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3,4,6-TRI-O-ACETYL-2-O-(2,3,4,6-TETRA-O-BENZOYL-alpha-D-MANNOPYRANOSYL)-alpha-D-MANNOPYRANOSE

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3,4,6-TRI-O-ACETYL-2-O-(2,3,4,6-TETRA-O-BENZOYL-alpha-D-MANNOPYRANOSYL)-alpha-D-MANNOPYRANOSE
SpectraBase Compound ID 1kMhI0Nc8af
InChI InChI=1S/C46H44O18/c1-26(47)55-24-33-35(57-27(2)48)37(58-28(3)49)39(45(54)59-33)64-46-40(63-44(53)32-22-14-7-15-23-32)38(62-43(52)31-20-12-6-13-21-31)36(61-42(51)30-18-10-5-11-19-30)34(60-46)25-56-41(50)29-16-8-4-9-17-29/h4-23,33-40,45-46,54H,24-25H2,1-3H3/t33-,34+,35-,36+,37+,38-,39+,40-,45+,46+/m0/s1
InChIKey NDRHVHBTCRRYEK-OVJUJKSQSA-N
Mol Weight 884.8 g/mol
Molecular Formula C46H44O18
Exact Mass 884.252765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Ai9iy5t5Im
Name 3,4,6-TRI-O-ACETYL-2-O-(2,3,4,6-TETRA-O-BENZOYL-alpha-D-MANNOPYRANOSYL)-alpha-D-MANNOPYRANOSE
Compound Number 28
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C46H44O18/c1-26(47)55-24-33-35(57-27(2)48)37(58-28(3)49)39(45(54)59-33)64-46-40(63-44(53)32-22-14-7-15-23-32)38(62-43(52)31-20-12-6-13-21-31)36(61-42(51)30-18-10-5-11-19-30)34(60-46)25-56-41(50)29-16-8-4-9-17-29/h4-23,33-40,45-46,54H,24-25H2,1-3H3/t33-,34+,35-,36+,37+,38-,39+,40-,45+,46+/m0/s1
InChIKey NDRHVHBTCRRYEK-OVJUJKSQSA-N
Literature Reference A.V.NIKOLAEV,T.J.RUTHERFORD,M.A.J.FERGUSON,J.S.BRIMACOMBE J.CHEM.SOC.PERKIN-1,1977(1995)
Solvent Methanol-d4:Chloroform-d