Chem
J-GLOBAL ID：201007004755950390   Nikkaji number：J2.791.764J

17-Methylandrost-5-ene-3β,11β,17β-triol

17-メチルアンドロスタ-5-エン-3β,11β,17β-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： C20H32O3
Molecular formula furigana： C20-H32-O3
Molecular weight： 320.473
InChI： InChI=1S/C20H32O3/c1-18-8-6-13(21)10-12(18)4-5-14-15-7-9-20(3,23)19(15,2)11-16(22)17(14)18/h4,13-17,21-23H,5-11H2,1-3H3/t13-,14-,15-,16-,17+,18-,19-,20-/m0/s1
InChI key： GKKUXCSIYRLCSI-AGVUXJGHSA-N
SMILES： C[C@]1(O)CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
Systematic name  (3)：
  • 17-メチルアンドロスタ-5-エン-3β,11β,17β-トリオール
  • (1S,3aS,3bS,7S,9aR,9bS,10S,11aS)-1,9a,11a-トリメチル-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-1,7,10-トリオール
  • (1S,3aS,3bS,7S,9aR,9bS,10S,11aS)-1,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7,10-triol
Other name (2)：
  • 17-Methylandrosta-5-ene-3β,11β,17β-triol
  • 17-Methylandrost-5-ene-3β,11β,17β-triol
KEGG COMPOUND： C15041
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