Ladanetin-6-O-β-D-glucopyranoside
HIT218850809
sdf文件结构编辑类似物检索
HIT ID: HIT218850809
Cas No: 89647-63-2
分子式: C22H22O11
分子量: 462.407
常用名: Ladanetin-6-O-β-D-glucopyranoside
常用名: Ladanetin-6-O-β-D-glucopyranoside
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one
IUPAC: 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one
SMILES: COc1cc2oc(cc(=O)c2c(O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)-c1ccc(O)cc1
SMILES: COc1cc2oc(cc(=O)c2c(O)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)-c1ccc(O)cc1
InChI key: JSUJHPSAVAWXEN-GSVZXUNASA-N
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