Chem
J-GLOBAL ID：200907097725362335   Nikkaji number：J145.723C

16α-Hydroxyprogesterone

16α-ヒドロキシプロゲステロン
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： C21H30O3
Molecular formula furigana： C21-H30-O3
Molecular weight： 330.468
InChI： InChI=1S/C21H30O3/c1-12(22)19-18(24)11-17-15-5-4-13-10-14(23)6-8-20(13,2)16(15)7-9-21(17,19)3/h10,15-19,24H,4-9,11H2,1-3H3/t15-,16+,17+,18-,19+,20+,21+/m1/s1
InChI key： LOVNYFVWYTXDRE-RMWFXKKMSA-N
SMILES： CC(=O)[C@H]1[C@H](O)C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (4)：
  • 16α-ヒドロキシプロゲステロン
  • 16α-ヒドロキシプレグナ-4-エン-3,20-ジオン
  • (1R,2R,3aS,3bS,9aR,9bS,11aS)-1-アセチル-2-ヒドロキシ-9a,11a-ジメチル-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-7-オン
  • (1R,2R,3aS,3bS,9aR,9bS,11aS)-1-acetyl-2-hydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (2)：
  • 16α-Hydroxyprogesterone
  • 16α-Hydroxypregn-4-ene-3,20-dione
CAS registry number： 438-07-3
KEGG COMPOUND： C03748
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