Naringenin 7-O-β-D-glucuronide methyl ester
HIT214316967
sdf文件结构编辑类似物检索
HIT ID: HIT214316967
Cas No: 1985597-72-5
分子式: C22H22O11
分子量: 462.407
常用名: Naringenin 7-O-β-D-glucuronide methyl ester
常用名: Naringenin 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-{[(2S)-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}oxane-2-carboxylate
IUPAC: methyl (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{[(2S)-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}oxane-2-carboxylate
SMILES: COC(=O)[C@H]1O[C@@H](Oc2cc(O)c3C(=O)C[C@H](Oc3c2)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
SMILES: COC(=O)[C@H]1O[C@@H](Oc2cc(O)c3C(=O)C[C@H](Oc3c2)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
InChI key: VXDMNDDYZSDEEQ-QBUJOIIVSA-N
共显示2个结果
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