Omanische Heilpflanze im Fokus der Phytochemie IPB-Wissenschaftler und Partner aus Dhofar haben jüngst die omanische Heilpflanze Terminalia dhofarica unter die phytochemische Lupe genommen. Die Pflanze ist reich an…
Geschmack ist vorhersagbar: Mit FlavorMiner. FlavorMiner heißt das Tool, das IPB-Chemiker und Partner aus Kolumbien jüngst entwickelt haben. Das Programm kann, basierend auf maschinellem Lernen (KI), anhand der…
Peters, K.; Blatt-Janmaat, K. L.; Tkach, N.; Dam, N. M.; Neumann, S.;Untargeted metabolomics for integrative taxonomy: Metabolomics, DNA marker-based sequencing, and phenotype bioimagingPlants12881(2023)DOI: 10.3390/plants12040881
Integrative taxonomy is a fundamental part of biodiversity and combines traditional morphology with additional methods such as DNA sequencing or biochemistry. Here, we aim to establish untargeted metabolomics for use in chemotaxonomy. We used three thallose liverwort species Riccia glauca, R. sorocarpa, and R. warnstorfii (order Marchantiales, Ricciaceae) with Lunularia cruciata (order Marchantiales, Lunulariacea) as an outgroup. Liquid chromatography high-resolution mass-spectrometry (UPLC/ESI-QTOF-MS) with data-dependent acquisition (DDA-MS) were integrated with DNA marker-based sequencing of the trnL-trnF region and high-resolution bioimaging. Our untargeted chemotaxonomy methodology enables us to distinguish taxa based on chemophenetic markers at different levels of complexity: (1) molecules, (2) compound classes, (3) compound superclasses, and (4) molecular descriptors. For the investigated Riccia species, we identified 71 chemophenetic markers at the molecular level, a characteristic composition in 21 compound classes, and 21 molecular descriptors largely indicating electron state, presence of chemical motifs, and hydrogen bonds. Our untargeted approach revealed many chemophenetic markers at different complexity levels that can provide more mechanistic insight into phylogenetic delimitation of species within a clade than genetic-based methods coupled with traditional morphology-based information. However, analytical and bioinformatics analysis methods still need to be better integrated to link the chemophenetic information at multiple scales.
Publikation
Blatt-Janmaat, K. L.; Neumann, S.; Ziegler, J.; Peters, K.;Host tree and geography induce metabolic shifts in the epiphytic liverwort Radula complanataPlants12571(2023)DOI: 10.3390/plants12030571
Bryophytes are prolific producers of unique, specialized metabolites that are not found in other plants. As many of these unique natural products are potentially interesting, for example, pharmacological use, variations in the production regarding ecological or environmental conditions have not often been investigated. Here, we investigate metabolic shifts in the epiphytic Radula complanata L. (Dumort) with regard to different environmental conditions and the type of phorophyte (host tree). Plant material was harvested from three different locations in Sweden, Germany, and Canada and subjected to untargeted liquid chromatography high-resolution mass-spectrometry (UPLC/ESI-QTOF-MS) and data-dependent acquisition (DDA-MS). Using multivariate statistics, variable selection methods, in silico compound identification, and compound classification, a large amount of variation (39%) in the metabolite profiles was attributed to the type of host tree and 25% to differences in environmental conditions. We identified 55 compounds to vary significantly depending on the host tree (36 on the family level) and 23 compounds to characterize R. complanata in different environments. Taken together, we found metabolic shifts mainly in primary metabolites that were associated with the drought response to different humidity levels. The metabolic shifts were highly specific to the host tree, including mostly specialized metabolites suggesting high levels of ecological interaction. As R. complanata is a widely distributed generalist species, we found it to flexibly adapt its metabolome according to different conditions. We found metabolic composition to also mirror the constitution of the habitat, which makes it interesting for conservation measures.
Bücher und Buchkapitel
Peters, K.; Poeschl, Y.; Blatt-Janmaat, K. L.; Uthe, H.;Ecometabolomics studies of BryophytesHosakatte Niranjana MurthyReference Series in Phytochemistry1-43(2022)ISBN:978-3-030-97415-2DOI: 10.1007/978-3-030-97415-2_30-1
Bryophytes are the largest group of non-vascular plants that occur in almost any land ecosystem and have remarkable impact on ecosystem functioning at a global level. Despite that they have evolved an extraordinary chemical diversity, only a few bryophytic species have been studied using metabolomic techniques. Ecometabolomics systematically investigates the composition of metabolic compounds in bryophytes and relates these to organismal and environmental interactions. The application of ecometabolomics to bryophytic organisms can lead to new insights into their molecular biology, can identify novel bioactive natural products, can shed light on the phylogenetic and evolutionary mechanisms bryophytes realize in order to sustain ecological change, or can greatly improve the mechanistic understanding of ecological processes that are mediated by metabolic compounds at various levels. In this chapter, we first describe ecometabolomics and provide an introduction to how it can be performed. We then focus on case studies covering the various research fields of natural product chemistry, chemodiversity, chemotaxonomy/chemophenetics, functional ecology and plant traits, bioindication and biomonitoring, bioactivities, and the molecular biology of bryophytes. Finally, we present the latest advancements in analytic and computational methods to show the tremendous potential of the emerging technology of ecometabolomics for research with bryophytic organisms.