Chem
J-GLOBAL ID：201007081063723330   Nikkaji number：J2.793.868J

2α,3α-(Difluoromethylene)-5α-androstan-17β-ol acetate

2α,3α-(ジフルオロメチレン)-5α-アンドロスタン-17β-オールアセタート
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： C22H32F2O2
Molecular formula furigana： C22-H32-F2-O2
Molecular weight： 366.493
InChI： InChI=1S/C22H32F2O2/c1-12(25)26-19-7-6-15-14-5-4-13-10-17-18(22(17,23)24)11-21(13,3)16(14)8-9-20(15,19)2/h13-19H,4-11H2,1-3H3/t13-,14-,15-,16-,17-,18+,19-,20-,21-/m0/s1
InChI key： BRZLCOPFROJRBE-WMFBMNODSA-N
SMILES： CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H]5[C@@H](C[C@]4(C)[C@H]3CC[C@]12C)C5(F)F
Systematic name  (3)：
  • 2α,3α-(ジフルオロメチレン)-5α-アンドロスタン-17β-オールアセタート
  • (1S,2S,4R,6S,8S,11R,12S,15S,16S)-5,5-ジフルオロ-2,16-ジメチルペンタシクロ[9.7.0.02,8.04,6.012,16]オクタデカン-15-イル アセタート
  • (1S,2S,4R,6S,8S,11R,12S,15S,16S)-5,5-difluoro-2,16-dimethylpentacyclo[9.7.0.02,8.04,6.012,16]octadecan-15-yl acetate
Other name (2)：
  • 2α,3α-(Difluoromethylene)-5α-androstane-17β-ol acetate
  • 2α,3α-(Difluoromethylene)-5α-androstan-17β-ol acetate
KEGG COMPOUND： C15322
Thsaurus map：
Thesaurus Map

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