Diosmin Impurity 8
HIT214312696
sdf文件结构编辑类似物检索
HIT ID: HIT214312696
Cas No: 28719-21-3
分子式: C30H38O15
分子量: 638.619
常用名: Diosmin Impurity 8
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-2-(3,4-dimethoxyphenyl)-5-methoxy-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one
IUPAC: (2S)-2-(3,4-dimethoxyphenyl)-5-methoxy-7-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one
SMILES: COc1ccc(cc1OC)[C@@H]1CC(=O)c2c(OC)cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2O1
SMILES: COc1ccc(cc1OC)[C@@H]1CC(=O)c2c(OC)cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2O1
InChI key: HGNGSTGMDVMUMT-IPVBXYCWSA-N
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