HIT ID: HIT217583923
Cas No: 82475-02-3;82475-01-2
分子式: C23H22O11
分子量: 474.418
常用名: Oroxylin A 7-O-β-D-glucuronide methyl ester
常用名: Oroxylin A 7-O-β-D-glucuronide methyl ester
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(5-hydroxy-6-methoxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]oxane-2-carboxylate
IUPAC: methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(5-hydroxy-6-methoxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]oxane-2-carboxylate
SMILES: COC(=O)[C@H]1O[C@@H](Oc2cc3oc(cc(=O)c3c(O)c2OC)-c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O
SMILES: COC(=O)[C@H]1O[C@@H](Oc2cc3oc(cc(=O)c3c(O)c2OC)-c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O
InChI key: BLLTXLXSBUMNOK-VLXBDIDVSA-N
