Chem
J-GLOBAL ID：200907089897488290   Nikkaji number：J1.763.234E

3β-(tert-Butyldimethylsiloxy)-20-(trifluoromethylsulfonyloxy)pregna-5,20-diene

3β-(tert-ブチルジメチルシロキシ)-20-(トリフルオロメチルスルホニルオキシ)プレグナ-5,20-ジエン
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： C28H45F3O4SSi
Molecular formula furigana： C28-H45-F3-O4-S-SI
Molecular weight： 562.800
InChI： InChI=1S/C28H45F3O4SSi/c1-18(34-36(32,33)28(29,30)31)22-11-12-23-21-10-9-19-17-20(35-37(7,8)25(2,3)4)13-15-26(19,5)24(21)14-16-27(22,23)6/h9,20-24H,1,10-17H2,2-8H3/t20-,21-,22+,23-,24-,26-,27+/m0/s1
InChI key： CPTZUVUKUTYATD-HDOFCAKMSA-N
SMILES： CC(C)(C)[Si](C)(C)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@H]4C(=C)OS(=O)(=O)C(F)(F)F)[C@@H]3CC=C2C1
Systematic name  (3)：
  • 3β-(tert-ブチルジメチルシロキシ)-20-(トリフルオロメチルスルホニルオキシ)プレグナ-5,20-ジエン
  • 1-[(1S,3aS,3bS,7S,9aR,9bS,11aS)-7-[(tert-ブチルジメチルシリル)オキシ]-9a,11a-ジメチル-1H,2H,3H,3aH,3bH,4H,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]エテニル トリフルオロメタンスルホナート
  • 1-[(1S,3aS,3bS,7S,9aR,9bS,11aS)-7-[(tert-butyldimethylsilyl)oxy]-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]ethenyl trifluoromethanesulfonate
Other name (1)：
  • 3β-(tert-Butyldimethylsiloxy)-20-(trifluoromethylsulfonyloxy)pregna-5,20-diene
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