Interval multivariate curve resolution in the dereplication of HPLC-DAD data from Jatropha gossypifolia

Phytochem Anal. 2013 Jul-Aug;24(4):401-6. doi: 10.1002/pca.2423. Epub 2013 Mar 10.

Abstract

Introduction: Jatropha gossypifolia has been used quite extensively by traditional medicine for the treatment of several diseases in South America and Africa. This medicinal plant has therapeutic potential as a phytomedicine and therefore the establishment of innovative analytical methods to characterise their active components is crucial to the future development of a quality product.

Objective: To enhance the chromatographic resolution of HPLC-UV-diode-array detector (DAD) experiments applying chemometric tools.

Methods: Crude leave extracts from J. gossypifolia were analysed by HPLC-DAD. A chromatographic band deconvolution method was designed and applied using interval multivariate curve resolution by alternating least squares (MCR-ALS).

Results: The MCR-ALS method allowed the deconvolution from up to 117% more bands, compared with the original HPLC-DAD experiments, even in regions where the UV spectra showed high similarity. The method assisted in the dereplication of three C-glycosylflavones isomers: vitexin/isovitexin, orientin/homorientin and schaftoside/isoschaftoside.

Conclusion: The MCR-ALS method is shown to be a powerful tool to solve problems of chromatographic band overlapping from complex mixtures such as natural crude samples.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Chromatography, High Pressure Liquid / instrumentation
  • Chromatography, High Pressure Liquid / methods*
  • Flavonoids / analysis
  • Flavonoids / chemistry
  • Glucosides / analysis
  • Glucosides / chemistry
  • Glycosides / analysis
  • Glycosides / chemistry
  • Jatropha / chemistry*
  • Least-Squares Analysis
  • Multivariate Analysis*
  • Plant Extracts / analysis
  • Plant Extracts / chemistry
  • Plants, Medicinal / chemistry
  • Ultraviolet Rays

Substances

  • Flavonoids
  • Glucosides
  • Glycosides
  • Plant Extracts
  • schaftoside
  • isoschaftoside
  • orientin