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SMILES: [Na+].[Na+].[Na+].c1(cc2c(c(c1)O)c(c(c(c2)S(=O)(=O)O)N=Nc1c(ccc(c1)S(=O)(=O)O)O)O)S(=O)(=O)O Canonical SMILES: Oc1ccc(cc1N=Nc1c(O)c2c(O)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O.[Na+].[Na+].[Na+] InChI: InChI=1S/C16H12N2O12S3.3Na/c19-11-2-1-8(31(22,23)24)5-10(11)17-18-15-13(33(28,29)30)4-7-3-9(32(25,26)27)6-12(20)14(7)16(15)21;;;/h1-6,19-21H,(H,22,23,24)(H,25,26,27)(H,28,29,30);;;/q;3*+1 InChIKey: XHCCWBJFZUXJBV-UHFFFAOYSA-N
CBID:798147 http://www.chembase.cn/molecule-798147.html