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OCTYL-2-O-(3,4,6-TRI-O-BENZYL-ALPHA-D-MANNOPYRANOSYL)-3,5-DI-O-BENZYL-ALPHA-D-ARABINOFURANOSIDE
SpectraBase Compound ID L0kAG1kJDoC
InChI InChI=1S/C54H66O10/c1-2-3-4-5-6-22-33-58-54-52(50(60-37-44-29-18-10-19-30-44)47(63-54)40-57-35-42-25-14-8-15-26-42)64-53-48(55)51(61-38-45-31-20-11-21-32-45)49(59-36-43-27-16-9-17-28-43)46(62-53)39-56-34-41-23-12-7-13-24-41/h7-21,23-32,46-55H,2-6,22,33-40H2,1H3/t46-,47+,48+,49-,50+,51-,52-,53-,54-/m1/s1
InChIKey FQUXGSMWIQDDLB-PVBNGYIJSA-N
Mol Weight 875.1 g/mol
Molecular Formula C54H66O10
Exact Mass 874.465598 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AJhpAfkcN02
Name OCTYL-2-O-(3,4,6-TRI-O-BENZYL-ALPHA-D-MANNOPYRANOSYL)-3,5-DI-O-BENZYL-ALPHA-D-ARABINOFURANOSIDE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H66O10
InChI InChI=1S/C54H66O10/c1-2-3-4-5-6-22-33-58-54-52(50(60-37-44-29-18-10-19-30-44)47(63-54)40-57-35-42-25-14-8-15-26-42)64-53-48(55)51(61-38-45-31-20-11-21-32-45)49(59-36-43-27-16-9-17-28-43)46(62-53)39-56-34-41-23-12-7-13-24-41/h7-21,23-32,46-55H,2-6,22,33-40H2,1H3/t46-,47+,48+,49-,50+,51-,52-,53-,54-/m1/s1
InChIKey FQUXGSMWIQDDLB-PVBNGYIJSA-N
Literature Reference Author K.M.RIDGWAY,W.SHI,S.LIN,M.M.PALCIC,T.L.LOWARY
Literature Reference Citation CAN.J.CHEM.,84,642(2006)
Literature Reference DOI 10.1139/v06-049
Molecular Weight 875.112 g/mol
Sample ID 46959
Solvent CDCl3