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Chem
J-GLOBAL ID：200907002831976309
Nikkaji number：J945.805K 17-(1H-Pyrazole-1-yl)androsta-5,16-diene-3β-ol
17-(1H-ピラゾール-1-イル)アンドロスタ-5,16-ジエン-3β-オール
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C22H30N2O
Molecular formula furigana： C22-H30-N2-O
Molecular weight： 338.495
InChI：
InChI=1S/C22H30N2O/c1-21-10-8-16(25)14-15(21)4-5-17-18-6-7-20(24-13-3-12-23-24)22(18,2)11-9-19(17)21/h3-4,7,12-13,16-19,25H,5-6,8-11,14H2,1-2H3/t16-,17-,18-,19-,21-,22-/m0/s1
InChI key：
RYIAPGBPXBVXQC-BLQWBTBKSA-N
SMILES：
C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC=C2n1cccn1
Systematic name (3)： - 17-(1H-ピラゾール-1-イル)アンドロスタ-5,16-ジエン-3β-オール
- (3aS,3bR,7S,9aR,9bS,11aS)-9a,11a-ジメチル-1-(1H-ピラゾール-1-イル)-3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オール
- (3aS,3bR,7S,9aR,9bS,11aS)-9a,11a-dimethyl-1-(1H-pyrazol-1-yl)-3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
- 17-(1H-Pyrazole-1-yl)androsta-5,16-diene-3β-ol
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