Chem
J-GLOBAL ID：200907004495621842   Nikkaji number：J527.928C

Androst-4-ene-3β,17β-diol

アンドロスタ-4-エン-3β,17β-ジオール
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： C19H30O2
Molecular formula furigana： C19-H30-O2
Molecular weight： 290.447
InChI： InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,13-17,20-21H,3-10H2,1-2H3/t13-,14-,15-,16-,17-,18-,19-/m0/s1
InChI key： BTTWKVFKBPAFDK-LOVVWNRFSA-N
SMILES： C[C@]12CC[C@H]3[C@@H](CCC4=C[C@@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Systematic name  (4)：
  • アンドロスタ-4-エン-3β,17β-ジオール
  • 3β,17β-ジヒドロキシアンドロスタ-4-エン
  • (1S,3aS,3bR,7S,9aR,9bS,11aS)-9a,11a-ジメチル-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1,7-ジオール
  • (1S,3aS,3bR,7S,9aR,9bS,11aS)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol
Other name (2)：
  • Androst-4-ene-3β,17β-diol
  • 3β,17β-Dihydroxyandrosta-4-ene
KEGG COMPOUND： C14210
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