Hesperidin
HIT104557330
sdf文件结构编辑类似物检索
HIT ID: HIT104557330
Cas No: 520-26-3
分子式: C28H34O15
分子量: 610.565
常用名: Hesperidin
氢键受体数 (HBA): 15
氢键供体数 (HBD): 8
LogP: -2.910000000000000e-001
IUPAC: (2S)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-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)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-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(cc1O)[C@@H]1CC(=O)c2c(O)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(cc1O)[C@@H]1CC(=O)c2c(O)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: QUQPHWDTPGMPEX-QJBIFVCTSA-N
共显示5个结果
供应商规格单价货期纯度操作
TargetMol
SC
1081-3天 购物车
Enamine
SC
13733-5周 购物车
InterBioScreen
NC
20063-5周 购物车
Mcule
SC
844-5周 购物车
Mcule
SC
754-5周 购物车
TargetMol | Target Loading
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