10β,17β-dihydroxyestra-1,4-dien-3-one
HIT212666686
sdf文件结构编辑类似物检索
HIT ID: HIT212666686
Cas No: 549-02-0
分子式: C18H24O3
分子量: 288.387
常用名: 10β,17β-dihydroxyestra-1,4-dien-3-one
常用名: 10β,17β-dihydroxyestra-1,4-dien-3-one
氢键受体数 (HBA): 3
氢键供体数 (HBD): 2
LogP: 2.137761
IUPAC: (1S,3aS,3bS,9aS,9bS,11aS)-1,9a-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
IUPAC: (1S,3aS,3bS,9aS,9bS,11aS)-1,9a-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
SMILES: [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@]12O |c:22,t:18|
SMILES: [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@]12O |c:22,t:18|
InChI key: UIKDFTLKOKNUJP-UGDFAFBOSA-N
共显示2个结果
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TargetMol
SC
6705日内发货 购物车
Mcule
SC
11054-5周 购物车
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