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SMILES: O=C(c1c(c(c(c(c1)C(=O)C)O)CCC)O)C Canonical SMILES: CCCc1c(O)c(cc(c1O)C(=O)C)C(=O)C InChI: InChI=1S/C13H16O4/c1-4-5-9-12(16)10(7(2)14)6-11(8(3)15)13(9)17/h6,16-17H,4-5H2,1-3H3 InChIKey: CDZGGLGTYSVPPX-UHFFFAOYSA-N
CBID:79532 http://www.chembase.cn/molecule-79532.html