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SMILES: c12c(Nc3c(C(=N1)N1CCN(CC1)C)cc(s3)C)cccc2.c1ccc2c(c1)cc(c(c2Cc1c(c(cc2c1cccc2)C(=O)O)O)O)C(=O)O.O Canonical SMILES: OC(=O)c1cc2ccccc2c(c1O)Cc1c(O)c(cc2c1cccc2)C(=O)O.CN1CCN(CC1)C1=Nc2ccccc2Nc2c1cc(s2)C.O InChI: InChI=1S/C23H16O6.C17H20N4S.H2O/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12;/h1-10,24-25H,11H2,(H,26,27)(H,28,29);3-6,11,19H,7-10H2,1-2H3;1H2 InChIKey: ZIMCQJVMPKQQPB-UHFFFAOYSA-N
CBID:175821 http://www.chembase.cn/molecule-175821.html