medicagenic acid
HIT212658930
sdf文件结构编辑类似物检索
HIT ID: HIT212658930
Cas No: 599-07-5
分子式: C30H46O6
分子量: 502.692
常用名: medicagenic acid
氢键受体数 (HBA): 6
氢键供体数 (HBD): 4
LogP: 4.711622
IUPAC: (2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-2,3-dihydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-4,8a-dicarboxylic acid
IUPAC: (2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-2,3-dihydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-4,8a-dicarboxylic acid
SMILES: [H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)C[C@H](O)[C@H](O)[C@@](C)(C(O)=O)[C@]3([H])CC[C@@]12C)C(O)=O |t:15|
SMILES: [H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)C[C@H](O)[C@H](O)[C@@](C)(C(O)=O)[C@]3([H])CC[C@@]12C)C(O)=O |t:15|
InChI key: IDGXIXSKISLYAC-WNTKNEGGSA-N
共显示2个结果
供应商规格单价货期纯度操作
TargetMol
SC
2491-3天 购物车
Mcule
SC
8094-5周 购物车
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