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SMILES: Cc1ccc(C[n+]2csc(CCO[P@@](=O)(O)OP(=O)(O)[O-])c2C)c(N)n1 Canonical SMILES: Cc1ccc(c(n1)N)C[n+]1csc(c1C)CCO[P@](=O)(OP(=O)(O)[O-])O InChI: InChI=1S/C13H19N3O7P2S/c1-9-3-4-11(13(14)15-9)7-16-8-26-12(10(16)2)5-6-22-25(20,21)23-24(17,18)19/h3-4,8H,5-7H2,1-2H3,(H4-,14,15,17,18,19,20,21) InChIKey: JHNXLHRDUXBCJW-UHFFFAOYSA-N
CBID:1433 http://www.chembase.cn/molecule-1433.html