Mass spectrometry‐based metabolomic analysis as a tool for quality control of natural complex products

L Mattoli, M Gianni, M Burico - Mass Spectrometry Reviews, 2023 - Wiley Online Library
Metabolomics is an area of intriguing and growing interest. Since the late 1990s, when the
first Omic applications appeared to study metabolite's pool (“metabolome”), to understand …

Automation of mass spectrometric detection of analytes and related workflows: A review

DP Elpa, GRD Prabhu, SP Wu, KS Tay, PL Urban - Talanta, 2020 - Elsevier
The developments in mass spectrometry (MS) in the past few decades reveal the power and
versatility of this technology. MS methods are utilized in routine analyses as well as research …

Improved LC/MS methods for the analysis of metal-sensitive analytes using medronic acid as a mobile phase additive

JJ Hsiao, OG Potter, TW Chu, H Yin - Analytical chemistry, 2018 - ACS Publications
Phosphorylated compounds and organic acids with multiple carboxylate groups are
commonly observed to have poor peak shapes and signal in LC/MS experiments. The poor …

Opportunities and limitations for untargeted mass spectrometry metabolomics to identify biologically active constituents in complex natural product mixtures

LK Caesar, JJ Kellogg, OM Kvalheim… - Journal of natural …, 2019 - ACS Publications
Compounds derived from natural sources represent the majority of small-molecule drugs
utilized today. Plants, owing to their complex biosynthetic pathways, are poised to …

Hierarchical cluster analysis of technical replicates to identify interferents in untargeted mass spectrometry metabolomics

LK Caesar, OM Kvalheim, NB Cech - Analytica chimica acta, 2018 - Elsevier
Mass spectral data sets often contain experimental artefacts, and data filtering prior to
statistical analysis is crucial to extract reliable information. This is particularly true in …

MetFID: artificial neural network-based compound fingerprint prediction for metabolite annotation

Z Fan, A Alley, K Ghaffari, HW Ressom - Metabolomics, 2020 - Springer
Introduction Metabolite annotation is a critical and challenging step in mass spectrometry-
based metabolomic profiling. In a typical untargeted MS/MS-based metabolomic study …

[HTML][HTML] Nanoparticle-based laser desorption/ionization mass spectrometric analysis of drugs and metabolites

HW Chu, B Unnikrishnan, A Anand, JY Mao… - journal of food and drug …, 2018 - Elsevier
Nanoparticle-assisted laser desorption/ionization mass spectrometry (LDI-MS) is a powerful
tool for the analysis of a wide range of molecules. Many of the drawbacks in the matrix …

Searching molecular structure databases using tandem MS data: are we there yet?

S Böcker - Current Opinion in Chemical Biology, 2017 - Elsevier
Untargeted metabolomics experiments usually rely on tandem mass spectrometry (MS/MS)
to identify the thousands of compounds in a complex sample. Spectral libraries used for …

Mass spectrometry-based metabolomics in translational research

SJ Kim, HE Song, HY Lee, HJ Yoo - Advanced Imaging and Bio …, 2021 - Springer
Metabolomics is the systematic study of metabolite profiles of complex biological systems,
and involves the systematic identification and quantification of metabolites. Metabolism is …

The impact of genome variation and diet on the metabolic phenotype and microbiome composition of Drosophila melanogaster

L Jehrke, FA Stewart, A Droste, M Beller - Scientific reports, 2018 - nature.com
The metabolic phenotype of an organism depends on a complex regulatory network, which
integrates the plethora of intrinsic and external information and prioritizes the flow of …