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2,3,4-TRI-O-BENZOYL-BETA-D-GALACTOPYRANOSYL-(1->4)-1-O-ACETYL-2,3,6-TRI-O-BENZOYL-ALPHA-D-MANNOPYRANOSE
SpectraBase Compound ID L8uwe9gPa6K
InChI InChI=1S/C56H48O18/c1-34(58)66-55-47(72-53(63)39-28-16-6-17-29-39)46(71-52(62)38-26-14-5-15-27-38)44(42(68-55)33-65-49(59)35-20-8-2-9-21-35)74-56-48(73-54(64)40-30-18-7-19-31-40)45(70-51(61)37-24-12-4-13-25-37)43(41(32-57)67-56)69-50(60)36-22-10-3-11-23-36/h2-31,41-48,55-57H,32-33H2,1H3/t41-,42+,43+,44+,45+,46-,47-,48-,55-,56+/m0/s1
InChIKey WXUCSEMXVZGHCI-ADJOANSNSA-N
Mol Weight 1009.0 g/mol
Molecular Formula C56H48O18
Exact Mass 1008.284065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wtYH8oIYT9
Name 2,3,4-TRI-O-BENZOYL-BETA-D-GALACTOPYRANOSYL-(1->4)-1-O-ACETYL-2,3,6-TRI-O-BENZOYL-ALPHA-D-MANNOPYRANOSE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H48O18
InChI InChI=1S/C56H48O18/c1-34(58)66-55-47(72-53(63)39-28-16-6-17-29-39)46(71-52(62)38-26-14-5-15-27-38)44(42(68-55)33-65-49(59)35-20-8-2-9-21-35)74-56-48(73-54(64)40-30-18-7-19-31-40)45(70-51(61)37-24-12-4-13-25-37)43(41(32-57)67-56)69-50(60)36-22-10-3-11-23-36/h2-31,41-48,55-57H,32-33H2,1H3/t41-,42+,43+,44+,45+,46-,47-,48-,55-,56+/m0/s1
InChIKey WXUCSEMXVZGHCI-ADJOANSNSA-N
Literature Reference Author A.V.NIKOLAEV,T.J.RUTHERFORD,M.A.J.FERGUSON,J.S.BRIMACOMBE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1559(1996)
Literature Reference DOI 10.1039/p19960001559
Molecular Weight 1008.986 g/mol
Solvent CDCl3
Source File Reference UWCS21826