John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=H6cdfMK2KSm SpectraBase Spectrum ID=4iITEO81HPv

(accessed ).
5-ACETAMIDO-2,6-ANHYDRO-2-C-(AZIDOMETHYL)-4,7,8,9-TETRA-O-BENZYL-3,5-DIDESOXY-D-ERYTHRO-L-MANNO-NONONIC-ACID
SpectraBase Compound ID H6cdfMK2KSm
InChI InChI=1S/C40H44N4O8/c1-29(45)43-36-34(49-24-31-16-8-3-9-17-31)22-40(39(46)47,28-42-44-41)52-38(36)37(51-26-33-20-12-5-13-21-33)35(50-25-32-18-10-4-11-19-32)27-48-23-30-14-6-2-7-15-30/h2-21,34-38H,22-28H2,1H3,(H,43,45)(H,46,47)/t34-,35-,36+,37+,38+,40-/m0/s1
InChIKey MKYUWQVOSBKUPP-YYXPMGQFSA-N
Mol Weight 708.8 g/mol
Molecular Formula C40H44N4O8
Exact Mass 708.315915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4iITEO81HPv
Name 5-ACETAMIDO-2,6-ANHYDRO-2-C-(AZIDOMETHYL)-4,7,8,9-TETRA-O-BENZYL-3,5-DIDESOXY-D-ERYTHRO-L-MANNO-NONONIC-ACID
Compound Number 18C
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H44N4O8
InChI InChI=1S/C40H44N4O8/c1-29(45)43-36-34(49-24-31-16-8-3-9-17-31)22-40(39(46)47,28-42-44-41)52-38(36)37(51-26-33-20-12-5-13-21-33)35(50-25-32-18-10-4-11-19-32)27-48-23-30-14-6-2-7-15-30/h2-21,34-38H,22-28H2,1H3,(H,43,45)(H,46,47)/t34-,35-,36+,37+,38+,40-/m0/s1
InChIKey MKYUWQVOSBKUPP-YYXPMGQFSA-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 708.811 g/mol
Solvent CD3OD
Source File Reference UWCH40
SpectraBase Batch ID 94CcuAhxuXK