The analysis of metabolic profiles using high resolution mass spectrometry (MS) data gives deep insights into the biological processes. In metabolomics, MS generates a large number of features that represent metabolites. However, identifying specific metabolites from these features can be challenging. One of the major bottlenecks in the metabolomics field is the identification of MS features, which is a prerequisite for any biochemical interpretation. By identifying similarities and differences within a family, evaluating MS features at the metabolite family level can help assign functional roles to individual MS features. This data can help interpret metabolic pathways and processes within a biological system. For the assignment of metabolite families to MS features, it is very important to have good quality, reliable, and diverse spectral libraries. We initiated a global effort to collect high-resolution MS/MS spectra of metabolites from all biological origins, including mammals, microorganisms, and plants. The mFAM-MS/MS Collection delivers valuable training data to assign machine-readable classified information on the unknown metabolites. The mFam Consortium used a standardized metadata template and has developed a globally curated MS/MS spectral library of 7,872 spectra with 2,126 unique metabolites. This library was compiled from 47 datasets contributed by 25 laboratories and leverages 12 instrument types, including QTOF, Orbitrap, and Ion Mobility systems. It comprises 4,646 spectra in positive mode and 3,226 in negative mode. This standardized resource significantly enhances metabolite identification capabilities, supports the development of machine learning-based annotation tools, and accelerates the discovery of novel metabolites. All spectra are available under the collective contributor label mFam in the MassBank system, including the web interface and the 2025.10 data release available at GitHub and Zenodo.

Global food security and environmental sustainability are closely linked to positive plant-soil feedback, for example through reduced dependence on synthetic agrochemicals. Beyond their nutritional value as protein- and lipid-rich crops, legumes have an essential ecological function by enhancing soil fertility and consequently reducing the use of synthetic fertilizers. Legume root systems exude a diverse array of secondary metabolites into the soil. These exudates affect soil functions by influencing nutrient cycling or availability, soil microbial activity, and structure. Thereby they modulate ecological interactions, which may result in positive plant-soil feedback that can contribute to improve soil health and resilience of plant production systems. Considering the importance of legume root exudate and SMs to food production and environment protection, this review fills a gap in the literature summarizing the state-of-the-art regarding the elucidation of their chemodiversity and functional significance. For that, we have compiled the literature on legume root exudates of the last 25 years (from 1999 to 2024) resulting in a comprehensive list of secondary metabolites. We also discussed how they are accessed and their biological relevance in root symbiosis. We found that root exudates were characterized in 22 legume species, which led to the identification of 92 secondary metabolites. The most reported metabolites are shikimate and phenylpropanoid derivatives, especially flavonoids. Based on the information organized in this review, we observed that the rapid progress of metabolomics and high-resolution analytical techniques provided invaluable data on legume exudate chemical diversity, although other chemical classes remain underrepresented. Besides, this knowledge remains fragmented across few legume taxa, with most research concentrated on a limited number of model and crop legume species. We argue that expanding the research beyond cultivated species, and combining metabolomics strategies to access their chemical diversity with functional and ecological studies can leverage the knowledge on their regulatory mechanisms and their influence on rhizosphere microbial communities. Ultimately, by addressing legume root exudates chemistry and biological functions, this comprehensive review expands our current understanding on how such compounds contribute to plant performance, enhance soil health and promote sustainable agricultural practices.