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SMILES: C[S+](CCC(C(=O)[O-])N)CC1C(C(C(O1)n1cnc2c1ncnc2N)O)O Canonical SMILES: C[S+](CC1OC(C(C1O)O)n1cnc2c1ncnc2N)CCC(C(=O)[O-])N InChI: InChI=1S/C15H22N6O5S/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25) InChIKey: MEFKEPWMEQBLKI-UHFFFAOYSA-N
CBID:131170 http://www.chembase.cn/molecule-131170.html