John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=CQSwjBqyArq SpectraBase Spectrum ID=J2QUftaGQ5x

(accessed ).
TERT.-BUTYL-5-ACETAMIDO-2,6-ANHYDRO-4,7,8,9-TETRA-O-BENZYL-3,5-DIDESOXY-2-C-(HYDROXYMETHYL)-D-ERYTHRO-L-GLUCO-NONONATE
SpectraBase Compound ID CQSwjBqyArq
InChI InChI=1S/C44H53NO9/c1-32(47)45-39-37(50-27-34-19-11-6-12-20-34)25-44(31-46,42(48)54-43(2,3)4)53-41(39)40(52-29-36-23-15-8-16-24-36)38(51-28-35-21-13-7-14-22-35)30-49-26-33-17-9-5-10-18-33/h5-24,37-41,46H,25-31H2,1-4H3,(H,45,47)/t37-,38-,39+,40+,41+,44+/m0/s1
InChIKey WXSGSBPBHYPOFJ-CKBCXZBSSA-N
Mol Weight 739.9 g/mol
Molecular Formula C44H53NO9
Exact Mass 739.372033 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J2QUftaGQ5x
Name TERT.-BUTYL-5-ACETAMIDO-2,6-ANHYDRO-4,7,8,9-TETRA-O-BENZYL-3,5-DIDESOXY-2-C-(HYDROXYMETHYL)-D-ERYTHRO-L-GLUCO-NONONATE
Compound Number 10
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H53NO9
InChI InChI=1S/C44H53NO9/c1-32(47)45-39-37(50-27-34-19-11-6-12-20-34)25-44(31-46,42(48)54-43(2,3)4)53-41(39)40(52-29-36-23-15-8-16-24-36)38(51-28-35-21-13-7-14-22-35)30-49-26-33-17-9-5-10-18-33/h5-24,37-41,46H,25-31H2,1-4H3,(H,45,47)/t37-,38-,39+,40+,41+,44+/m0/s1
InChIKey WXSGSBPBHYPOFJ-CKBCXZBSSA-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 739.906 g/mol
Solvent CDCl3
Source File Reference UWCH37
SpectraBase Batch ID 99WeQWVdbiM