Deacylmetaplexigenin
HIT212667033
sdf文件结构编辑类似物检索
HIT ID: HIT212667033
Cas No: 3513-04-0
分子式: C21H32O6
分子量: 380.481
常用名: Deacylmetaplexigenin
氢键受体数 (HBA): 6
氢键供体数 (HBD): 5
LogP: -0.48161608
IUPAC: 1-[(1S,3aR,3bS,7S,9aR,9bR,11R,11aS)-1,3a,3b,7,11-pentahydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]ethan-1-one
IUPAC: 1-[(1S,3aR,3bS,7S,9aR,9bR,11R,11aS)-1,3a,3b,7,11-pentahydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]ethan-1-one
SMILES: [H][C@]12C[C@@H](O)[C@]3(C)[C@@](O)(CC[C@]3(O)[C@]1(O)CC=C1C[C@@H](O)CC[C@]21C)C(C)=O |t:18|
SMILES: [H][C@]12C[C@@H](O)[C@]3(C)[C@@](O)(CC[C@]3(O)[C@]1(O)CC=C1C[C@@H](O)CC[C@]21C)C(C)=O |t:18|
InChI key: ATMZVVNNICECKQ-MNSFQJRNSA-N
共显示2个结果
供应商规格单价货期纯度操作
TargetMol
SC
140005日内发货 购物车
Mcule
SC
123444-5周 购物车
TargetMol | Target Loading
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