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3',4',6'-TRI-O-BENZOYL-2'-DEOXY-2'-FLUORO-ALPHA-D-GALACTOPYRANOSYL-(1'->2)-1,6-ANHYDRO-3,4-O-ISOPROPYLIDENE-BETA-D-GALACTOPYRANOSE

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3',4',6'-TRI-O-BENZOYL-2'-DEOXY-2'-FLUORO-ALPHA-D-GALACTOPYRANOSYL-(1'->2)-1,6-ANHYDRO-3,4-O-ISOPROPYLIDENE-BETA-D-GALACTOPYRANOSE
SpectraBase Compound ID BVCfmOl2vrG
InChI InChI=1S/C36H35FO12/c1-36(2)48-29-27(24-19-42-35(44-24)30(29)49-36)47-34-25(37)28(46-33(40)22-16-10-5-11-17-22)26(45-32(39)21-14-8-4-9-15-21)23(43-34)18-41-31(38)20-12-6-3-7-13-20/h3-17,23-30,34-35H,18-19H2,1-2H3/t23-,24+,25-,26+,27-,28-,29+,30-,34-,35+/m1/s1
InChIKey NTCGLVDDMWWBJG-BYOCQQMESA-N
Mol Weight 678.7 g/mol
Molecular Formula C36H35FO12
Exact Mass 678.211255 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eu9mI2wmfqS
Name 3',4',6'-TRI-O-BENZOYL-2'-DEOXY-2'-FLUORO-ALPHA-D-GALACTOPYRANOSYL-(1'->2)-1,6-ANHYDRO-3,4-O-ISOPROPYLIDENE-BETA-D-GALACTOPYRANOSE
Compound Number 25-ALPHA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H35FO12
InChI InChI=1S/C36H35FO12/c1-36(2)48-29-27(24-19-42-35(44-24)30(29)49-36)47-34-25(37)28(46-33(40)22-16-10-5-11-17-22)26(45-32(39)21-14-8-4-9-15-21)23(43-34)18-41-31(38)20-12-6-3-7-13-20/h3-17,23-30,34-35H,18-19H2,1-2H3/t23-,24+,25-,26+,27-,28-,29+,30-,34-,35+/m1/s1
InChIKey NTCGLVDDMWWBJG-BYOCQQMESA-N
Literature Reference Author S.P.VINCENT,M.D.BURKART,C.Y.TSAI,Z.ZHANG,C.H.WONG
Literature Reference Citation J.ORG.CHEM.,64,5264(1999)
Literature Reference DOI 10.1021/jo990686h
Molecular Weight 678.665 g/mol
Sample ID 41215
Solvent CDCl3