2-(3,4-dihydroxyphenyl)-7-hydroxy-3,5-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})chromen-4-one, Quercetin 3,5-O-diglucoside
HIT218679486
sdf文件结构编辑类似物检索
HIT ID: HIT218679486
Cas No:
分子式: C27H30O17
分子量: 626.52
常用名: 2-(3,4-dihydroxyphenyl)-7-hydroxy-3,5-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})chromen-4-one, Quercetin 3,5-O-diglucoside
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-(3,4-dihydroxyphenyl)-7-hydroxy-3,5-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-4H-chromen-4-one
SMILES: OCC1OC(Oc2cc(O)cc3oc(-c4ccc(O)c(O)c4)c(OC4OC(CO)C(O)C(O)C4O)c(=O)c23)C(O)C(O)C1O
InChI key: YOXWSUCVDVXAMX-UHFFFAOYSA-N
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