Chem
J-GLOBAL ID:200907003848844720   Nikkaji number:J1.221.428F

3β-(tert-Butyldimethylsiloxy)-17β-[(R)-1-methyl-2-acetoxyethyl]-5α-androsta-16-ene-15-one

3β-(tert-ブチルジメチルシロキシ)-17β-[(R)-1-メチル-2-アセトキシエチル]-5α-アンドロスタ-16-エン-15-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: C30H50O4Si
Molecular formula furigana: C30-H50-O4-SI
Molecular weight: 502.811
InChI: InChI=1S/C30H50O4Si/c1-19(18-33-20(2)31)25-17-26(32)27-23-11-10-21-16-22(34-35(8,9)28(3,4)5)12-14-29(21,6)24(23)13-15-30(25,27)7/h17,19,21-24,27H,10-16,18H2,1-9H3/t19-,21-,22-,23+,24-,27+,29-,30+/m0/s1
InChI key: IMCZZSNJHZQBAQ-XJQGLWJTSA-N
SMILES: C[C@@H](COC(=O)C)C1=CC(=O)[C@H]2[C@@H]3CC[C@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)O[Si](C)(C)C(C)(C)C
Systematic name  (3):
  • 3β-(tert-ブチルジメチルシロキシ)-17β-[(R)-1-メチル-2-アセトキシエチル]-5α-アンドロスタ-16-エン-15-オン
  • (2R)-2-[(3aS,3bR,5aS,7S,9aS,9bS,11aS)-7-[(tert-ブチルジメチルシリル)オキシ]-9a,11a-ジメチル-3-オキソ-3H,3aH,3bH,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1-イル]プロピル アセタート
  • (2R)-2-[(3aS,3bR,5aS,7S,9aS,9bS,11aS)-7-[(tert-butyldimethylsilyl)oxy]-9a,11a-dimethyl-3-oxo-3H,3aH,3bH,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]propyl acetate
Other name (1):
  • 3β-(tert-Butyldimethylsiloxy)-17β-[(R)-1-methyl-2-acetoxyethyl]-5α-androsta-16-ene-15-one
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