Chem
J-GLOBAL ID:200907008507701940   Nikkaji number:J1.879.489F

(2S,4aβ,8aα,9aα,10aβ)-2β-[[(2S)-2-(Phenylsulfonyl)-3β-(tert-butyldiphenylsiloxymethyl)oxirane-2α-yl]methyl]-3α-(triethylsiloxy)-6α-(benzyloxy)-7β-[2-(benzyloxy)ethyl]-7-methyldecahydro-2H-1,8,10-trioxaanthracene

(2S,4aβ,8aα,9aα,10aβ)-2β-[[(2S)-2-(フェニルスルホニル)-3β-(tert-ブチルジフェニルシロキシメチル)オキシラン-2α-イル]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: C60H78O10SSi2
Molecular formula furigana: C60-H78-O10-S-SI2
Molecular weight: 1047.500
InChI: InChI=1S/C60H78O10SSi2/c1-8-72(9-2,10-3)70-54-39-51-50(38-53-52(66-51)40-56(64-43-46-28-18-12-19-29-46)59(7,68-53)36-37-63-42-45-26-16-11-17-27-45)67-55(54)41-60(71(61,62)47-30-20-13-21-31-47)57(69-60)44-65-73(58(4,5)6,48-32-22-14-23-33-48)49-34-24-15-25-35-49/h11-35,50-57H,8-10,36-44H2,1-7H3/t50-,51+,52-,53+,54-,55+,56+,57-,59-,60+/m1/s1
InChI key: ZOSZILOFJWOWHK-HANFAUGFSA-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]1C[C@]1(O[C@@H]1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)S(=O)(=O)c1ccccc1
Systematic name  (3):
  • (2S,4aβ,8aα,9aα,10aβ)-2β-[[(2S)-2-(フェニルスルホニル)-3β-(tert-ブチルジフェニルシロキシメチル)オキシラン-2α-イル]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)-6-{[(2S,3R)-2-(ベンゼンスルホニル)-3-{[(tert-ブチルジフェニルシリル)オキシ]メチル}オキシラン-2-イル]メチル}-13-(ベンジルオキシ)-12-[2-(ベンジルオキシ)エチル]-12-メチル-2,7,11-トリオキサトリシクロ[8.4.0.03,8]テトラデカン-5-イル]オキシ}トリエチルシラン
  • {[(1R,3S,5R,6S,8R,10S,12R,13S)-6-{[(2S,3R)-2-(benzenesulfonyl)-3-{[(tert-butyldiphenylsilyl)oxy]methyl}oxiran-2-yl]methyl}-13-(benzyloxy)-12-[2-(benzyloxy)ethyl]-12-methyl-2,7,11-trioxatricyclo[8.4.0.03,8]tetradecan-5-yl]oxy}triethylsilane
Other name (1):
  • (2S,4aβ,8aα,9aα,10aβ)-2β-[[(2S)-2-(Phenylsulfonyl)-3β-(tert-butyldiphenylsiloxymethyl)oxirane-2α-yl]methyl]-3α-(triethylsiloxy)-6α-(benzyloxy)-7β-[2-(benzyloxy)ethyl]-7-methyldecahydro-2H-1,8,10-trioxaanthracene
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