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SMILES: c1c(c(=O)[nH]c(=O)n1[C@H]1[C@@H]([C@@H]([C@H](O1)OP(=O)(CP(=O)(CP(=O)(O)[O-])[O-])[O-])O)O)/C=C/CN.[Na+].[Na+].[Na+] Canonical SMILES: NC/C=C/c1cn(c(=O)[nH]c1=O)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)OP(=O)(CP(=O)(CP(=O)(O)[O-])[O-])[O-].[Na+].[Na+].[Na+] InChI: InChI=1S/C13H22N3O13P3.3Na/c14-3-1-2-7-4-16(13(20)15-10(7)19)11-8(17)9(18)12(28-11)29-32(26,27)6-30(21,22)5-31(23,24)25;;;/h1-2,4,8-9,11-12,17-18H,3,5-6,14H2,(H,21,22)(H,26,27)(H,15,19,20)(H2,23,24,25);;;/q;3*+1/p-3/b2-1+;;;/t8-,9+,11-,12-;;;/m1.../s1 InChIKey: MFRKSTHYXMPZPJ-ZPVWDQBGSA-K
CBID:132645 http://www.chembase.cn/molecule-132645.html