Chem
J-GLOBAL ID:200907002516077134   Nikkaji number:J1.879.488H

(2S,4aβ,8aα,9aα,10aβ)-2β-(Trifluoromethylsulfonyloxymethyl)-3α-(triethylsiloxy)-6α-(benzyloxy)-7β-[2-(benzyloxy)ethyl]-7-methyldecahydro-2H-1,8,10-trioxaanthracene

(2S,4aβ,8aα,9aα,10aβ)-2β-(トリフルオロメチルスルホニルオキシメチル)-3α-(トリエチルシロキシ)-6α-(ベンジルオキシ)-7β-[2-(ベンジルオキシ)エチル]-7-メチルデカヒドロ-2H-1,8,10-トリオキサアントラセン
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: C36H51F3O9SSi
Molecular formula furigana: C36-H51-F3-O9-S-SI
Molecular weight: 744.940
InChI: InChI=1S/C36H51F3O9SSi/c1-5-50(6-2,7-3)48-32-21-29-28(46-33(32)25-44-49(40,41)36(37,38)39)20-31-30(45-29)22-34(43-24-27-16-12-9-13-17-27)35(4,47-31)18-19-42-23-26-14-10-8-11-15-26/h8-17,28-34H,5-7,18-25H2,1-4H3/t28-,29+,30-,31+,32-,33+,34+,35-/m1/s1
InChI key: DJPWUJUEUBHKRE-RZDCRZJSSA-N
SMILES: CC[Si](CC)(CC)O[C@@H]1C[C@@H]2O[C@@H]3C[C@H](OCc4ccccc4)[C@@](C)(CCOCc4ccccc4)O[C@H]3C[C@H]2O[C@H]1COS(=O)(=O)C(F)(F)F
Systematic name  (3):
  • (2S,4aβ,8aα,9aα,10aβ)-2β-(トリフルオロメチルスルホニルオキシメチル)-3α-(トリエチルシロキシ)-6α-(ベンジルオキシ)-7β-[2-(ベンジルオキシ)エチル]-7-メチルデカヒドロ-2H-1,8,10-トリオキサアントラセン
  • [(1R,3S,5R,6S,8R,10S,12R,13S)-13-(ベンジルオキシ)-12-[2-(ベンジルオキシ)エチル]-12-メチル-5-[(トリエチルシリル)オキシ]-2,7,11-トリオキサトリシクロ[8.4.0.03,8]テトラデカン-6-イル]メチル トリフルオロメタンスルホナート
  • [(1R,3S,5R,6S,8R,10S,12R,13S)-13-(benzyloxy)-12-[2-(benzyloxy)ethyl]-12-methyl-5-[(triethylsilyl)oxy]-2,7,11-trioxatricyclo[8.4.0.03,8]tetradecan-6-yl]methyl trifluoromethanesulfonate
Other name (1):
  • (2S,4aβ,8aα,9aα,10aβ)-2β-(Trifluoromethylsulfonyloxymethyl)-3α-(triethylsiloxy)-6α-(benzyloxy)-7β-[2-(benzyloxy)ethyl]-7-methyldecahydro-2H-1,8,10-trioxaanthracene
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