Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography-High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics

Jean Luc Wolfender; Jean Marc Nuzillard; Justin J.J. Van Der Hooft; Jean Hugues Renault; Samuel Bertrand

doi:10.1021/acs.analchem.8b05112

Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography-High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics

Jean Luc Wolfender^*, Jean Marc Nuzillard, Justin J.J. Van Der Hooft, Jean Hugues Renault, Samuel Bertrand

^*Corresponding author for this work

Bioinformatics

Research output: Contribution to journal › Article › Academic › peer-review

167 Citations (Scopus)

Original language	English
Pages (from-to)	704-742
Journal	Analytical Chemistry
Volume	91
Issue number	1
DOIs	https://doi.org/10.1021/acs.analchem.8b05112
Publication status	Published - 2 Jan 2019

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10.1021/acs.analchem.8b05112

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Wolfender, J. L., Nuzillard, J. M., Van Der Hooft, J. J. J., Renault, J. H., & Bertrand, S. (2019). Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography-High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics. Analytical Chemistry, 91(1), 704-742. https://doi.org/10.1021/acs.analchem.8b05112

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author = "Wolfender, {Jean Luc} and Nuzillard, {Jean Marc} and {Van Der Hooft}, {Justin J.J.} and Renault, {Jean Hugues} and Samuel Bertrand",

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Wolfender, JL, Nuzillard, JM, Van Der Hooft, JJJ, Renault, JH & Bertrand, S 2019, 'Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography-High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics', Analytical Chemistry, vol. 91, no. 1, pp. 704-742. https://doi.org/10.1021/acs.analchem.8b05112

Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography-High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics. / Wolfender, Jean Luc; Nuzillard, Jean Marc; Van Der Hooft, Justin J.J. et al.
In: Analytical Chemistry, Vol. 91, No. 1, 02.01.2019, p. 704-742.

Research output: Contribution to journal › Article › Academic › peer-review

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T1 - Accelerating Metabolite Identification in Natural Product Research

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AU - Wolfender, Jean Luc

AU - Nuzillard, Jean Marc

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AU - Renault, Jean Hugues

AU - Bertrand, Samuel

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DO - 10.1021/acs.analchem.8b05112

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Wolfender JL, Nuzillard JM, Van Der Hooft JJJ, Renault JH, Bertrand S. Accelerating Metabolite Identification in Natural Product Research: Toward an Ideal Combination of Liquid Chromatography-High-Resolution Tandem Mass Spectrometry and NMR Profiling, in Silico Databases, and Chemometrics. Analytical Chemistry. 2019 Jan 2;91(1):704-742. doi: 10.1021/acs.analchem.8b05112