John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=GB9WlT2mKnU SpectraBase Spectrum ID=CvrMPKkjwHi

(accessed ).
TERT.-BUTYL-5-ACETAMIDO-2-C-(ACETOXYMETHYL)-2,6-ANHYDRO-4,7,8,9-TETRA-O-BENZYL-3,5-DIDESOXY-D-ERYTHRO-L-GLUCO-NONONATE
SpectraBase Compound ID GB9WlT2mKnU
InChI InChI=1S/C46H55NO10/c1-33(48)47-41-39(52-28-36-20-12-7-13-21-36)26-46(32-55-34(2)49,44(50)57-45(3,4)5)56-43(41)42(54-30-38-24-16-9-17-25-38)40(53-29-37-22-14-8-15-23-37)31-51-27-35-18-10-6-11-19-35/h6-25,39-43H,26-32H2,1-5H3,(H,47,48)/t39-,40-,41+,42+,43+,46+/m0/s1
InChIKey VQSRLMZFQCIJLS-ULRBLNDRSA-N
Mol Weight 781.9 g/mol
Molecular Formula C46H55NO10
Exact Mass 781.382597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CvrMPKkjwHi
Name TERT.-BUTYL-5-ACETAMIDO-2-C-(ACETOXYMETHYL)-2,6-ANHYDRO-4,7,8,9-TETRA-O-BENZYL-3,5-DIDESOXY-D-ERYTHRO-L-GLUCO-NONONATE
Compound Number 12
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H55NO10
InChI InChI=1S/C46H55NO10/c1-33(48)47-41-39(52-28-36-20-12-7-13-21-36)26-46(32-55-34(2)49,44(50)57-45(3,4)5)56-43(41)42(54-30-38-24-16-9-17-25-38)40(53-29-37-22-14-8-15-23-37)31-51-27-35-18-10-6-11-19-35/h6-25,39-43H,26-32H2,1-5H3,(H,47,48)/t39-,40-,41+,42+,43+,46+/m0/s1
InChIKey VQSRLMZFQCIJLS-ULRBLNDRSA-N
Literature Reference Author K.WALLIMANN,A.VASELLA
Literature Reference Citation HELV.CHIM.ACTA,74,1520(1991)
Literature Reference DOI 10.1002/hlca.19910740716
Molecular Weight 781.943 g/mol
Solvent CDCl3
Source File Reference UWCH35
SpectraBase Batch ID 9KAhTE6z04Q