Autor segons l'article: Fox Ramos AE, Le Pogam P, Fox Alcover C, Otogo N'Nang E, Cauchie G, Hazni H, Awang K, Bréard D, Echavarren AM, Frédérich M, Gaslonde T, Girardot M, Grougnet R, Kirillova MS, Kritsanida M, Lémus C, Le Ray AM, Lewin G, Litaudon M, Mambu L, Michel S, Miloserdov FM, Muratore ME, Richomme-Peniguel P, Roussi F, Evanno L, Poupon E, Champy P, Beniddir MA
Departament: Química Analítica i Química Orgànica
Autor/s de la URV: ECHAVARREN PABLOS, ANTONIO
Paraules clau: Step Molecular networking Catharanthus-roseus
Resum: 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 ).
Àrees temàtiques: Zootecnia / recursos pesqueiros Statistics, probability and uncertainty Statistics and probability Multidisciplinary sciences Library and information sciences Information systems Education Computer science applications Ciencias sociales Ciências ambientais Biotecnología Biodiversidade
Accès a la llicència d'ús: https://creativecommons.org/licenses/by/3.0/es/
ISSN: 20524463
Adreça de correu electrònic de l'autor: antoniomaria.echavarren@urv.cat
Identificador de l'autor: 0000-0002-6418-7930
Data d'alta del registre: 2022-07-23
Versió de l'article dipositat: info:eu-repo/semantics/publishedVersion
Enllaç font original: https://www.nature.com/articles/s41597-019-0028-3
Referència a l'article segons font original: Scientific Data. 6 (1): 15-15
Referència de l'ítem segons les normes APA: Fox Ramos AE, Le Pogam P, Fox Alcover C, Otogo N'Nang E, Cauchie G, Hazni H, Awang K, Bréard D, Echavarren AM, Frédérich M, Gaslonde T, Girardot M, Gr (2019). Collected mass spectrometry data on monoterpene indole alkaloids from natural product chemistry research. Scientific Data, 6(1), 15-15. DOI: 10.1038/s41597-019-0028-3
URL Document de llicència: https://repositori.urv.cat/ca/proteccio-de-dades/
DOI de l'article: 10.1038/s41597-019-0028-3
Entitat: Universitat Rovira i Virgili
Any de publicació de la revista: 2019
Tipus de publicació: Journal Publications