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METHYL-4,6-O-BENZYLIDENE-2-O-(2,3,4,6-TETRA-O-BENZYL-BETA-D-GLUCOPYRANOSYL)-3-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-ALPHA-D-ALTROPYRANOSE
SpectraBase Compound ID KNolyyDGj7b
InChI InChI=1S/C82H86O16/c1-83-80-78(98-82-77(91-54-65-43-25-9-26-44-65)74(89-52-63-39-21-7-22-40-63)71(87-50-61-35-17-5-18-36-61)68(95-82)56-85-48-59-31-13-3-14-32-59)75(72-69(93-80)57-92-79(96-72)66-45-27-10-28-46-66)97-81-76(90-53-64-41-23-8-24-42-64)73(88-51-62-37-19-6-20-38-62)70(86-49-60-33-15-4-16-34-60)67(94-81)55-84-47-58-29-11-2-12-30-58/h2-46,67-82H,47-57H2,1H3/t67-,68+,69+,70-,71+,72+,73+,74-,75+,76-,77+,78-,79+,80-,81-,82-/m0/s1
InChIKey CLFJBANBXQNOOG-PQCRTVDYSA-N
Mol Weight 1327.6 g/mol
Molecular Formula C82H86O16
Exact Mass 1326.591587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JNRvdJmXRlQ
Name METHYL-4,6-O-BENZYLIDENE-2-O-(2,3,4,6-TETRA-O-BENZYL-BETA-D-GLUCOPYRANOSYL)-3-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-GLUCOPYRANOSYL)-ALPHA-D-ALTROPYRANOSE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C82H86O16
InChI InChI=1S/C82H86O16/c1-83-80-78(98-82-77(91-54-65-43-25-9-26-44-65)74(89-52-63-39-21-7-22-40-63)71(87-50-61-35-17-5-18-36-61)68(95-82)56-85-48-59-31-13-3-14-32-59)75(72-69(93-80)57-92-79(96-72)66-45-27-10-28-46-66)97-81-76(90-53-64-41-23-8-24-42-64)73(88-51-62-37-19-6-20-38-62)70(86-49-60-33-15-4-16-34-60)67(94-81)55-84-47-58-29-11-2-12-30-58/h2-46,67-82H,47-57H2,1H3/t67-,68+,69+,70-,71+,72+,73+,74-,75+,76-,77+,78-,79+,80-,81-,82-/m0/s1
InChIKey CLFJBANBXQNOOG-PQCRTVDYSA-N
Literature Reference Author E.BOZO,A.VASELLA
Literature Reference Citation HELV.CHIM.ACTA,75,2613(1992)
Literature Reference DOI 10.1002/hlca.19920750816
Molecular Weight 1327.575 g/mol
Solvent CDCl3
Source File Reference UWCS8846