Chem
J-GLOBAL ID：200907029621911986   Nikkaji number：J605.088C

3-Hydroxy-19-norpregna-1,3,5(10)-trien-20-one

3-ヒドロキシ-19-ノルプレグナ-1,3,5(10)-トリエン-20-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： C20H26O2
Molecular formula furigana： C20-H26-O2
Molecular weight： 298.426
InChI： InChI=1S/C20H26O2/c1-12(21)18-7-8-19-17-5-3-13-11-14(22)4-6-15(13)16(17)9-10-20(18,19)2/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3/t16-,17-,18-,19+,20-/m1/s1
InChI key： HREDZMAPXFYEQW-LTFPLMDUSA-N
SMILES： CC(=O)[C@H]1CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@]12C
Systematic name  (3)：
  • 3-ヒドロキシ-19-ノルプレグナ-1,3,5(10)-トリエン-20-オン
  • 1-[(1S,3aS,3bS,9bS,11aS)-7-ヒドロキシ-11a-メチル-1H,2H,3H,3aH,3bH,4H,5H,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-[(1S,3aS,3bS,9bS,11aS)-7-hydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]ethan-1-one
Other name (1)：
  • 3-Hydroxy-19-norpregna-1,3,5(10)-trien-20-one
KEGG COMPOUND： C15277
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