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3-O-BENZYL-2-O-(2',3',4',6'-TETRA-O-BENZYL-BETA-D-GLUCOPYRANOSYL)-L-GLYCERALDEHYDE-1,1-DIETHYL-ACETAL
SpectraBase Compound ID G8qxyyJ5YJx
InChI InChI=1S/C50H60O9/c1-3-30-53-49(54-31-4-2)45(38-52-33-40-22-12-6-13-23-40)59-50-48(57-36-43-28-18-9-19-29-43)47(56-35-42-26-16-8-17-27-42)46(55-34-41-24-14-7-15-25-41)44(58-50)37-51-32-39-20-10-5-11-21-39/h5-29,44-50H,3-4,30-38H2,1-2H3/t44-,45-,46-,47+,48-,50+/m1/s1
InChIKey QVRQASQGKMKHPB-MDJOEOQOSA-N
Mol Weight 805.0 g/mol
Molecular Formula C50H60O9
Exact Mass 804.423734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1cexMsL6Bqf
Name 3-O-BENZYL-2-O-(2',3',4',6'-TETRA-O-BENZYL-BETA-D-GLUCOPYRANOSYL)-L-GLYCERALDEHYDE-1,1-DIETHYL-ACETAL
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H60O9
InChI InChI=1S/C50H60O9/c1-3-30-53-49(54-31-4-2)45(38-52-33-40-22-12-6-13-23-40)59-50-48(57-36-43-28-18-9-19-29-43)47(56-35-42-26-16-8-17-27-42)46(55-34-41-24-14-7-15-25-41)44(58-50)37-51-32-39-20-10-5-11-21-39/h5-29,44-50H,3-4,30-38H2,1-2H3/t44-,45-,46-,47+,48-,50+/m1/s1
InChIKey QVRQASQGKMKHPB-MDJOEOQOSA-N
Literature Reference Author M.KANEDA
Literature Reference Citation PHYTOCHEM.,29,3559(1990)
Literature Reference DOI 10.1016/0031-9422(90)85276-L
Molecular Weight 805.021 g/mol
Solvent CDCl3
Source File Reference UWLU26861