Dihydrobaicalin
HIT217584142
sdf文件结构编辑类似物检索
HIT ID: HIT217584142
Cas No: 56226-98-3
分子式: C21H20O11
分子量: 448.38
常用名: Dihydrobaicalin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S,3S,4S,5R,6S)-6-{[(2S)-5,6-dihydroxy-4-oxo-2-phenyl-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
IUPAC: (2S,3S,4S,5R,6S)-6-{[(2S)-5,6-dihydroxy-4-oxo-2-phenyl-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
SMILES: O[C@@H]1[C@@H](O)[C@H](Oc2cc3O[C@@H](CC(=O)c3c(O)c2O)c2ccccc2)O[C@@H]([C@H]1O)C(O)=O
SMILES: O[C@@H]1[C@@H](O)[C@H](Oc2cc3O[C@@H](CC(=O)c3c(O)c2O)c2ccccc2)O[C@@H]([C@H]1O)C(O)=O
InChI key: UVNUGBQJLDGZKE-XDZPIWCFSA-N
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SC
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