Chem
J-GLOBAL ID：200907076609745246   Nikkaji number：J2.622.069F

(2S,4R,5R)-1-(4-Methoxybenzyloxy)-2-(tert-butyldimethylsilyloxy)-4,5-(isopropylidenedioxy)-5-(benzoyloxymethyl)-7-(tert-butyldiphenylsilyloxy)heptane

(2S,4R,5R)-1-(4-メトキシベンジルオキシ)-2-(tert-ブチルジメチルシリルオキシ)-4,5-(イソプロピリデンジオキシ)-5-(ベンゾイルオキシメチル)-7-(tert-ブチルジフェニルシリルオキシ)ヘプタン
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： C48H66O8Si2
Molecular formula furigana： C48-H66-O8-SI2
Molecular weight： 827.218
InChI： InChI=1S/C48H66O8Si2/c1-45(2,3)57(10,11)55-40(35-51-34-37-27-29-39(50-9)30-28-37)33-43-48(56-47(7,8)54-43,36-52-44(49)38-21-15-12-16-22-38)31-32-53-58(46(4,5)6,41-23-17-13-18-24-41)42-25-19-14-20-26-42/h12-30,40,43H,31-36H2,1-11H3/t40-,43+,48+/m0/s1
InChI key： XCGSXGHKHVTBHJ-WZGCEBSNSA-N
SMILES： COc1ccc(COC[C@H](C[C@H]2OC(C)(C)O[C@]2(CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)COC(=O)c2ccccc2)O[Si](C)(C)C(C)(C)C)cc1
Systematic name  (3)：
  • (2S,4R,5R)-1-(4-メトキシベンジルオキシ)-2-(tert-ブチルジメチルシリルオキシ)-4,5-(イソプロピリデンジオキシ)-5-(ベンゾイルオキシメチル)-7-(tert-ブチルジフェニルシリルオキシ)ヘプタン
  • [(4R,5R)-5-[(2S)-2-[(tert-ブチルジメチルシリル)オキシ]-3-[(4-メトキシフェニル)メトキシ]プロピル]-4-{2-[(tert-ブチルジフェニルシリル)オキシ]エチル}-2,2-ジメチル-1,3-ジオキソラン-4-イル]メチル ベンゾアート
  • [(4R,5R)-5-[(2S)-2-[(tert-butyldimethylsilyl)oxy]-3-[(4-methoxyphenyl)methoxy]propyl]-4-{2-[(tert-butyldiphenylsilyl)oxy]ethyl}-2,2-dimethyl-1,3-dioxolan-4-yl]methyl benzoate
Other name (1)：
  • (2S,4R,5R)-1-(4-Methoxybenzyloxy)-2-(tert-butyldimethylsilyloxy)-4,5-(isopropylidenedioxy)-5-(benzoyloxymethyl)-7-(tert-butyldiphenylsilyloxy)heptane
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