Aegineoside
HIT104510000
sdf文件结构编辑类似物检索
HIT ID: HIT104510000
Cas No: 752209-48-6
分子式: C26H30O12
分子量: 534.514
常用名: Aegineoside
氢键受体数 (HBA): 12
氢键供体数 (HBD): 6
LogP: -0.115
IUPAC: (2E)-3-[(2R,3S)-3-(hydroxymethyl)-7-methoxy-2-(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid
IUPAC: (2E)-3-[(2R,3S)-3-(hydroxymethyl)-7-methoxy-2-(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-2,3-dihydro-1-benzofuran-5-yl]prop-2-enoic acid
SMILES: COc1cc(\C=C\C(O)=O)cc2[C@@H](CO)[C@@H](Oc12)c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c1
SMILES: COc1cc(\C=C\C(O)=O)cc2[C@@H](CO)[C@@H](Oc12)c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c1
InChI key: QQYGUIBEIDPARU-IAJBZRFBSA-N
共显示3个结果
供应商规格单价货期纯度操作
TargetMol
SC
2350 购物车
Analyticon
SC
32893-4周 购物车
Mcule
SC
50204-5周 购物车
TargetMol | Target Loading
正在加载 ~