Multiple co-pigments of quercetin and chlorogenic acid blends intensify the color of mulberry anthocyanins: insights from hyperchromicity, kinetics, and molecular modeling investigations

J Sci Food Agric. 2021 Mar 15;101(4):1579-1588. doi: 10.1002/jsfa.10777. Epub 2020 Sep 24.

Abstract

Background: The effect of multiple co-pigments on the color intensification of mulberry anthocyanins (ACs) using spectroscopic techniques in combination with a molecular docking study was studied. The hyperchromicity of ACs co-pigmented with chlorogenic acid (CH) and quercetin (Q) blends was measured and their color stability in liquid and encapsulated particle models was evaluated.

Results: Multiple co-pigments exhibited higher hyperchromicity, pKH -values, and heat-stability than their individual counterparts. Surflex-docking findings confirmed that stronger binding occurred between multiple ligands and AC than single ones due to their extra -OH, -COOH groups, and delocalization systems. The binding was allowed by increased H-bonding, van der Waals forces, and π-π sites by the extra groups of the multiple co-pigments with AC in aqueous juice and whey particle-based models.

Conclusion: This is the first report of the ternary mixture of phenolic acid-flavonol-anthocyanin which could be used as promising food red-colorants. © 2020 Society of Chemical Industry.

Keywords: molecular docking modeling; mulberry anthocyanins; multiple co-pigments; multispectral approaches; thermodynamic constants.

MeSH terms

  • Anthocyanins / chemistry*
  • Anthocyanins / metabolism
  • Chlorogenic Acid / chemistry*
  • Chlorogenic Acid / metabolism
  • Color
  • Fruit / chemistry
  • Fruit / growth & development
  • Fruit / metabolism
  • Kinetics
  • Molecular Docking Simulation
  • Morus / chemistry
  • Morus / growth & development
  • Morus / metabolism*
  • Plant Extracts / chemistry*
  • Plant Extracts / metabolism
  • Quercetin / chemistry*
  • Quercetin / metabolism

Substances

  • Anthocyanins
  • Plant Extracts
  • Chlorogenic Acid
  • Quercetin