Arctigenin 4'-O-β-gentiobioside
HIT212665275
sdf文件结构编辑类似物检索
HIT ID: HIT212665275
Cas No: 41682-24-0
分子式: C33H44O16
分子量: 696.699
常用名: Arctigenin 4'-O-β-gentiobioside
氢键受体数 (HBA): 15
氢键供体数 (HBD): 7
LogP: -0.60122716
IUPAC: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}phenyl)methyl]oxolan-2-one
IUPAC: (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}phenyl)methyl]oxolan-2-one
SMILES: COc1ccc(C[C@H]2COC(=O)[C@@H]2Cc2ccc(O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc1OC
SMILES: COc1ccc(C[C@H]2COC(=O)[C@@H]2Cc2ccc(O[C@@H]3O[C@H](CO[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc1OC
InChI key: FEQSYBHDHIPRKS-QWNZGVGBSA-N
共显示3个结果
供应商规格单价货期纯度操作
TargetMol
SC
2380 购物车
Mcule
SC
18944-5周 购物车
Mcule
SC
17904-5周 购物车
TargetMol | Target Loading
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