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Collected mass spectrometry data on monoterpene indole alkaloids from natural product chemistry research

Fox Ramos AE 1 , Le Pogam P 1 , Fox Alcover C 1 , Otogo N'Nang E 1 , Cauchie G 1 , Hazni H 1 Show all authors , Awang K 2 , Bréard D 3 , Echavarren AM 4 , Frédérich M 5 , Gaslonde T 6 , Girardot M 7 , Grougnet R 6 , Kirillova MS 4 , Kritsanida M 6 , Lémus C 6 , Le Ray AM 3 , Lewin G 1 , Litaudon M 8 , Mambu L 9 , Michel S 6 , Miloserdov FM 4 , Muratore ME 4 , Richomme-Peniguel P 3 , Roussi F 8 , Evanno L 1 , Poupon E 1 , Champy P 1 , Beniddir MA 10

Affiliations 

  • 1 Équipe "Pharmacognosie-Chimie des Substances Naturelles" BioCIS, Univ. Paris-Sud, CNRS, Université Paris-Saclay, 5 Rue J.-B. Clément, 92290, Châtenay-Malabry, France
  • 2 Centre for Natural Products and Drug Discovery, University of Malaya, Jalan Universiti, 50603 Kuala Lumpur, Wilayah Persekutuan, Kuala Lumpur, Malaysia
  • 3 EA921, SONAS, SFR QUASAV, UBL/Angers University, Campus du végétal, 42 rue Georges Morel, 49070, Beaucouzé, France
  • 4 Institute of Chemical Research of Catalonia (ICIQ), Barcelona Institute of Science and Technology, Avenue Països Catalans 16, 43007, Tarragona, Spain
  • 5 Laboratory of Pharmacognosy, CIRM, University of Liège, Quartier Hopital, 15 Avenue Hippocrate, Sart Tilman, 4000, Liège, Belgium
  • 6 Laboratoire de Pharmacognosie, UMR/CNRS 8638 COMETE, Faculté de Pharmacie de Paris, Université Paris Descartes, Sorbonne Paris Cité, 4 Avenue de l'Observatoire, 75006, Paris, France
  • 7 Laboratoire Écologie et Biologie des Interactions, Équipe Microbiologie de l'Eau, UMR CNRS 7267, Université de Poitiers, 5 rue Albert Turpain, 86073, Poitiers CEDEX 09, France
  • 8 Institut de Chimie des Substances Naturelles, CNRS-ICSN, UPR 2301, Université Paris-Saclay, 1 Avenue de la Terrasse, 91198, Gif-sur-Yvette, France
  • 9 Département de Pharmacognosie, Laboratoire PEIRENE-EA 7500, Faculté de Pharmacie, Université de Limoges, 2 rue du Dr Marcland, 87025, Limoges CEDEX, France
  • 10 Équipe "Pharmacognosie-Chimie des Substances Naturelles" BioCIS, Univ. Paris-Sud, CNRS, Université Paris-Saclay, 5 Rue J.-B. Clément, 92290, Châtenay-Malabry, France. [email protected]
Sci Data, 2019 04 03;6(1):15.
PMID: 30944327 DOI: 10.1038/s41597-019-0028-3

Abstract

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 ).

* Title and MeSH Headings from MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.

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