Chem
J-GLOBAL ID：200907026714867449   Nikkaji number：J1.253.634H

RU-24858

RU-24858
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： C23H28FNO3
Molecular formula furigana： C23-H28-F-N-O3
Molecular weight： 385.479
InChI： InChI=1S/C23H28FNO3/c1-13-10-17-16-5-4-14-11-15(26)6-8-22(14,3)23(16,24)19(28)12-21(17,2)20(13)18(27)7-9-25/h6,8,11,13,16-17,19-20,28H,4-5,7,10,12H2,1-3H3/t13-,16+,17+,19+,20-,21+,22+,23+/m1/s1
InChI key： LQHIJOQODVGHSE-UCMWIJGCSA-N
SMILES： C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@H]1C(=O)CC#N
Systematic name  (3)：
  • 9-フルオロ-11β-ヒドロキシ-16α-メチル-3,20-ジオキソプレグナ-1,4-ジエン-21-カルボニトリル
  • 3-[(1S,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-フルオロ-10-ヒドロキシ-2,9a,11a-トリメチル-7-オキソ-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1-イル]-3-オキソプロパンニトリル
  • 3-[(1S,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-10-hydroxy-2,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-3-oxopropanenitrile
Other name (2)：
  • 9-Fluoro-11β-hydroxy-16α-methyl-3,20-dioxopregna-1,4-diene-21-carbonitrile
  • RU-24858
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