Chem
J-GLOBAL ID：200907014926648188   Nikkaji number：J1.235.611K

3β-(Methoxycarbonyloxy)androsta-5-ene-7,17-dione

3β-(メトキシカルボニルオキシ)アンドロスタ-5-エン-7,17-ジオン
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： C21H28O5
Molecular formula furigana： C21-H28-O5
Molecular weight： 360.450
InChI： InChI=1S/C21H28O5/c1-20-8-6-13(26-19(24)25-3)10-12(20)11-16(22)18-14-4-5-17(23)21(14,2)9-7-15(18)20/h11,13-15,18H,4-10H2,1-3H3/t13-,14-,15-,18-,20-,21-/m0/s1
InChI key： OIWCVMDZSJYYES-ADAATNHASA-N
SMILES： COC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CCC4=O)[C@@H]3C(=O)C=C2C1
Systematic name  (3)：
  • 3β-(メトキシカルボニルオキシ)アンドロスタ-5-エン-7,17-ジオン
  • (3aS,3bR,7S,9aR,9bS,11aS)-9a,11a-ジメチル-1,4-ジオキソ-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-7-イル メチル カルボナート
  • (3aS,3bR,7S,9aR,9bS,11aS)-9a,11a-dimethyl-1,4-dioxo-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl methyl carbonate
Other name (1)：
  • 3β-(Methoxycarbonyloxy)androsta-5-ene-7,17-dione
Thsaurus map：
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