Chem
J-GLOBAL ID：200907094762689388   Nikkaji number：J2.414.940D

3-Oxoandrosta-4-ene-17β-ol 3-methyl-2-pyridinecarboxylate

3-オキソアンドロスタ-4-エン-17β-オール3-メチル-2-ピリジンカルボキシラート
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： C26H33NO3
Molecular formula furigana： C26-H33-N-O3
Molecular weight： 407.554
InChI： InChI=1S/C26H33NO3/c1-16-5-4-14-27-23(16)24(29)30-22-9-8-20-19-7-6-17-15-18(28)10-12-25(17,2)21(19)11-13-26(20,22)3/h4-5,14-15,19-22H,6-13H2,1-3H3/t19-,20-,21-,22-,25-,26-/m0/s1
InChI key： ZMUCEVZJAJZNTI-BNCSLUSBSA-N
SMILES： Cc1cccnc1C(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • 3-オキソアンドロスタ-4-エン-17β-オール3-メチル-2-ピリジンカルボキシラート
  • (1S,3aS,3bR,9aR,9bS,11aS)-9a,11a-ジメチル-7-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-1-イル 3-メチルピリジン-2-カルボキシラート
  • (1S,3aS,3bR,9aR,9bS,11aS)-9a,11a-dimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl 3-methylpyridine-2-carboxylate
Other name (1)：
  • 3-Oxoandrosta-4-ene-17β-ol 3-methyl-2-pyridinecarboxylate
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