Collected mass spectrometry data on monoterpene indole alkaloids from natural product chemistry research
| Autor: | Laurent Evanno, Mariia S. Kirillova, Fanny Roussi, Gaëla Cauchie, Pierre Champy, Marc Litaudon, Guy Lewin, Anne-Marie Le Ray, Raphaël Grougnet, Erwan Poupon, Marina Kritsanida, Lengo Mambu, Alexander E. Fox Ramos, Antonio M. Echavarren, Fedor M. Miloserdov, Pascal Richomme-Peniguel, Michel Frederich, Khalijah Awang, Sylvie Michel, Hazrina Hazni, Dimitri Bréard, Pierre Le Pogam, Christelle Lémus, Marion Girardot, Elvis Otogo N’Nang, Michael E. Muratore, Mehdi A. Beniddir, Charlotte Fox Alcover, Thomas Gaslonde |
|---|---|
| Přispěvatelé: | Institut de Recherches sur les lois Fondamentales de l'Univers (IRFU), Commissariat à l'énergie atomique et aux énergies alternatives (CEA)-Université Paris-Saclay, Université de Rennes 1 (UR1), Université de Rennes (UNIV-RENNES), Institut de Chimie des Substances Naturelles (ICSN), Centre National de la Recherche Scientifique (CNRS)-Institut de Chimie du CNRS (INC), Substances d'Origine Naturelle et Analogues Structuraux (SONAS), Université d'Angers (UA), Université de Liège, Synthèse et structure de molécules d'interet pharmacologique (SSMIP), Université Paris Descartes - Paris 5 (UPD5)-Centre National de la Recherche Scientifique (CNRS), Microbiologie de l'Eau (MDE), Ecologie et biologie des interactions (EBI), Université de Poitiers-Centre National de la Recherche Scientifique (CNRS)-Université de Poitiers-Centre National de la Recherche Scientifique (CNRS), Chimie Organique, Médicinale et Extractive et Toxicologie Expérimentale (COMETE - UMR 8638), Université Paris Descartes - Paris 5 (UPD5)-Institut de Chimie du CNRS (INC)-Centre National de la Recherche Scientifique (CNRS), PEIRENE (PEIRENE), Institut Génomique, Environnement, Immunité, Santé, Thérapeutique (GEIST), Université de Limoges (UNILIM)-Université de Limoges (UNILIM), Institut de Recherche en Gestion des Organisations (IRGO), Université de Bordeaux (UB)-Institut d'Administration des Entreprises (IAE) - Bordeaux, Équipe 'Pharmacognosie-Chimie des Substances Naturelles' BioCIS, Centre National de la Recherche Scientifique (CNRS), Université Paris-Sud - Paris 11 (UP11), Université de Rennes (UR), Institut de Chimie du CNRS (INC)-Centre National de la Recherche Scientifique (CNRS) |
| Rok vydání: | 2019 |
| Předmět: |
Statistics and Probability
Data descriptor Data Descriptor 010504 meteorology & atmospheric sciences Monoterpene Library and Information Sciences Tandem mass spectrometry Mass spectrometry 01 natural sciences Education 03 medical and health sciences chemistry.chemical_compound Life Science [CHIM]Chemical Sciences Metabolomics Organic chemistry lcsh:Science 030304 developmental biology 0105 earth and related environmental sciences Indole test Natural products 0303 health sciences Natural product Indole alkaloid Accession number (library science) Data acquisition Computer Science Applications chemistry 13. Climate action lcsh:Q Statistics Probability and Uncertainty Information Systems |
| Zdroj: | RECERCAT (Dipòsit de la Recerca de Catalunya) Scientific Data, Vol 6, Iss 1, Pp 1-6 (2019) Scientific Data Scientific Data, Nature Publishing Group, 2019, 6 (15), pp.1-6. ⟨10.1038/s41597-019-0028-3⟩ Recercat. Dipósit de la Recerca de Catalunya instname Scientific Data 6 (2019) 1 Scientific Data, 2019, 6 (15), pp.1-6. ⟨10.1038/s41597-019-0028-3⟩ Scientific Data, 6(1) |
| ISSN: | 2052-4463 |
| DOI: | 10.1038/s41597-019-0028-3 |
| Popis: | This Data Descriptor announces the submission to public repositories of the monoterpene indole alkaloid database (MIADB), a cumulative collection of 172 tandem mass spectrometry (MS/MS) spectra from multiple research projects conducted in eight natural product chemistry laboratories since the 1960s. All data have been annotated and organized to promote reuse by the community. Being a unique collection of these complex natural products, these data can be used to guide the dereplication and targeting of new related monoterpene indole alkaloids within complex mixtures when applying computer-based approaches, such as molecular networking. Each spectrum has its own accession number from CCMSLIB00004679916 to CCMSLIB00004680087 on the GNPS. The MIADB is available for download from MetaboLights under the identifier: MTBLS142 (https://www.ebi.ac.uk/metabolights/MTBLS142). Design Type(s)mass spectrometry data transformation objective • mass spectrometry data analysis objective • data integration objectiveMeasurement Type(s)mass spectrumTechnology Type(s)liquid chromatography-tandem mass spectrometryFactor Type(s)Sample Characteristic(s)Strychnos usambarensis • Picralima nitida • Geissospermum laeve • Pleiocarpa mutica • Alstonia • Callichilia inaequalis • Chimarris cymosa • Mostuea brunonis • Gonioma • Cinchona • Catharanthus roseus • Voacanga grandifolia Machine-accessible metadata file describing the reported data (ISA-Tab format) |
| Databáze: | OpenAIRE |
| Externí odkaz: |
|