Chem
J-GLOBAL ID：201007039249708555   Nikkaji number：J2.792.703C

Androst-5-ene-3β,17β,19-triol

アンドロスタ-5-エン-3β,17β,19-トリオール
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： C19H30O3
Molecular formula furigana： C19-H30-O3
Molecular weight： 306.446
InChI： InChI=1S/C19H30O3/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h2,13-17,20-22H,3-11H2,1H3/t13-,14-,15-,16-,17-,18-,19+/m0/s1
InChI key： KPTQFNUKAKVGSS-ACJJDMNUSA-N
SMILES： C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34CO)[C@@H]1CC[C@@H]2O
Systematic name  (3)：
  • アンドロスタ-5-エン-3β,17β,19-トリオール
  • (1S,3aS,3bR,7S,9aS,9bS,11aS)-9a-(ヒドロキシメチル)-11a-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-1,7-ジオール
  • (1S,3aS,3bR,7S,9aS,9bS,11aS)-9a-(hydroxymethyl)-11a-methyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol
Other name (2)：
  • Androsta-5-ene-3β,17β,19-triol
  • Androst-5-ene-3β,17β,19-triol
KEGG COMPOUND： C15097
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