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Drug metabolite analysis with Trapped Ion Mobility Mass Spectrometry and Mass MetaSite high throughput data analysis
EP38447
Poster Title: Drug metabolite analysis with Trapped Ion Mobility Mass Spectrometry and Mass MetaSite high throughput data analysis
Submitted on 09 Mar 2022
Author(s): Xuejun Peng 1 , Eric S.E. van Beelen 2 , Ismael Zamora 3 , Anjali Alving 1 ,
Affiliations: 1 Bruker Scientific LLC, Billerica, MA, USA 2 Bruker Daltonics GmbH & Co. KG, Bremen, Germany ; 3Lead Molecular Design, Barcelona Spain
Poster Views: 169
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Poster Information
Abstract: An important aspect of metabolomics includes metabolic profiling studies wherein metabolites of the drug product are identified and quantified. This data is important to gain a thorough understanding of the routes of elimination, drug metabolizing enzyme pathways, drug drug interactions and any safety or toxicity concerns in humans.[1]
Here, we describe a workflow for metabolites identification of the drug Verapamil using Trapped Ion Mobility Spectrometry (TIMS) and Mass MetaSite (Molecular Discovery) for software processing.
Trapped Ion Mobility Spectrometry primarily is a separation technique in gas phase, which resolves sample complexity with an added dimension of separation independently and in addition to HPLC and mass spectrometry, increasing peak capacity and confidence in compound characterization.Summary: The use of Trapped Ion Mobility Spectrometry (TIMS) and Mass MetaSite data processing and analysis for metabolite identification allows for increased speed and confidence the result.References: (1) Drug Bank online: https://go.drugbank.com/drugs/DB00661Report abuse »
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