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(3S,4R,5R,6S,7S)-3-Acetoxy-4-[(benzyloxy)carbonyl]amino]-1,8-bis[(tert-butyldimethylsilyl)oxy]-6,7-(isopropylidenedioxy)-5-(methoxymethoxy)octane
SpectraBase Compound ID LW4UENNuMbt
InChI InChI=1S/C35H63NO10Si2/c1-25(37)44-27(20-21-42-47(11,12)33(2,3)4)29(36-32(38)40-22-26-18-16-15-17-19-26)31(41-24-39-10)30-28(45-35(8,9)46-30)23-43-48(13,14)34(5,6)7/h15-19,27-31H,20-24H2,1-14H3,(H,36,38)/t27-,28-,29-,30+,31+/m0/s1
InChIKey QDHWSCFNJLNABA-DYFQPDDQSA-N
Mol Weight 714.1 g/mol
Molecular Formula C35H63NO10Si2
Exact Mass 713.39905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cz4TNykm0tQ
Name (3S,4R,5R,6S,7S)-3-Acetoxy-4-[(benzyloxy)carbonyl]amino]-1,8-bis[(tert-butyldimethylsilyl)oxy]-6,7-(isopropylidenedioxy)-5-(methoxymethoxy)octane
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Formula C35H63NO10Si2
InChI InChI=1S/C35H63NO10Si2/c1-25(37)44-27(20-21-42-47(11,12)33(2,3)4)29(36-32(38)40-22-26-18-16-15-17-19-26)31(41-24-39-10)30-28(45-35(8,9)46-30)23-43-48(13,14)34(5,6)7/h15-19,27-31H,20-24H2,1-14H3,(H,36,38)/t27-,28-,29-,30+,31+/m0/s1
InChIKey QDHWSCFNJLNABA-DYFQPDDQSA-N
Molecular Weight 714.056 g/mol
SMILES N([C@]([C@]([C@]1([C@@](OC(O1)(C)C)(CO[Si](C(C)(C)C)(C)C)[H])[H])(OCOC)[H])([C@@](OC(=O)C)(CCO[Si](C(C)(C)C)(C)C)[H])[H])C(=O)OCc1ccccc1
SPLASH splash10-014l-0907102000-309f0d0216c6f1991ffe
Source of Spectrum J-58-61-33
Synonyms 3-O-acetyl-4-{[(benzyloxy)carbonyl]amino}-1,8-bis-O-[tert-butyl(dimethyl)silyl]-2,4-dideoxy-5-O-(methoxymethyl)-6,7-O-(1-methylethylidene)-L-glycero-D-gulo-octitol
Wiley ID 1415437