Structure of Sulfated Monosaccharides Studied by Quantum Chemical Methods

oleh: Miloš Hricovíni, Pavel Mach, Eva Scholtzová

Format: Article
Diterbitkan: MDPI AG 2003-11-01

Deskripsi

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.