Protocetraric acid
HIT214312595
sdf文件结构编辑类似物检索
HIT ID: HIT214312595
Cas No: 489-51-0
分子式: C18H14O9
分子量: 374.301
常用名: Protocetraric acid
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 15-formyl-6,14-dihydroxy-7-(hydroxymethyl)-4,12-dimethyl-10-oxo-2,9-dioxatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid
IUPAC: 15-formyl-6,14-dihydroxy-7-(hydroxymethyl)-4,12-dimethyl-10-oxo-2,9-dioxatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid
SMILES: Cc1cc(O)c(C=O)c2Oc3c(C)c(C(O)=O)c(O)c(CO)c3OC(=O)c12
SMILES: Cc1cc(O)c(C=O)c2Oc3c(C)c(C(O)=O)c(O)c(CO)c3OC(=O)c12
InChI key: VOXMONAUSQZPTP-UHFFFAOYSA-N
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