John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=LCwHfelNtbj SpectraBase Spectrum ID=2IdL9DkIqN2

(accessed ).
METHYL_(PENTAFLUOROBENZYL_5-ACETAMIDO-4,7,8-TRI-O-ACETYL-9-AZIDO-3,5,9-TRIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE
SpectraBase Compound ID LCwHfelNtbj
InChI InChI=1S/C25H27F5N4O11/c1-9(35)33-21-14(42-10(2)36)6-25(24(39)40-5,41-8-13-16(26)18(28)20(30)19(29)17(13)27)45-23(21)22(44-12(4)38)15(7-32-34-31)43-11(3)37/h14-15,21-23H,6-8H2,1-5H3,(H,33,35)/t14-,15+,21+,22-,23+,25+/m0/s1
InChIKey MABNUZYRFIWIDC-RYIKUENQSA-N
Mol Weight 654.5 g/mol
Molecular Formula C25H27F5N4O11
Exact Mass 654.159649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2IdL9DkIqN2
Name METHYL_(PENTAFLUOROBENZYL_5-ACETAMIDO-4,7,8-TRI-O-ACETYL-9-AZIDO-3,5,9-TRIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE
Compound Number 11C
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H27F5N4O11
InChI InChI=1S/C25H27F5N4O11/c1-9(35)33-21-14(42-10(2)36)6-25(24(39)40-5,41-8-13-16(26)18(28)20(30)19(29)17(13)27)45-23(21)22(44-12(4)38)15(7-32-34-31)43-11(3)37/h14-15,21-23H,6-8H2,1-5H3,(H,33,35)/t14-,15+,21+,22-,23+,25+/m0/s1
InChIKey MABNUZYRFIWIDC-RYIKUENQSA-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 654.502 g/mol
Solvent CDCl3
Source File Reference UWMZ46752
SpectraBase Batch ID JnCVMkfD6ja