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

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3',4',6'-TRI-O-BENZOYL-2'-DEOXY-2'-FLUORO-BETA-D-GLUCOPYRANOSYL-(1'->6)-1,2:3,4-DI-O-ISOPROPYLIDENE-ALPHA-D-GALACTOPYRANOSE
SpectraBase Compound ID BIv95jFChVn
InChI InChI=1S/C39H41FO13/c1-38(2)50-29-26(47-37-32(31(29)51-38)52-39(3,4)53-37)21-45-36-27(40)30(49-35(43)24-18-12-7-13-19-24)28(48-34(42)23-16-10-6-11-17-23)25(46-36)20-44-33(41)22-14-8-5-9-15-22/h5-19,25-32,36-37H,20-21H2,1-4H3/t25-,26+,27-,28-,29-,30-,31-,32+,36-,37+/m1/s1
InChIKey WBIMXRRGOUOMNJ-UHMWAPTBSA-N
Mol Weight 736.7 g/mol
Molecular Formula C39H41FO13
Exact Mass 736.25312 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7tri5i5ozhc
Name 3',4',6'-TRI-O-BENZOYL-2'-DEOXY-2'-FLUORO-BETA-D-GLUCOPYRANOSYL-(1'->6)-1,2:3,4-DI-O-ISOPROPYLIDENE-ALPHA-D-GALACTOPYRANOSE
Compound Number 18-GLUCO-BETA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H41FO13
InChI InChI=1S/C39H41FO13/c1-38(2)50-29-26(47-37-32(31(29)51-38)52-39(3,4)53-37)21-45-36-27(40)30(49-35(43)24-18-12-7-13-19-24)28(48-34(42)23-16-10-6-11-17-23)25(46-36)20-44-33(41)22-14-8-5-9-15-22/h5-19,25-32,36-37H,20-21H2,1-4H3/t25-,26+,27-,28-,29-,30-,31-,32+,36-,37+/m1/s1
InChIKey WBIMXRRGOUOMNJ-UHMWAPTBSA-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 736.745 g/mol
Sample ID 41214
Solvent CDCl3