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SMILES: c1(nc(cc(n1)OC)OC)Oc1c(C(=O)O)nccc1.O Canonical SMILES: COc1cc(OC)nc(n1)Oc1cccnc1C(=O)O.O InChI: InChI=1S/C12H11N3O5.H2O/c1-18-8-6-9(19-2)15-12(14-8)20-7-4-3-5-13-10(7)11(16)17;/h3-6H,1-2H3,(H,16,17);1H2 InChIKey: GKHNNTOQVPMCRW-UHFFFAOYSA-N
CBID:61550 http://www.chembase.cn/molecule-61550.html