Chem
J-GLOBAL ID：200907002840370685   Nikkaji number：J617.458B

abiraterone acetate

アビラテロン酢酸エステル
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： C26H33NO2
Molecular formula furigana： C26-H33-N-O2
Molecular weight： 391.555
InChI： InChI=1S/C26H33NO2/c1-17(28)29-20-10-12-25(2)19(15-20)6-7-21-23-9-8-22(18-5-4-14-27-16-18)26(23,3)13-11-24(21)25/h4-6,8,14,16,20-21,23-24H,7,9-13,15H2,1-3H3/t20-,21-,23-,24-,25-,26+/m0/s1
InChI key： UVIQSJCZCSLXRZ-UBUQANBQSA-N
SMILES： CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC=C4c4cccnc4)[C@@H]3CC=C2C1
Systematic name  (4)：
  • 17-(3-ピリジニル)アンドロスタ-5,16-ジエン-3β-オールアセタート
  • 17-(3-ピリジル)アンドロスタ-5,16-ジエン-3β-オールアセタート
  • (3aS,3bR,7S,9aR,9bS,11aS)-9a,11a-ジメチル-1-(ピリジン-3-イル)-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 アセタート
  • (3aS,3bR,7S,9aR,9bS,11aS)-9a,11a-dimethyl-1-(pyridin-3-yl)-3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl acetate
Other name (10)：
  • CB-7630
  • 17-(3-Pyridyl)androsta-5,16-dien-3β-ol acetate
  • 17-(3-Pyridinyl)androsta-5,16-dien-3β-ol acetate
  • アビラテロンアセタート
  • Abiraterone acetate
Show all
Application (2)：
antitumor drug ,  prostatic tumor
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