Pregnenolone monosulfate
HIT212667250
sdf文件结构编辑类似物检索
HIT ID: HIT212667250
Cas No: 1247-64-9
分子式: C21H32O5S
分子量: 396.54
常用名: Pregnenolone monosulfate
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 3.6363442
IUPAC: [(1S,3aS,3bS,7S,9aR,9bS,11aS)-1-acetyl-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxidanesulfonic acid
IUPAC: [(1S,3aS,3bS,7S,9aR,9bS,11aS)-1-acetyl-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxidanesulfonic acid
SMILES: [H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OS(O)(=O)=O |t:19|
SMILES: [H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OS(O)(=O)=O |t:19|
InChI key: DIJBBUIOWGGQOP-QGVNFLHTSA-N
共显示2个结果
供应商规格单价货期纯度操作
TargetMol
SC
2181-3天 购物车
Mcule
SC
5014-5周 购物车
TargetMol | Target Loading
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