Chem
J-GLOBAL ID：201007021287369024   Nikkaji number：J2.794.380B

5α-Androst-1-ene-3,11,17-trione

5α-アンドロスタ-1-エン-3,11,17-トリオン
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： C19H24O3
Molecular formula furigana： C19-H24-O3
Molecular weight： 300.398
InChI： InChI=1S/C19H24O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h7-8,11,13-14,17H,3-6,9-10H2,1-2H3/t11-,13-,14-,17+,18-,19-/m0/s1
InChI key： NYLSQMMWVJMFFO-XNTXBEAUSA-N
SMILES： C[C@]12CC(=O)[C@H]3[C@@H](CC[C@H]4CC(=O)C=C[C@]34C)[C@@H]1CCC2=O
Systematic name  (3)：
  • 5α-アンドロスタ-1-エン-3,11,17-トリオン
  • (3aS,3bS,5aS,9aR,9bS,11aS)-9a,11a-ジメチル-1H,2H,3H,3aH,3bH,4H,5H,5aH,6H,7H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1,7,10-トリオン
  • (3aS,3bS,5aS,9aR,9bS,11aS)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,5aH,6H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7,10-trione
Other name (2)：
  • 5α-Androsta-1-ene-3,11,17-trione
  • 5α-Androst-1-ene-3,11,17-trione
KEGG COMPOUND： C15406
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