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4,6-DI-O-ACETYL-3-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-MANNOPYRANOSIDE)-2-O-BENZOYL-ALPHA-D-MANNOPYRANOSIDE
SpectraBase Compound ID ASJtzFPVanR
InChI InChI=1S/C31H38O18/c1-14(32)40-12-21-23(42-16(3)34)25(27(30(39)46-21)48-29(38)20-10-8-7-9-11-20)49-31-28(45-19(6)37)26(44-18(5)36)24(43-17(4)35)22(47-31)13-41-15(2)33/h7-11,21-28,30-31,39H,12-13H2,1-6H3/t21-,22-,23-,24-,25+,26+,27+,28+,30+,31-/m1/s1
InChIKey AZBJCVQAGGKKNX-SOCPZHDXSA-N
Mol Weight 698.6 g/mol
Molecular Formula C31H38O18
Exact Mass 698.205814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2jZzfXgpDpN
Name 4,6-DI-O-ACETYL-3-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-MANNOPYRANOSIDE)-2-O-BENZOYL-ALPHA-D-MANNOPYRANOSIDE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H38O18
InChI InChI=1S/C31H38O18/c1-14(32)40-12-21-23(42-16(3)34)25(27(30(39)46-21)48-29(38)20-10-8-7-9-11-20)49-31-28(45-19(6)37)26(44-18(5)36)24(43-17(4)35)22(47-31)13-41-15(2)33/h7-11,21-28,30-31,39H,12-13H2,1-6H3/t21-,22-,23-,24-,25+,26+,27+,28+,30+,31-/m1/s1
InChIKey AZBJCVQAGGKKNX-SOCPZHDXSA-N
Literature Reference Author C.CARPENTER,S.A.NEPOGODIEV
Literature Reference Citation EUR.J.ORG.CHEM.,3286(2005)
Molecular Weight 698.632 g/mol
Sample ID 30061
Solvent D2O