Chem
J-GLOBAL ID：200907008508035021   Nikkaji number：J1.175.751K

(2R)-2α-(Benzyloxymethyl)-3β-(benzyloxy)-6β-(trimethylsiloxy)-6-methyl-7α-(cyanomethyl)oxepane

(2R)-2α-(ベンジルオキシメチル)-3β-(ベンジルオキシ)-6β-(トリメチルシロキシ)-6-メチル-7α-(シアノメチル)オキセパン
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： C27H37NO4Si
Molecular formula furigana： C27-H37-N-O4-SI
Molecular weight： 467.681
InChI： InChI=1S/C27H37NO4Si/c1-27(32-33(2,3)4)17-15-24(30-20-23-13-9-6-10-14-23)25(31-26(27)16-18-28)21-29-19-22-11-7-5-8-12-22/h5-14,24-26H,15-17,19-21H2,1-4H3/t24-,25+,26-,27+/m0/s1
InChI key： QTDWUSIONNXOLG-YYGZZXRFSA-N
SMILES： C[C@]1(CC[C@H](OCc2ccccc2)[C@@H](COCc2ccccc2)O[C@H]1CC#N)O[Si](C)(C)C
Systematic name  (3)：
  • (2R)-2α-(ベンジルオキシメチル)-3β-(ベンジルオキシ)-6β-(トリメチルシロキシ)-6-メチル-7α-(シアノメチル)オキセパン
  • 2-[(2S,3R,6S,7R)-6-(ベンジルオキシ)-7-[(ベンジルオキシ)メチル]-3-メチル-3-[(トリメチルシリル)オキシ]オキセパン-2-イル]アセトニトリル
  • 2-[(2S,3R,6S,7R)-6-(benzyloxy)-7-[(benzyloxy)methyl]-3-methyl-3-[(trimethylsilyl)oxy]oxepan-2-yl]acetonitrile
Other name (1)：
  • (2R)-2α-(Benzyloxymethyl)-3β-(benzyloxy)-6β-(trimethylsiloxy)-6-methyl-7α-(cyanomethyl)oxepane
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