High Throughput Metabolomics using 96-plex Isotope Tagging

31 May 2023, Version 1
This content is a preprint and has not undergone peer review at the time of posting.

Abstract

Liquid Chromatography-mass spectrometry (LC-MS) based metabolomics suffers from extended duty cycles and matrix-dependent quantitation. Chemical tags with 96 unique masses are reported which alleviate the metabolomic workflow bottleneck and allow for absolute quantitation. A metabolic screen for carboxylic acids was performed on mammalian cells deprived of various nutrients and showed 24% RSD and analysis of 288 samples in 2 hours.

Keywords

Multiplexing
Metabolomics
Isotopes
High-throughput screening

Supplementary materials

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Description
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Analyte m/z list
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This matrix details the expected m/z for each isotope variant of every analyte investigated.
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Tag isotope purity matrix
Description
Raw data detailing all sites of isotope overlap. Tags are numbered in order of decreasing mass.
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Cell media table
Description
Details the media components used for culture. Nutrients in red were added manually or excluded to create the deprived media stocks.
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Tag plate maps
Description
Details which tags were used for each biological experiment.
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Tag characterization
Description
HRMS and NMR characterization of the 96 synthesized tags.
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Supporting information
Description
Contains supplemental figures, tables, and methods referenced in the manuscript.
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