Luteolin 7-diglucuronide
HIT212673159
sdf文件结构编辑类似物检索
HIT ID: HIT212673159
Cas No: 96400-45-2
分子式: C27H26O18
分子量: 638.487
常用名: Luteolin 7-diglucuronide
氢键受体数 (HBA): 18
氢键供体数 (HBD): 10
LogP: -0.99523085
IUPAC: (2S,3S,4S,5R,6S)-5-{[(2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl]oxy}-3,4-dihydroxyoxane-2-carboxylic acid
IUPAC: (2S,3S,4S,5R,6S)-5-{[(2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl]oxy}-3,4-dihydroxyoxane-2-carboxylic acid
SMILES: O[C@H]1[C@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)oc(cc4=O)-c3ccc(O)c(O)c3)O[C@@H]([C@@H](O)[C@@H]2O)C(O)=O)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O
SMILES: O[C@H]1[C@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)oc(cc4=O)-c3ccc(O)c(O)c3)O[C@@H]([C@@H](O)[C@@H]2O)C(O)=O)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O
InChI key: PBBVWJQPAZYQDB-DBFWEQBMSA-N
共显示2个结果
供应商规格单价货期纯度操作
TargetMol
SC
5651-3天 购物车
Mcule
SC
18944-5周 购物车
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