HIT ID: HIT101191021

Cas No: 74712-71-3

分子式: C22H28O13

分子量: 500.453

常用名: Haploperoside A

氢键受体数 (HBA): 12

氢键供体数 (HBD): 6

LogP: -1.67

IUPAC: 6-methoxy-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-2H-chromen-2-one

SMILES: COc1cc2ccc(=O)oc2cc1O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O

InChI key: FCIZPHNZRNLUJD-HLUXVQISSA-N