Chem
J-GLOBAL ID:200907067245161996   Nikkaji number:J2.508.879D

Halobetasolpropionate

ハロベタソールプロピオナート
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: C25H31ClF2O5
Molecular formula furigana: C25-H31-CL-F2-O5
Molecular weight: 484.960
InChI: InChI=1S/C25H31ClF2O5/c1-5-21(32)33-25(20(31)12-26)13(2)8-15-16-10-18(27)17-9-14(29)6-7-22(17,3)24(16,28)19(30)11-23(15,25)4/h6-7,9,13,15-16,18-19,30H,5,8,10-12H2,1-4H3/t13-,15-,16-,18-,19-,22-,23-,24-,25-/m0/s1
InChI key: BDSYKGHYMJNPAB-LICBFIPMSA-N
SMILES: CCC(=O)O[C@@]1([C@@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C(=O)CCl
Systematic name  (3):
  • 6α,9α-ジフルオロ-16β-メチル-21-クロロ-3,20-ジオキソプレグナ-1,4-ジエン-11β,17α-ジオール17-プロピオナート
  • (1R,2S,3aS,3bS,5S,9aS,9bR,10S,11aS)-1-(2-クロロアセチル)-5,9b-ジフルオロ-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 プロパノアート
  • (1R,2S,3aS,3bS,5S,9aS,9bR,10S,11aS)-1-(2-chloroacetyl)-5,9b-difluoro-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 propanoate
Other name (3):
  • 6α,9α-Difluoro-16β-methyl-21-chloro-3,20-dioxopregna-1,4-diene-11β,17α-diol 17-propionate
  • ハロベタソールプロピオナート
  • Halobetasolpropionate
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