Chem
J-GLOBAL ID：200907094100140220   Nikkaji number：J2.641.537C

16α-Hydroxy-17-oxoandrosta-4-ene-19-al

16α-ヒドロキシ-17-オキソアンドロスタ-4-エン-19-アール
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： C19H26O3
Molecular formula furigana： C19-H26-O3
Molecular weight： 302.414
InChI： InChI=1S/C19H26O3/c1-18-9-7-14-13(15(18)10-16(21)17(18)22)6-5-12-4-2-3-8-19(12,14)11-20/h4,11,13-16,21H,2-3,5-10H2,1H3/t13-,14+,15+,16-,18+,19-/m1/s1
InChI key： JBXMOBICZNXLIZ-ROSLGNJOSA-N
SMILES： C[C@]12CC[C@H]3[C@@H](CCC4=CCCC[C@]34C=O)[C@@H]1C[C@@H](O)C2=O
Systematic name  (3)：
  • 16α-ヒドロキシ-17-オキソアンドロスタ-4-エン-19-アール
  • (2R,3aS,3bR,9aS,9bS,11aS)-2-ヒドロキシ-11a-メチル-1-オキソ-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-9a-カルバルデヒド
  • (2R,3aS,3bR,9aS,9bS,11aS)-2-hydroxy-11a-methyl-1-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-9a-carbaldehyde
Other name (1)：
  • 16α-Hydroxy-17-oxoandrosta-4-ene-19-al
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