Structure of Sulfated Monosaccharides Studied by Quantum Chemical Methods

Abstract

Ab initio and DFT analysis have been used to study of geometry of sulfated monosaccharides GlcN,6-SO3 and IdoA 2-SO3 in solvent. The computed low conformational barrier between the interconverting conformers of the IdoA 2-SO3 residue is in agreement with experimental data. 

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