(I)c1OCC(=O)O	408905946	GMZAVVJIMGYJCY-VGOFMYFVSA-N	552.346	2.903	10	40	KFCB	
COc1ccc(N2CCN(CC(=O)N3CCN(S(=O)(=O)c4ccc5ccccc5c4)CC3)CC2)cc1	12550368	LBBPGBUDRXMGRA-UHFFFAOYSA-N	508.644	2.504	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cn(CC(=O)N4CCOCC4)c4ccccc34)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409175404	RGEFVDNEKXMSKW-ZNRKBWGRSA-N	613.740	2.678	10	40	KFCB	
O=C(O)COc1c(I)cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1I	408779813	LCNINSGWDQUEOF-QDEBKDIKSA-N	662.130	2.754	10	40	KFCB	
CCOc1ccc(N2C(=O)NC(=O)/C(=C\Nc3ccc(S(=O)(=O)Nc4nc(C)cc(C)n4)cc3)C2=O)cc1	408526439	BZCPTWXLEHNHSQ-KGENOOAVSA-N	536.570	2.872	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc(I)c1OCC(N)=O	409222746	DZCPCUYJBWYRJH-MKMNVTDBSA-N	569.739	2.874	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccccc2F)cc1	6135963	SEWNDRMHHBRPMX-HTAPYJJXSA-N	540.621	2.713	10	40	KFCB	
Cc1ccccc1N(C(=O)c1snc(C(N)=O)c1N)[C@@H](C(=O)NC[C@@H]1CCCO1)c1ccc(N(C)C)cc1	6444000	VNGKFEPVHILHKS-WMZHIEFXSA-N	536.658	2.882	10	40	KFCB	
COc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Br)c(N4CCOCC4)o3)C2=O)c(OC)c1	408953526	WODVVCDHTNOPOV-NTEUORMPSA-N	506.309	2.562	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OCC(=O)Nc1ccc(C)c(C)c1	409265363	HUNVADMTCFRRSI-UHFFFAOYSA-N	565.389	2.848	10	40	KFCB	
Cc1ccc(C)c(N2C(=O)/C(=C/c3ccc4c(c3)CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]3CCCN43)C(=O)N=C2O)c1	97968313	QDAOMBVLIZUCNM-YSSBIZNGSA-N	555.591	2.736	10	40	KFCB	
CCOc1cc(/C=C2\C(=O)N(c3ccc(S(N)(=O)=O)cc3)N=C2C)cc(I)c1O	665706	SEPQICOZNINNTP-NVNXTCNLSA-N	527.340	2.849	10	40	KFCB	
CC1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)/C1=C/C=C/C=C/[C@@H]1C(=O)N(c2ccc(S(=O)(=O)O)cc2)N=C1C	135964794	ZYEKPKUEHLUSET-BUFKRQNUSA-N	570.605	2.980	10	40	KFCB	
COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc(I)c1OCC(N)=O	409218402	IQBZLFHGTBORMT-WUXMJOGZSA-N	569.739	2.792	10	40	KFCB	
O=C1[C@@H]2[C@H](Cc3ccc(O)c(O)c3)N[C@]3(C(=O)Nc4ccccc43)[C@@H]2C(=O)N1Cc1ccccc1Cl	16021697	UYYOJRBRGCNQTK-HGXGVQFASA-N	503.942	2.915	10	40	KFCB	
CCc1nnc(NS(=O)(=O)c2ccc(N/C=C3/C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)cc2)s1	95471600	UBXSFWIWGLACSK-ATVHPVEESA-N	512.573	2.789	10	40	KFCB	
NC(=O)COc1cccc([C@@H]2CC(=O)Oc3cc(O)c4c(=O)c(O)c(-c5ccc(O)c(O)c5)oc4c32)c1	96221137	IXMRVIBHYUCERV-AWEZNQCLSA-N	505.435	2.588	10	40	KFCB	biogenic
CC(=O)OC[C@H]1O[C@@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O	101462031	OPMJIWCAYZDKKJ-XWPYXPDRSA-N	586.040	2.624	10	40	KFCB	
CN(C)c1ccc(/C=c2\sc3n(c2=O)N[C@@]2(c4ccccc4)N(C)C(=O)N(C)[C@]2(c2ccccc2)N=3)cc1	8690325	JETDYKDVQXDARZ-FZIMLHQMSA-N	524.650	2.685	10	40	KFCB	
C[C@H]1CCCN(Cc2c(O)c(CN3CCC[C@@H](C)C3)c3occ(-c4ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc4)c(=O)c3c2O)C1	226744436	JWVPRIUMDUETIT-LJQOOJLESA-N	654.757	2.514	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=O)NC2=O)cc(I)c1OS(=O)(=O)c1ccc(Cl)cc1	409066903	DCBHNVNGTBECRC-UHFFFAOYSA-N	576.752	2.860	10	40	KFCB	
COc1ccc(N2CCN([C@@H](CNC(=O)C(=O)NCCc3ccccc3OC)c3ccco3)CC2)cc1	56946060	YCIRCAQHWAHWDS-DEOSSOPVSA-N	506.603	2.635	10	40	KFCB	
COc1cc(NS(=O)(=O)c2ccc(N/C=C3/C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)cc2)nc(OC)n1	6088729	BCMAQMOGOIOIEE-ATVHPVEESA-N	558.960	2.527	10	40	KFCB	
Cc1cc(Cl)c2c(c1)[C@@]1(N[C@H](Cc3ccc(O)c(O)c3)[C@H]3C(=O)N(c4ccc5c(c4)OCCO5)C(=O)[C@H]31)C(=O)N2	70705362	HPHNEOJMOVENCK-MIWMSVFZSA-N	561.978	2.999	10	40	KFCB	biogenic
CCOC(=O)C1=C(C)N=c2s/c(=C/[C@H]3C(=O)N(c4ccccc4)N=C3C)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409018324	UJACRZPYKZVRPV-ZIFIAAKRSA-N	543.649	2.855	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@H]2CCCO2)N(Cc2ccccc2)C(=O)c2snc(C(N)=O)c2N)cc1	6135964	KCTAERDGUNBAKQ-NFBKMPQASA-N	536.658	2.569	10	40	KFCB	
COc1ccc(C(=O)NN2C(=O)/C(=C/c3cc([N+](=O)[O-])ccc3N3CCOCC3)SC2=S)cc1	409328499	WNJNRQUSCRBXLQ-UYRXBGFRSA-N	500.558	2.986	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1ccc(N(C)C)cc1	409052105	GKUFSBNSUXYMJF-NQCZSQBNSA-N	532.666	2.701	10	40	KFCB	
COc1ccc(C(=O)Oc2ccc(/C=C3/C(=N)N4C(=NC3=O)SN=C4S(C)(=O)=O)cc2)cc1OC	20206201	YHOQSLRWPCFIOU-IQGAPNPZSA-N	514.541	2.544	10	40	KFCB	
CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(OCC(=O)N3CCOCC3)c(Br)c2)C1=O	409380167	JMVCRTLCRLXXLT-QGOAFFKASA-N	542.386	2.916	10	40	KFCB	
CCOC(=O)CNC(=O)[C@@H](c1ccc(N(C)C)cc1)N(C(=O)c1snc(C(N)=O)c1N)c1cccc(C)c1C	6089336	IFYNXRJQLQNXCQ-HSZRJFAPSA-N	552.657	2.574	10	40	KFCB	
COC(=O)[C@H](Cc1c[nH]c2ccccc12)N/C=C1\C(=O)NC(=O)N(c2ccc(I)cc2)C1=O	97967999	QOFYDJSPNGPBTG-WPNIOXTASA-N	558.332	2.613	10	40	KFCB	
COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C2/SC(=O)N(CC(=O)N3CCOCC3)C2=O)c1C	409134663	XADYXKBYGAPSPN-RGVLZGJSSA-N	500.533	2.906	10	40	KFCB	
CCOC(=O)COc1cc(Br)c(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1OC	409373801	WFSYJFIBNOHOPM-VGOFMYFVSA-N	507.293	2.655	10	40	KFCB	
CCN1C(=O)/C(=C\c2cn(CC(=O)NC[C@@H]3CCCO3)c3ccccc23)c2cc(S(=O)(=O)N3CCOCC3)ccc21	8778048	CXXNPTBXOJFVRZ-PPEIKGMUSA-N	578.691	2.865	10	40	KFCB	
COC(=O)c1ccc(N2C(=O)NC(=O)/C(=C\c3cc(I)cc(OC)c3)C2=O)cc1	408869467	PPNKCLRWWHNLEU-CXUHLZMHSA-N	506.252	2.753	10	40	KFCB	
O=C(NC1CCCC1)[C@H](c1ccc(O)c(O)c1)N(C(=O)CN1C(=O)c2ccccc2S1(=O)=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	150387011	CVYGPBWVRIACIY-PMERELPUSA-N	682.777	2.860	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)c(=O)n2[C@@H]1c1ccc(C)cc1	409008346	WFYVYXRQKDHRGO-OWXSRONMSA-N	548.621	2.852	10	40	KFCB	
COc1ccc(OC)c(N2C(=O)N=C(O)/C(=C/c3c(CCN(C)C(C)=O)cc4c(c3OC)OCO4)C2=O)c1	2129487	RWCBQEOMUUAHTJ-PDGQHHTCSA-N	525.514	2.969	10	40	KFCB	biogenic
CCOC(=O)C1=C(C)N=c2s/c(=C3\C(=O)Nc4ccc(Br)cc43)c(=O)n2[C@H]1c1ccc(N(C)C)cc1	409120128	VHLMJMCCHLOUQR-AGGMBTAESA-N	567.465	2.949	10	40	KFCB	
COc1cc(C=C2C(=O)NC(=O)NC2=O)cc(Br)c1OCC(=O)Nc1ccc(Cl)cc1	409225521	QROPDXIETLGNTQ-UHFFFAOYSA-N	508.712	2.878	10	40	KFCB	
CCOc1cc(C=C2C(=O)NC(=S)NC2=O)cc(I)c1OC(=O)c1ccc(OC)cc1	408898135	UUULSRUBAFBSGU-UHFFFAOYSA-N	552.346	2.832	10	40	KFCB	
CN(C)c1ccc([C@H](C(=O)NC[C@@H]2CCCO2)N(C(=O)c2snc(C(N)=O)c2N)c2ccc(F)cc2)cc1	6135958	VFXBEHCMMVXNET-SIKLNZKXSA-N	540.621	2.713	10	40	KFCB	
Cc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C/Nc2cc3nc(O)[nH]c3cc2N2CCOCC2)C1=O	408526145	AILODILSGFLARF-KAMYIIQDSA-N	541.362	2.755	10	40	KFCB	
Cc1cc(/C=C2\SC(=O)N(CC(=O)N3CCCCC3)C2=O)c(C)n1-c1ccc(S(N)(=O)=O)cc1	409380890	PTTJQWIEHDZJKA-MOSHPQCFSA-N	502.618	2.790	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1cc(OC)c(OC)c(OC)c1	409059402	MXJQFWXHBBONDI-KMBIYUNPSA-N	579.675	2.661	10	40	KFCB	
CCOC(=O)COc1c(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1OC	103844147	CBDXLZWHRRLPQU-MKMNVTDBSA-N	547.314	2.795	10	40	KFCB	
CCc1cc(Br)ccc1N1C(=O)NC(=O)/C(=C\Nc2ccc(S(N)(=O)=O)cc2C)C1=O	408536759	XWEGMPUIJOWWAO-XNTDXEJSSA-N	507.366	2.546	10	40	KFCB	
Cc1ccc2c(nc3s/c(=C/c4cc([N+](=O)[O-])c(N5CCOCC5)cc4N4CCOCC4)c(=O)n32)c1C	27528017	QBXGWRFOIURBCF-OEAKJJBVSA-N	521.599	2.655	10	40	KFCB	
CCOC(=O)C1=C(C)N=c2s/c(=C/c3ccc(N4CCOCC4)cc3)c(=O)n2[C@@H]1c1ccc(OC)cc1	78547120	ULUSQUNCWUULBS-LBKCIFGTSA-N	519.623	2.644	10	40	KFCB	
CN1C(=O)N(C)C(=O)C2(Cc3cc(/C=C4\C(=O)N=C(O)N(c5cccc(Cl)c5)C4=O)ccc3N3CCC[C@@H]32)C1=O	97968434	FFSNXTILDSMVOT-PRWBYUBPSA-N	561.982	2.773	10	40	KFCB	
CCCOc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(I)c(OCC(N)=O)c(OC)c3)C2=O)cc1OC	409221822	AUBLCBQDKPWBTK-OVCLIPMQSA-N	609.373	2.628	10	40	KFCB