Easy Structural Dereplication of Natural Products by Means of Predicted Carbon‐13 Nuclear Magnetic Resonance Spectroscopy Data**
Author:
Affiliation:
1. Institute of Computer Science University of Tartu Narva mnt 18 51009 Tartu Estonia
2. School of Computer Science and Informatics De Montfort University Leicester UK
3. CNRS, Université de Reims Champagne-Ardenne, ICMR Reims France
Funder
Centre National de la Recherche Scientifique
Publisher
Wiley
Subject
Materials Science (miscellaneous)
Link
https://onlinelibrary.wiley.com/doi/pdf/10.1002/cmtd.202200054
Reference17 articles.
1. Dereplication strategies in natural product research: How many tools and methodologies behind the same concept?
2. Identification of Natural Metabolites in Mixture: A Pattern Recognition Strategy Based on 13C NMR
3. Taxonomy-Focused Natural Product Databases for Carbon-13 NMR-Based Dereplication
4. The LOTUS initiative for open knowledge management in natural products research
5. Facilitating quality control for spectra assignments of small organic molecules: nmrshiftdb2 - a free in-house NMR database with integrated LIMS for academic service laboratories
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1. Natural Products Dereplication: Databases and Analytical Methods;Progress in the Chemistry of Organic Natural Products;2024
2. Twenty years of nmrshiftdb2: A case study of an open database for analytical chemistry;Magnetic Resonance in Chemistry;2023-12-19
3. Use of carbon‐13 NMR to identify known natural products by querying a nuclear magnetic resonance database—An assessment;Magnetic Resonance in Chemistry;2023-08-15
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