Chem
J-GLOBAL ID：200907096074515581   Nikkaji number：J564.832G

16α-Hydroxypregnenolone

16α-ヒドロキシプレグネノロン
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： C21H32O3
Molecular formula furigana： C21-H32-O3
Molecular weight： 332.484
InChI： InChI=1S/C21H32O3/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/h4,14-19,23-24H,5-11H2,1-3H3/t14-,15+,16-,17-,18+,19-,20-,21-/m0/s1
InChI key： ZAKJZPQDUPCXSD-YRWKUUEZSA-N
SMILES： CC(=O)[C@H]1[C@H](O)C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 3β,16α-ジヒドロキシプレグナ-5-エン-20-オン
  • 1-[(1R,2R,3aS,3bS,7S,9aR,9bS,11aS)-2,7-ジヒドロキシ-9a,11a-ジメチル-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-イル]エタン-1-オン
  • 1-[(1R,2R,3aS,3bS,7S,9aR,9bS,11aS)-2,7-dihydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]ethan-1-one
Other name (3)：
  • 3β,16α-Dihydroxypregn-5-en-20-one
  • 16α-ヒドロキシプレグネノロン
  • 16α-Hydroxypregnenolone
KEGG COMPOUND： C06390
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