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SMILES: OCC1OC(C(O)C1O)c1c[nH]c(=O)[nH]c1=O Canonical SMILES: OCC1OC(C(C1O)O)c1c[nH]c(=O)[nH]c1=O InChI: InChI=1S/C9H12N2O6/c12-2-4-5(13)6(14)7(17-4)3-1-10-9(16)11-8(3)15/h1,4-7,12-14H,2H2,(H2,10,11,15,16) InChIKey: PTJWIQPHWPFNBW-UHFFFAOYSA-N
CBID:106126 http://www.chembase.cn/molecule-106126.html