Chem
J-GLOBAL ID：201007091815835618   Nikkaji number：J2.791.375J

11α-Hydroxy-12α-methylpregn-4-ene-3,20-dione

11α-ヒドロキシ-12α-メチルプレグナ-4-エン-3,20-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： C22H32O3
Molecular formula furigana： C22-H32-O3
Molecular weight： 344.495
InChI： InChI=1S/C22H32O3/c1-12-20(25)19-16(18-8-7-17(13(2)23)22(12,18)4)6-5-14-11-15(24)9-10-21(14,19)3/h11-12,16-20,25H,5-10H2,1-4H3/t12-,16-,17+,18-,19+,20+,21-,22+/m0/s1
InChI key： JLOPYNSMWUXMEO-FJKSHLSCSA-N
SMILES： C[C@H]1[C@@H](O)[C@H]2[C@@H](CCC3=CC(=O)CC[C@]23C)[C@@H]2CC[C@H](C(=O)C)[C@@]12C
Systematic name  (3)：
  • 11α-ヒドロキシ-12α-メチルプレグナ-4-エン-3,20-ジオン
  • (1S,3aS,3bS,9aR,9bS,10R,11R,11aR)-1-アセチル-10-ヒドロキシ-9a,11,11a-トリメチル-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-7-オン
  • (1S,3aS,3bS,9aR,9bS,10R,11R,11aR)-1-acetyl-10-hydroxy-9a,11,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (2)：
  • 11α-Hydroxy-12α-methylpregna-4-ene-3,20-dione
  • 11α-Hydroxy-12α-methylpregn-4-ene-3,20-dione
KEGG COMPOUND： C14964
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