Abstract

A comparison between High-Performance Thin-Layer Chromatography (HPTLC) analysis and Liquid Chromatography High Resolution Mass Spectrometry (LC–HRMS), coupled with Principal Component Analysis (PCA) was carried out by performing a combined metabolomics study to discriminate Arbutus unedo (A. unedo) plants. For a rapid digital record of A. unedo extracts (leaves, yellow fruit, and red fruit collected in La Maddalena and Sassari, Sardinia), HPTLC was used. Data were then analysed by PCA with the results of the ability of this technique to discriminate samples. Similarly, extracts were acquired by non-targeted LC–HRMS followed by unsupervised PCA, and then by LC–HRMS (MS) to identify secondary metabolites involved in the differentiation of the samples. As a result, we demonstrated that HPTLC may be applied as a simple and reliable untargeted approach to rapidly discriminate extracts based on tissues and/or geographical origins, while LC–HRMS could be used to identify which metabolites are able to discriminate samples.

Highlights

  • Plant metabolic profiling is a very useful strategy to study the complexity and the large variety of compounds belonging to different chemical classes [1] and is ideally suited to comparing many samples in order to classify them according to botanical, geographical origins and chemotypes [2,3,4,5].As a consequence, one of the many aims of research in the field of metabolomics is to analyze a large number of samples and obtain information in the shortest times and with a little or no sample preparation time [6,7]

  • The new developments reached, employing high chromatographic resolution/separation interfaced with high resolution mass spectrometry, showed the power of this coupled technique in metabolomics [12,13,14,15]

  • The power of High-Performance Thin-Layer Chromatography (HPTLC) analysis is to get characteristic fingerprints of secondary metabolites occurring in numerous biological samples (~20) in a single run

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Summary

Introduction

Plant metabolic profiling is a very useful strategy to study the complexity and the large variety of compounds belonging to different chemical classes [1] and is ideally suited to comparing many samples in order to classify them according to botanical, geographical origins and chemotypes [2,3,4,5].As a consequence, one of the many aims of research in the field of metabolomics is to analyze a large number of samples and obtain information in the shortest times and with a little or no sample preparation time [6,7]. Plant metabolic profiling is a very useful strategy to study the complexity and the large variety of compounds belonging to different chemical classes [1] and is ideally suited to comparing many samples in order to classify them according to botanical, geographical origins and chemotypes [2,3,4,5]. Creation of rapid and convenient methods for simultaneous metabolites fingerprinting and their quantification requires the use of peculiar analytical techniques. Most metabolomics studies were performed using the most popular analytical technologies, such as Nuclear Magnetic Resonance, GC, LC, and MS [11]. The new developments reached, employing high chromatographic resolution/separation interfaced with high resolution mass spectrometry, showed the power of this coupled technique in metabolomics [12,13,14,15].

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