A Metabolomic Approach Applied to a Liquid Chromatography Coupled to High-Resolution Tandem Mass Spectrometry Method (HPLC-ESI-HRMS/MS): Towards the Comprehensive Evaluation of the Chemical Composition of Cannabis Medicinal Extracts.

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Abstract

Cannabis sativa L. is a powerful medicinal plant and its use has recently increased for the treatment of several pathologies. Nonetheless, side effects, like dizziness and hallucinations, and long-term effects concerning memory and cognition, can occur. Most alarming is the lack of a standardised procedure to extract medicinal cannabis. Indeed, each galenical preparation has an unknown chemical composition in terms of cannabinoids and other active principles that depends on the extraction procedure.

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XCMS Online: a web-based platform to process untargeted metabolomic data.

Ralf Tautenhahn, Gary J Patti, Duane Rinehart … (2012)

Recently, interest in untargeted metabolomics has become prevalent in the general scientific community among an increasing number of investigators. The majority of these investigators, however, do not have the bioinformatic expertise that has been required to process metabolomic data by using command-line driven software programs. Here we introduce a novel platform to process untargeted metabolomic data that uses an intuitive graphical interface and does not require installation or technical expertise. This platform, called XCMS Online, is a web-based version of the widely used XCMS software that allows users to easily upload and process liquid chromatography/mass spectrometry data with only a few mouse clicks. XCMS Online provides a solution for the complete untargeted metabolomic workflow including feature detection, retention time correction, alignment, annotation, statistical analysis, and data visualization. Results can be browsed online in an interactive, customizable table showing statistics, chromatograms, and putative METLIN identities for each metabolite. Additionally, all results and images can be downloaded as zip files for offline analysis and publication. XCMS Online is available at https://xcmsonline.scripps.edu.

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Plant metabolomics: large-scale phytochemistry in the functional genomics era.

Lloyd W. Sumner, Pedro Mendes, Richard A. F. Dixon (2003)

Metabolomics or the large-scale phytochemical analysis of plants is reviewed in relation to functional genomics and systems biology. A historical account of the introduction and evolution of metabolite profiling into today's modern comprehensive metabolomics approach is provided. Many of the technologies used in metabolomics, including optical spectroscopy, nuclear magnetic resonance, and mass spectrometry are surveyed. The critical role of bioinformatics and various methods of data visualization are summarized and the future role of metabolomics in plant science assessed.

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Quaternary Ammonium and Tertiary Sulfonium Compounds in Higher Plants

Scott D Rhodes, A Hanson (1993)

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Author and article information

Journal

Journal ID (iso-abbrev): Phytochem Anal

Title: Phytochemical analysis : PCA

Publisher: Wiley

ISSN (Electronic): 1099-1565

ISSN (Print): 0958-0344

Publication date (Electronic): Mar 2018

Volume: 29

Issue: 2

Affiliations

[1 ] Dipartimento di Scienze e Tecnologie Biologiche ed Ambientali, Università del Salento, Via per Monteroni, 73100, Lecce, Italy.

[2 ] CNR NANOTEC, Campus Ecoteckne dell'Università del Salento, Via per Monteroni, 73100, Lecce, Italy.

[3 ] Dipartimento di Scienze della Vita, Università di Modena e Reggio Emilia, Via Campi 103, 41125, Modena, Italy.

[4 ] Department of Medicinal Chemistry, School of Pharmacy, Virginia Commonwealth University, Richmond, VA, 23298, USA.

[5 ] Dipartimento di Scienze e Tecnologie Biologiche ed Ambientali, Università del Salento & UdR INSTM di Lecce, c/o Campus Ecotekne, Via Monteroni, 73100, Lecce, Italy.

[6 ] Institute of Pharmaceutical Sciences, Department of Pharmaceutical Chemistry, University of Graz, Schubertstraße 1, Graz, A-8010, Austria.

Article

DOI: 10.1002/pca.2722

PubMed ID: 28915313

SO-VID: 1a5d9778-7164-4fef-bbbc-44b91dc6369e

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Keywords: cannabis medicinal extracts,mass spectrometry,metabolomics,cannabinoids extraction

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Keywords: cannabis medicinal extracts, mass spectrometry, metabolomics, cannabinoids extraction

A Metabolomic Approach Applied to a Liquid Chromatography Coupled to High-Resolution Tandem Mass Spectrometry Method (HPLC-ESI-HRMS/MS): Towards the Comprehensive Evaluation of the Chemical Composition of Cannabis Medicinal Extracts.

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Most cited references 33

XCMS Online: a web-based platform to process untargeted metabolomic data.

Plant metabolomics: large-scale phytochemistry in the functional genomics era.

Quaternary Ammonium and Tertiary Sulfonium Compounds in Higher Plants

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