دورية أكاديمية
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Improving wastewater-based epidemiology for new psychoactive substance surveillance by combining a high-throughput in vitro metabolism assay and LC-HRMS metabolite identification.

التفاصيل البيبلوغرافية
العنوان: Improving wastewater-based epidemiology for new psychoactive substance surveillance by combining a high-throughput in vitro metabolism assay and LC-HRMS metabolite identification.
المؤلفون: Bade R; Queensland Alliance for Environmental Health Sciences (QAEHS), The University of Queensland, Woolloongabba, Australia. Electronic address: r.bade@uq.edu.au., Huchthausen J; Helmholtz Centre for Environmental Research, Leipzig, Germany., Huber C; Helmholtz Centre for Environmental Research, Leipzig, Germany., Dewapriya P; Queensland Alliance for Environmental Health Sciences (QAEHS), The University of Queensland, Woolloongabba, Australia., Tscharke BJ; Queensland Alliance for Environmental Health Sciences (QAEHS), The University of Queensland, Woolloongabba, Australia., Verhagen R; Queensland Alliance for Environmental Health Sciences (QAEHS), The University of Queensland, Woolloongabba, Australia., Puljevic C; School of Public Health, The University of Queensland, Brisbane, Australia., Escher BI; Queensland Alliance for Environmental Health Sciences (QAEHS), The University of Queensland, Woolloongabba, Australia; Helmholtz Centre for Environmental Research, Leipzig, Germany., O'Brien JW; Queensland Alliance for Environmental Health Sciences (QAEHS), The University of Queensland, Woolloongabba, Australia; Van 't Hoff Institute for Molecular Sciences (HIMS), University of Amsterdam, the Netherlands.
المصدر: Water research [Water Res] 2024 Apr 01; Vol. 253, pp. 121297. Date of Electronic Publication: 2024 Feb 09.
نوع المنشور: Journal Article
اللغة: English
بيانات الدورية: Publisher: Pergamon Press Country of Publication: England NLM ID: 0105072 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1879-2448 (Electronic) Linking ISSN: 00431354 NLM ISO Abbreviation: Water Res Subsets: MEDLINE
أسماء مطبوعة: Original Publication: Oxford, Pergamon Press.
مواضيع طبية MeSH: Wastewater-Based Epidemiological Monitoring* , Wastewater*, Humans ; Mass Spectrometry ; Chromatography, Liquid/methods ; Australia
مستخلص: One of the primary criteria for a suitable drug biomarker for wastewater-based epidemiology (WBE) is having a unique source representing human metabolism. For WBE studies, this means it is important to identify and monitor metabolites rather than parent drugs, to capture consumption of drugs and not fractions that could be directly disposed. In this study, a high-throughput workflow based on a human liver S9 fraction in vitro metabolism assay was developed to identify human transformation products of new chemicals, using α-pyrrolidino-2-phenylacetophenone (α-D2PV) as a case study. Analysis by liquid chromatography coupled to high resolution mass spectrometry identified four metabolites. Subsequently, a targeted liquid chromatography - tandem mass spectrometry method was developed for their analysis in wastewater samples collected from a music festival in Australia. The successful application of this workflow opens the door for future work to better understand the metabolism of chemicals and their detection and application for wastewater-based epidemiology.
Competing Interests: Declaration of competing interest The authors declare that they have no known competing financial interests or personal relationships that could have appeared to influence the work reported in this paper.
(Copyright © 2024. Published by Elsevier Ltd.)
فهرسة مساهمة: Keywords: Metabolite discovery; Music festivals; Synthetic cathinones; Wastewater analysis; α-D2PV; α-pyrrolidino-2-phenylacetophenone
المشرفين على المادة: 0 (Wastewater)
تواريخ الأحداث: Date Created: 20240214 Date Completed: 20240318 Latest Revision: 20240318
رمز التحديث: 20240318
DOI: 10.1016/j.watres.2024.121297
PMID: 38354662
قاعدة البيانات: MEDLINE
الوصف
تدمد:1879-2448
DOI:10.1016/j.watres.2024.121297