Chem
J-GLOBAL ID：200907085734661940   Nikkaji number：J7.644I

HMS

メドリソン
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/c1-12-9-15-17-6-5-16(13(2)23)22(17,4)11-19(25)20(15)21(3)8-7-14(24)10-18(12)21/h10,12,15-17,19-20,25H,5-9,11H2,1-4H3/t12-,15-,16+,17-,19-,20+,21-,22+/m0/s1
InChI key： GZENKSODFLBBHQ-ILSZZQPISA-N
SMILES： C[C@H]1C[C@H]2[C@@H]3CC[C@H](C(=O)C)[C@@]3(C)C[C@H](O)[C@@H]2[C@@]2(C)CCC(=O)C=C12
Systematic name  (4)：
  • 6α-メチル-11β-ヒドロキシプロゲステロン
  • 11β-ヒドロキシ-6α-メチルプレグナ-4-エン-3,20-ジオン
  • (1S,3aS,3bS,5S,9aR,9bS,10S,11aS)-1-アセチル-10-ヒドロキシ-5,9a,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,5S,9aR,9bS,10S,11aS)-1-acetyl-10-hydroxy-5,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (7)：
  • メドリソン
  • U-8471
  • Medrysone
  • NSC-63278
  • HMS
Show all
CAS registry number： 2668-66-8
Regulation number (2)：
  • TU5250000
  • EINECS2202087
KEGG DRUG： D02289
KEGG COMPOUND： C14643
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