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METHYL_((2,3-DIFLUOROBENZYL)-5-CYCLOPROPYLAMIDO-4,7,8-TRI-O-ACETYL-9-(4-CHLOROBENZAMIDO)-3,5,9-TRIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULO

View entire compound with spectra: 1 NMR

METHYL_((2,3-DIFLUOROBENZYL)-5-CYCLOPROPYLAMIDO-4,7,8-TRI-O-ACETYL-9-(4-CHLOROBENZAMIDO)-3,5,9-TRIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULO
SpectraBase Compound ID AhitkRYif3y
InChI InChI=1S/C34H37ClF2N2O12/c1-17(40)48-25-14-34(33(45)46-4,47-16-22-6-5-7-24(36)27(22)37)51-30(28(25)39-32(44)21-8-9-21)29(50-19(3)42)26(49-18(2)41)15-38-31(43)20-10-12-23(35)13-11-20/h5-7,10-13,21,25-26,28-30H,8-9,14-16H2,1-4H3,(H,38,43)(H,39,44)/t25-,26+,28+,29-,30+,34+/m0/s1
InChIKey PALAHTJTZCYQSS-HQKDJQSFSA-N
Mol Weight 739.1 g/mol
Molecular Formula C34H37ClF2N2O12
Exact Mass 738.200309 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E71cLTZuBCf
Name METHYL_((2,3-DIFLUOROBENZYL)-5-CYCLOPROPYLAMIDO-4,7,8-TRI-O-ACETYL-9-(4-CHLOROBENZAMIDO)-3,5,9-TRIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULO
Compound Number 23F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H37ClF2N2O12
InChI InChI=1S/C34H37ClF2N2O12/c1-17(40)48-25-14-34(33(45)46-4,47-16-22-6-5-7-24(36)27(22)37)51-30(28(25)39-32(44)21-8-9-21)29(50-19(3)42)26(49-18(2)41)15-38-31(43)20-10-12-23(35)13-11-20/h5-7,10-13,21,25-26,28-30H,8-9,14-16H2,1-4H3,(H,38,43)(H,39,44)/t25-,26+,28+,29-,30+,34+/m0/s1
InChIKey PALAHTJTZCYQSS-HQKDJQSFSA-N
Literature Reference Author S.MESCH,D.MOSER,D.S.STRASSER,A.KELM,B.CUTTING,G.ROSSATO,A.VE DANI,H.KOLIWER-BRAND
Literature Reference Citation J.MED.CHEM.,53,1597(2010)
Literature Reference DOI 10.1021/jm901517k
Molecular Weight 739.124 g/mol
Solvent CDCl3
Source File Reference UWMZ46793