24-Hydroxycholesterol
HIT212666724
sdf文件结构编辑类似物检索
HIT ID: HIT212666724
Cas No: 30271-38-6
分子式: C27H46O2
分子量: 402.663
常用名: 24-Hydroxycholesterol
氢键受体数 (HBA): 2
氢键供体数 (HBD): 2
LogP: 5.8041244
IUPAC: (1R,3aS,3bS,7S,9aR,9bS,11aR)-1-[(2R)-5-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
IUPAC: (1R,3aS,3bS,7S,9aR,9bS,11aR)-1-[(2R)-5-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
SMILES: [H][C@@]12CC[C@H]([C@H](C)CCC(O)C(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C |t:25|
SMILES: [H][C@@]12CC[C@H]([C@H](C)CCC(O)C(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C |t:25|
InChI key: IOWMKBFJCNLRTC-GHMQSXNDSA-N
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