Structural Chemistry

, Volume 27, Issue 2, pp 449–455 | Cite as

A new hybrid (experimental–theoretical) quantitative method for detection of relative anomer concentrations in water

Original Research

Abstract

A novel and inexpensive hybrid (combined experimental and theoretical) approach was used to quantitatively identify anomer proportions of d-glucose, d-galactose and d-mannose in water. The study involves three parts: recording of experimental FT-IR spectra of monosaccharides in water, calculation of vibrational frequencies of all stable anomers of monosaccharides and regression analysis of theoretical and experimental intensities. No expensive experimental processes and high-level calculations were needed during the study. The results were compared with the data from pure experimental and molecular dynamic studies. It has been concluded that in water while d-glucose and d-mannose have two stable anomers, α-pyranose and β-pyranose, d-galactose has four stable anomers, α-pyranose, β-pyranose, α-furanose and β-furanose. Comparison of detected results with the literature data showed that the developed method is working for the quantitative detection of anomer proportions of monosaccharides in water.

Keywords

Monosaccharide Anomer FT-IR Molecular modeling 

Supplementary material

11224_2015_722_MOESM1_ESM.pdf (342 kb)
Supplementary material 1 (PDF 342 kb)

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Copyright information

© Springer Science+Business Media New York 2015

Authors and Affiliations

  • Sedat Karabulut
    • 1
  • Devran Uysal
    • 1
  • Jerzy Leszczynski
    • 2
  1. 1.Chemistry Department, Science and Art FacultyBalikesir UniversityBalikesirTurkey
  2. 2.Interdisciplinary Nanotoxicology CenterJackson State UniversityJacksonUSA

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