Caffeic acid 4-O-glucoside
HIT214313102
sdf文件结构编辑类似物检索
HIT ID: HIT214313102
Cas No: 166735-99-5
分子式: C15H18O9
分子量: 342.3
常用名: Caffeic acid 4-O-glucoside
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 3-(3-hydroxy-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid
IUPAC: 3-(3-hydroxy-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid
SMILES: OC[C@H]1O[C@H](Oc2ccc(C=CC(O)=O)cc2O)[C@H](O)[C@@H](O)[C@@H]1O |w:10.9|
SMILES: OC[C@H]1O[C@H](Oc2ccc(C=CC(O)=O)cc2O)[C@H](O)[C@@H](O)[C@@H]1O |w:10.9|
InChI key: OHEYCHKLBCPRLZ-LFHLZQBKSA-N
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