A Data-Independent Methodology for the Structural Characterization of Microcystins and Anabaenopeptins Leading to the Identification of Four New Congeners

Toxin-producing cyanobacteria are responsible for the presence of hundreds of bioactive compounds in aquatic environments undergoing increasing eutrophication. The identification of cyanotoxins is still emerging, due to the great diversity of potential congeners, yet high-resolution mass spectrometr...

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Main Authors: Audrey Roy-Lachapelle, Morgan Solliec, Sébastien Sauvé, Christian Gagnon
Format: Article
Language:English
Published: MDPI AG 2019-10-01
Series:Toxins
Subjects:
Online Access:https://www.mdpi.com/2072-6651/11/11/619
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author Audrey Roy-Lachapelle
Morgan Solliec
Sébastien Sauvé
Christian Gagnon
author_facet Audrey Roy-Lachapelle
Morgan Solliec
Sébastien Sauvé
Christian Gagnon
author_sort Audrey Roy-Lachapelle
collection DOAJ
description Toxin-producing cyanobacteria are responsible for the presence of hundreds of bioactive compounds in aquatic environments undergoing increasing eutrophication. The identification of cyanotoxins is still emerging, due to the great diversity of potential congeners, yet high-resolution mass spectrometry (HRMS) has the potential to deepen this knowledge in aquatic environments. In this study, high-throughput and sensitive on-line solid-phase extraction ultra-high performance liquid chromatography (SPE-UHPLC) coupled to HRMS was applied to a data-independent acquisition (DIA) workflow for the suspect screening of cyanopeptides, including microcystin and anabaenopeptin toxin classes. The unambiguous characterization of 11 uncommon cyanopeptides was possible using a characterization workflow through extensive analysis of fragmentation patterns. This method also allowed the characterization of four unknown cyanotoxins ([Leu<sup>1</sup>, Ser<sup>7</sup>] MC-HtyR, [Asp<sup>3</sup>]MC-RHar, AP731, and AP803). The quantification of 17 common cyanotoxins along with the semi-quantification of the characterized uncommon cyanopeptides resulted with the identification of 23 different cyanotoxins in 12 lakes in Canada, United Kingdom and France. The concentrations of the compounds varied between 39 and 41,000 ng L<sup>&#8722;1</sup>. To our knowledge, this is the first DIA method applied for the suspect screening of two families of cyanopeptides simultaneously. Moreover, this study shows the great diversity of cyanotoxins in lake water cyanobacterial blooms, a growing concern in aquatic systems.
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spelling doaj.art-58ece97d88a442f480d91aa9fc6affb02022-12-22T02:15:16ZengMDPI AGToxins2072-66512019-10-01111161910.3390/toxins11110619toxins11110619A Data-Independent Methodology for the Structural Characterization of Microcystins and Anabaenopeptins Leading to the Identification of Four New CongenersAudrey Roy-Lachapelle0Morgan Solliec1Sébastien Sauvé2Christian Gagnon3Environment and Climate Change Canada, Aquatic Contaminants Research Division, Montréal, QC H2Y 2E5, CanadaNSERC-Industrial Chair on Drinking Water, CGM Department, École Polytechnique de Montréal, Montréal, QC H3T 1J4, CanadaDepartment of Chemistry, Université de Montréal, Montréal, QC H3T 1J4, CanadaEnvironment and Climate Change Canada, Aquatic Contaminants Research Division, Montréal, QC H2Y 2E5, CanadaToxin-producing cyanobacteria are responsible for the presence of hundreds of bioactive compounds in aquatic environments undergoing increasing eutrophication. The identification of cyanotoxins is still emerging, due to the great diversity of potential congeners, yet high-resolution mass spectrometry (HRMS) has the potential to deepen this knowledge in aquatic environments. In this study, high-throughput and sensitive on-line solid-phase extraction ultra-high performance liquid chromatography (SPE-UHPLC) coupled to HRMS was applied to a data-independent acquisition (DIA) workflow for the suspect screening of cyanopeptides, including microcystin and anabaenopeptin toxin classes. The unambiguous characterization of 11 uncommon cyanopeptides was possible using a characterization workflow through extensive analysis of fragmentation patterns. This method also allowed the characterization of four unknown cyanotoxins ([Leu<sup>1</sup>, Ser<sup>7</sup>] MC-HtyR, [Asp<sup>3</sup>]MC-RHar, AP731, and AP803). The quantification of 17 common cyanotoxins along with the semi-quantification of the characterized uncommon cyanopeptides resulted with the identification of 23 different cyanotoxins in 12 lakes in Canada, United Kingdom and France. The concentrations of the compounds varied between 39 and 41,000 ng L<sup>&#8722;1</sup>. To our knowledge, this is the first DIA method applied for the suspect screening of two families of cyanopeptides simultaneously. Moreover, this study shows the great diversity of cyanotoxins in lake water cyanobacterial blooms, a growing concern in aquatic systems.https://www.mdpi.com/2072-6651/11/11/619cyanotoxinscyanobacteriamicrocystinsanabaenopeptinslc-hrmsdata-independent acquisitionsuspect screeningnon-target screeningstructural characterization
spellingShingle Audrey Roy-Lachapelle
Morgan Solliec
Sébastien Sauvé
Christian Gagnon
A Data-Independent Methodology for the Structural Characterization of Microcystins and Anabaenopeptins Leading to the Identification of Four New Congeners
Toxins
cyanotoxins
cyanobacteria
microcystins
anabaenopeptins
lc-hrms
data-independent acquisition
suspect screening
non-target screening
structural characterization
title A Data-Independent Methodology for the Structural Characterization of Microcystins and Anabaenopeptins Leading to the Identification of Four New Congeners
title_full A Data-Independent Methodology for the Structural Characterization of Microcystins and Anabaenopeptins Leading to the Identification of Four New Congeners
title_fullStr A Data-Independent Methodology for the Structural Characterization of Microcystins and Anabaenopeptins Leading to the Identification of Four New Congeners
title_full_unstemmed A Data-Independent Methodology for the Structural Characterization of Microcystins and Anabaenopeptins Leading to the Identification of Four New Congeners
title_short A Data-Independent Methodology for the Structural Characterization of Microcystins and Anabaenopeptins Leading to the Identification of Four New Congeners
title_sort data independent methodology for the structural characterization of microcystins and anabaenopeptins leading to the identification of four new congeners
topic cyanotoxins
cyanobacteria
microcystins
anabaenopeptins
lc-hrms
data-independent acquisition
suspect screening
non-target screening
structural characterization
url https://www.mdpi.com/2072-6651/11/11/619
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