Chem
J-GLOBAL ID：200907083910082798   Nikkaji number：J58.218B

Androstane-3α,17β-diol

アンドロスタン-3α,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： C19H32O2
Molecular formula furigana： C19-H32-O2
Molecular weight： 292.463
InChI： InChI=1S/C19H32O2/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/h12-17,20-21H,3-11H2,1-2H3/t12?,13-,14+,15+,16+,17+,18+,19+/m1/s1
InChI key： CBMYJHIOYJEBSB-JBDJBKRMSA-N
SMILES： C[C@]12CC[C@H]3[C@@H](CCC4C[C@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2O
Systematic name  (4)：
  • アンドロスタン-3α,17β-ジオール
  • 5ξ-アンドロスタン-3α,17β-ジオール
  • (1S,3aS,3bR,7R,9aS,9bS,11aS)-9a,11a-ジメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-1,7-ジオール
  • (1S,3aS,3bR,7R,9aS,9bS,11aS)-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-1,7-diol
Other name (3)：
  • 5ξ-Androstane-3α,17β-diol
  • Androstane-3α,17β-diol
  • Androstan-3α,17β-diol
Regulation number (1)：
  • BV8044300
KEGG COMPOUND： C03852
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