Chem
J-GLOBAL ID:200907016609837580   Nikkaji number:J756.118K

(2S,3S,4S,5R)-2-(tert-Butyldimethylsiloxy)-3,5-dimethyl-4-methoxy-6-(phenylthio)hexanal

(2S,3S,4S,5R)-2-(tert-ブチルジメチルシロキシ)-3,5-ジメチル-4-メトキシ-6-(フェニルチオ)ヘキサナール
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: C21H36O3SSi
Molecular formula furigana: C21-H36-O3-S-SI
Molecular weight: 396.660
InChI: InChI=1S/C21H36O3SSi/c1-16(15-25-18-12-10-9-11-13-18)20(23-6)17(2)19(14-22)24-26(7,8)21(3,4)5/h9-14,16-17,19-20H,15H2,1-8H3/t16-,17+,19+,20+/m0/s1
InChI key: WMVOJGGDEIDQSU-ONCXSQPRSA-N
SMILES: CO[C@H]([C@@H](C)CSc1ccccc1)[C@H](C)[C@H](O[Si](C)(C)C(C)(C)C)C=O
Systematic name  (3):
  • (2S,3S,4S,5R)-2-(tert-ブチルジメチルシロキシ)-3,5-ジメチル-4-メトキシ-6-(フェニルチオ)ヘキサナール
  • (2S,3S,4S,5R)-2-[(tert-ブチルジメチルシリル)オキシ]-4-メトキシ-3,5-ジメチル-6-(フェニルスルファニル)ヘキサナール
  • (2S,3S,4S,5R)-2-[(tert-butyldimethylsilyl)oxy]-4-methoxy-3,5-dimethyl-6-(phenylsulfanyl)hexanal
Other name (1):
  • (2S,3S,4S,5R)-2-(tert-Butyldimethylsiloxy)-3,5-dimethyl-4-methoxy-6-(phenylthio)hexanal
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