Conformational behaviour of glycomimetics: NMR and molecular modelling studies of the C-glycoside analogue of the disaccharide methyl beta-D-galactopyranosyl-(1-->3)-beta-D-glucopyranoside

Carbohydr Res. 2007 Sep 3;342(12-13):1910-7. doi: 10.1016/j.carres.2007.04.017. Epub 2007 Apr 29.

Abstract

The conformational behaviour of the C-glycoside beta-C-Gal-(1-->3)-beta-Glc-OMe (1) has been studied using a combination of molecular mechanics and NMR spectroscopy (proton-proton coupling constants and nuclear Overhauser effects). It is shown that the C-disaccharide populates two distinctive conformational families in solution, the normal syn-psi conformation, which is the predominating conformation of parent O-glycoside 2, and the anti-psi conformation, which has not been detected for the O-disaccharide.

MeSH terms

  • Biomimetics
  • Carbohydrate Conformation
  • Disaccharides / chemical synthesis
  • Disaccharides / chemistry*
  • Galactose
  • Glucose
  • Glycosides / chemistry*
  • Magnetic Resonance Spectroscopy
  • Models, Molecular

Substances

  • Disaccharides
  • Glycosides
  • Glucose
  • Galactose