Chem
J-GLOBAL ID:200907025591567015   Nikkaji number:J1.879.487J

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

(2S,4aβ,8aα,9aα,10aβ)-2β-(tert-ブチルジフェニルシロキシメチル)-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-3-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: C45H54O7Si
Molecular formula furigana: C45-H54-O7-SI
Molecular weight: 735.005
InChI: InChI=1S/C45H54O7Si/c1-44(2,3)53(35-21-13-7-14-22-35,36-23-15-8-16-24-36)49-32-42-37(46)27-38-39(51-42)28-41-40(50-38)29-43(48-31-34-19-11-6-12-20-34)45(4,52-41)25-26-47-30-33-17-9-5-10-18-33/h5-24,38-43H,25-32H2,1-4H3/t38-,39+,40+,41-,42-,43-,45+/m0/s1
InChI key: AWLZNPKJHZFPBM-GXRADCCYSA-N
SMILES: CC(C)(C)[Si](OC[C@@H]1O[C@@H]2C[C@@H]3O[C@](C)(CCOCc4ccccc4)[C@H](C[C@H]3O[C@H]2CC1=O)OCc1ccccc1)(c1ccccc1)c1ccccc1
Systematic name  (3):
  • (2S,4aβ,8aα,9aα,10aβ)-2β-(tert-ブチルジフェニルシロキシメチル)-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-3-オン
  • (1R,3S,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]-6-{[(tert-ブチルジフェニルシリル)オキシ]メチル}-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-オン
  • (1R,3S,6S,8R,10S,12R,13S)-13-(benzyloxy)-12-[2-(benzyloxy)ethyl]-6-{[(tert-butyldiphenylsilyl)oxy]methyl}-12-methyl-2,7,11-trioxatricyclo[8.4.0.03,8]tetradecan-5-one
Other name (1):
  • (2S,4aβ,8aα,9aα,10aβ)-2β-(tert-Butyldiphenylsiloxymethyl)-6α-(benzyloxy)-7β-[2-(benzyloxy)ethyl]-7-methyldecahydro-2H-1,8,10-trioxaanthracene-3-one
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