Chem
J-GLOBAL ID:200907079668132583   Nikkaji number:J3.157G

Alphaxalone

アルファキサロン
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: C21H32O3
Molecular formula furigana: C21-H32-O3
Molecular weight: 332.484
InChI: InChI=1S/C21H32O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h13-17,19,23H,4-11H2,1-3H3/t13-,14+,15-,16+,17-,19+,20-,21+/m0/s1
InChI key: DUHUCHOQIDJXAT-OLVMNOGESA-N
SMILES: CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C(=O)C[C@]12C
Systematic name  (3):
  • 3α-ヒドロキシ-5α-プレグナン-11,20-ジオン
  • (1S,3aS,3bS,5aS,7R,9aS,9bS,11aS)-1-アセチル-7-ヒドロキシ-9a,11a-ジメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-10-オン
  • (1S,3aS,3bS,5aS,7R,9aS,9bS,11aS)-1-acetyl-7-hydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-10-one
Other name (9):
  • アルファキサロン
  • GR 2/234
  • Alfaxalone
  • Alphaxalone
  • 3α-Hydroxy-5α-pregnane-11,12-dione
Show all
CAS registry number: 23930-19-0
Regulation number (2):
  • 7-(1)-199
  • TU4157190
KEGG DRUG: D07282
KEGG COMPOUND: C13803
Application (1):
anesthetic
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