Chem
J-GLOBAL ID：200907047583061823   Nikkaji number：J143.194C

Δ5-Pregnen-3β-ol

Δ5-プレグネン-3β-オール
Substance type：
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
Molecular formula： C21H34O
Molecular formula furigana： C21-H34-O
Molecular weight： 302.502
InChI： InChI=1S/C21H34O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h5,14,16-19,22H,4,6-13H2,1-3H3/t14-,16-,17-,18-,19-,20+,21-/m0/s1
InChI key： QWUGXTUSOZVHEM-UZCUGSDUSA-N
SMILES： CC[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 3β-ヒドロキシプレグナ-5-エン
  • (1S,3aS,3bS,7S,9aR,9bS,11aR)-1-エチル-9a,11a-ジメチル-1H,2H,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
  • (1S,3aS,3bS,7S,9aR,9bS,11aR)-1-ethyl-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
Other name (3)：
  • Δ5-プレグネン-3β-オール
  • Δ5-Pregnen-3β-ol
  • 3β-Hydroxypregn-5-ene
CAS registry number： 2862-58-0
KEGG COMPOUND： C14482
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