Chem
J-GLOBAL ID:200907068936809751   Nikkaji number:J2.077.867I

(3S)-3β-[1-(Methoxymethoxymethyl)-1-(2-hydroxybenzylaminomethyl)-2-(methoxymethoxy)ethyl]-4β-(tert-butyldimethylsiloxy)cyclohexanone

(3S)-3β-[1-(メトキシメトキシメチル)-1-(2-ヒドロキシベンジルアミノメチル)-2-(メトキシメトキシ)エチル]-4β-(tert-ブチルジメチルシロキシ)シクロヘキサノン
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: C27H47NO7Si
Molecular formula furigana: C27-H47-N-O7-SI
Molecular weight: 525.758
InChI: InChI=1S/C27H47NO7Si/c1-26(2,3)36(6,7)35-25-13-12-22(29)14-23(25)27(17-33-19-31-4,18-34-20-32-5)16-28-15-21-10-8-9-11-24(21)30/h8-11,23,25,28,30H,12-20H2,1-7H3/t23-,25+/m1/s1
InChI key: BWBRAHJWXGUIAI-NOZRDPDXSA-N
SMILES: COCOCC(CNCc1ccccc1O)(COCOC)[C@@H]1CC(=O)CC[C@@H]1O[Si](C)(C)C(C)(C)C
Systematic name  (3):
  • (3S)-3β-[1-(メトキシメトキシメチル)-1-(2-ヒドロキシベンジルアミノメチル)-2-(メトキシメトキシ)エチル]-4β-(tert-ブチルジメチルシロキシ)シクロヘキサノン
  • (3S,4S)-4-[(tert-ブチルジメチルシリル)オキシ]-3-[6-({[(2-ヒドロキシフェニル)メチル]アミノ}メチル)-2,4,8,10-テトラオキサウンデカン-6-イル]シクロヘキサン-1-オン
  • (3S,4S)-4-[(tert-butyldimethylsilyl)oxy]-3-[6-({[(2-hydroxyphenyl)methyl]amino}methyl)-2,4,8,10-tetraoxaundecan-6-yl]cyclohexan-1-one
Other name (1):
  • (3S)-3β-[1-(Methoxymethoxymethyl)-1-(2-hydroxybenzylaminomethyl)-2-(methoxymethoxy)ethyl]-4β-(tert-butyldimethylsiloxy)cyclohexanone
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