Chem
J-GLOBAL ID:200907050019279445   Nikkaji number:J2.692.701C

(2S,4S,5R)-2-[4-(4-Methoxybenzyloxy)butyl]-4,5-dimethyl-6-(benzyloxy)hexanoic acid (R,E)-4-(tert-butyldiphenylsiloxy)-1-methyl-2-butenyl ester

(2S,4S,5R)-2-[4-(4-メトキシベンジルオキシ)ブチル]-4,5-ジメチル-6-(ベンジルオキシ)ヘキサン酸(R,E)-4-(tert-ブチルジフェニルシロキシ)-1-メチル-2-ブテニル
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: C48H64O6Si
Molecular formula furigana: C48-H64-O6-SI
Molecular weight: 765.119
InChI: InChI=1S/C48H64O6Si/c1-38(39(2)35-52-37-41-21-11-8-12-22-41)34-43(23-17-18-32-51-36-42-28-30-44(50-7)31-29-42)47(49)54-40(3)20-19-33-53-55(48(4,5)6,45-24-13-9-14-25-45)46-26-15-10-16-27-46/h8-16,19-22,24-31,38-40,43H,17-18,23,32-37H2,1-7H3/b20-19+/t38-,39-,40+,43-/m0/s1
InChI key: KLOUTOMVEWFSHM-CVWASMPRSA-N
SMILES: COc1ccc(COCCCC[C@@H](C[C@H](C)[C@@H](C)COCc2ccccc2)C(=O)O[C@H](C)/C=C/CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)cc1
Systematic name  (3):
  • (2S,4S,5R)-2-[4-(4-メトキシベンジルオキシ)ブチル]-4,5-ジメチル-6-(ベンジルオキシ)ヘキサン酸(R,E)-4-(tert-ブチルジフェニルシロキシ)-1-メチル-2-ブテニル
  • (2R,3E)-5-[(tert-ブチルジフェニルシリル)オキシ]ペンタ-3-エン-2-イル (2S,4S,5R)-6-(ベンジルオキシ)-2-{4-[(4-メトキシフェニル)メトキシ]ブチル}-4,5-ジメチルヘキサノアート
  • (2R,3E)-5-[(tert-butyldiphenylsilyl)oxy]pent-3-en-2-yl (2S,4S,5R)-6-(benzyloxy)-2-{4-[(4-methoxyphenyl)methoxy]butyl}-4,5-dimethylhexanoate
Other name (1):
  • (2S,4S,5R)-2-[4-(4-Methoxybenzyloxy)butyl]-4,5-dimethyl-6-(benzyloxy)hexanoic acid (R,E)-4-(tert-butyldiphenylsiloxy)-1-methyl-2-butenyl ester
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