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Molecular weight: 608.67
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Iso. SMILES:
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CC(C)(C(=O)[O-])O/N=C(\C1=CSC(=N1)N)/C(=O)N[C@@H]2[C@H]3N(C2=O)C(=C(CS3=O)CSC4=CC=[N+](C=C4)C)C(=O)O
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InChI Key:
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HCCFUFNFJIUPHS-UMIMETMPSA-N
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Can. SMILES:
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CC(C)(C(=O)[O-])O/N=C(\C1=CSC(=N1)N)/C(=O)N[C@H]2C(=O)N3C(=C(CSC4=CC=[N+](C)C=C4)CS(=O)[C@@H]23)C(=O)O
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InChI:
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InChI=1S/C23H24N6O8S3/c1-23(2,21(34)35)37-27-14(13-9-39-22(24)25-13)17(30)26-15-18(31)29-16(20(32)33)11(10-40(36)19(15)29)8-38-12-4-6-28(3)7-5-12/h4-7,9,15,19H,8,10H2,1-3H3,(H4-,24,25,26,30,32,33,34,35)/b27-14+/t15-,19-,40?/m0/s1
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