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O=C([O-])c1cc2c([nH]1)-c1c(C(=O)NC[C@H]3CO[C@]4(C3)C[NH2+]CCOC4)cc(C(=O)[O-])nc1C(=O)C2=O ZINC001219844907 1069542042 /nfs/dbraw/zinc/54/20/42/1069542042.db2.gz SGFYJCVOBROOSZ-SDWAUSNYSA-N -1 0 498.448 -0.023 20 10 JBCDRM O=C([O-])c1cc2c([nH]1)-c1c(C(=O)NC[C@H]3CO[C@@]4(C3)C[NH2+]CCOC4)cc(C(=O)[O-])nc1C(=O)C2=O ZINC001219844908 1069541997 /nfs/dbraw/zinc/54/19/97/1069541997.db2.gz SGFYJCVOBROOSZ-VCGICTTQSA-N -1 0 498.448 -0.023 20 10 JBCDRM O=C([O-])c1cc2c([nH]1)-c1c(C(=O)NC[C@@H]3CO[C@@]4(C3)C[NH2+]CCOC4)cc(C(=O)[O-])nc1C(=O)C2=O ZINC001219844909 1069542131 /nfs/dbraw/zinc/54/21/31/1069542131.db2.gz SGFYJCVOBROOSZ-WYVULQQZSA-N -1 0 498.448 -0.023 20 10 JBCDRM COC(=O)C1(NC(=O)c2cc(C(=O)[O-])nc3c2-c2[nH]c(C(=O)[O-])cc2C(=O)C3=O)CC[NH2+]CC1 ZINC001220003503 1069545611 /nfs/dbraw/zinc/54/56/11/1069545611.db2.gz OXUATVAMCUMTRL-UHFFFAOYSA-N -1 0 470.394 -0.123 20 10 JBCDRM [NH3+]CCOCCOCCNC(=O)c1cc(C(=O)[O-])nc2c1-c1[nH]c(C(=O)[O-])cc1C(=O)C2=O ZINC001220521888 1069561763 /nfs/dbraw/zinc/56/17/63/1069561763.db2.gz SBQJYVGQCXVFPM-UHFFFAOYSA-N -1 0 460.399 -0.426 20 10 JBCDRM COC(=O)[C@H](CCC[NH3+])NC(=O)c1cc(C(=O)[O-])nc2c1-c1[nH]c(C(=O)[O-])cc1C(=O)C2=O ZINC001221190640 1069578777 /nfs/dbraw/zinc/57/87/77/1069578777.db2.gz WGNLVEZYYAEZGI-VIFPVBQESA-N -1 0 458.383 -0.138 20 10 JBCDRM O=c1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2NS(=O)(=O)c2cc(Cl)cc(Cl)c2[O-])c(=O)[nH]1 ZINC001251439169 1069677232 /nfs/dbraw/zinc/67/72/32/1069677232.db2.gz NYKASNKLHWMHRF-KLPZLMTLSA-N -1 0 468.271 -0.441 20 10 JBCDRM NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1cc(Cl)cc(Cl)c1[O-] ZINC001251447821 1069677351 /nfs/dbraw/zinc/67/73/51/1069677351.db2.gz PCLQSDRXUJXSEZ-JTQLQIEISA-N -1 0 453.304 -0.430 20 10 JBCDRM O=S(=O)([N-]c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)c1cccc2nsnc21 ZINC001260388562 1069764973 /nfs/dbraw/zinc/76/49/73/1069764973.db2.gz NGNSMBOUSWZTLR-COWMOVNHSA-N -1 0 469.497 -0.329 20 10 JBCDRM O=S(=O)([N-]c1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1)c1cccc2nsnc21 ZINC001260389006 1069765361 /nfs/dbraw/zinc/76/53/61/1069765361.db2.gz NGNSMBOUSWZTLR-JGRFCZEVSA-N -1 0 469.497 -0.329 20 10 JBCDRM O=S(=O)([N-]c1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)c1cccc2nonc21 ZINC001260443151 1069766881 /nfs/dbraw/zinc/76/68/81/1069766881.db2.gz ZNIDZPLLVPJRSN-FMUWMXLXSA-N -1 0 469.497 -0.084 20 10 JBCDRM O=S(=O)([N-]c1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1)c1cccc2nonc21 ZINC001260443156 1069766953 /nfs/dbraw/zinc/76/69/53/1069766953.db2.gz ZNIDZPLLVPJRSN-IDTSGUGQSA-N -1 0 469.497 -0.084 20 10 JBCDRM O=S(=O)([N-]c1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1)c1cccc2nonc21 ZINC001260443157 1069766579 /nfs/dbraw/zinc/76/65/79/1069766579.db2.gz ZNIDZPLLVPJRSN-QNHTTWNFSA-N -1 0 469.497 -0.084 20 10 JBCDRM O=S(=O)([N-]c1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc1)c1cccc2nonc21 ZINC001260443158 1069766967 /nfs/dbraw/zinc/76/69/67/1069766967.db2.gz ZNIDZPLLVPJRSN-WRJYRGCMSA-N -1 0 469.497 -0.084 20 10 JBCDRM