An Overview of Metabolomic Approaches to Polyphenol Profiling for Nutraceutical Development

Secondary plant metabolites such as polyphenols (flavonoids, phenolic acids, stilbenes, and lignans) are valued for their numerous benefits and commonly associated with antioxidants, anti-inflammatory, anticancer, neuroprotective, and antidiabetic effects. Comprehensive profiling facilitates their identification and quantification, with metabolomics emerging as an increasingly valuable tool. This current work provides an overview of recent application of metabolomics for investigating polyphenols with nutraceutical potential. It also highlights the influence of plant species and environmental stressors (both biotics and abiotic) inducing metabolic shifts that promote the production and accumulation of these bioactive compounds (BACs). While various analytical tools including mass spectrometry (MS) coupled with liquid chromatography (LC-MS) or gas chromatography (GC-MS), as well as nuclear magnetic resonance (NMR) spectroscopy have been utilized to identify the diverse group of polyphenol metabolites, LC-MS has been predominantly used due to its superior sensitivity and wider metabolite coverage, with flavonoids being the main compounds identified. The integration of bioinformatic tools and pathway enrichment analysis in metabolomics is providing expansive insight into the pool of polyphenols, and their bio-functional interpretation and metabolic variations beyond the narrow scope of chromatographic separation alone. This overview also identifies limitations of current methods and suggests directions for future research, aimed at facilitating the development of nutraceuticals.