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Angew Chem Int Ed Engl. 2019 Aug 9. doi: 10.1002/anie.201908006. [Epub ahead of print]

Fast and Quantitative NMR Metabolite Analysis Afforded by a Paramagnetic Co-Solute.

Author information

1
Interdisciplinary Nanoscience Center (iNANO) and Department of Chemistry, Aarhus University, Gustav Wieds Vej 14, 8000, Aarhus C, Denmark.
2
Magnetic Resonance Center (CERM), University of Florence, Via L. Sacconi 6, 50019, Sesto Fiorentino (FI), Italy.
3
Department of Experimental and Clinical Medicine, Largo Brambilla 3, 50134, Firenze (FI), Italy.
4
Department of Chemistry Ugo Schiff, University of Florence, Via della Lastruccia 3, 50019, Sesto Fiorentino (FI), Italy.

Abstract

NMR spectroscopy is an indispensable technique for the determination of the chemical identity and structure of small molecules. The method is especially recognized for its robustness and intrinsically quantitative nature, and has manifested itself as a key analytical platform for diverse fields of application, ranging from chemical synthesis to metabolomics. Unfortunately, the slow recovery of nuclear spin polarization by spin-lattice (T1 ) relaxation causes most experimental time to be lost on idle waiting. Furthermore, truly quantitative NMR (qNMR) spectroscopy requires waiting times of 5-times the longest T1 in the sample, making qNMR spectroscopy slow and inefficient. We demonstrate here that co-solute paramagnetic relaxation can mitigate these two problems simultaneously. The addition of a small amount of paramagnetic gadolinium chelate, available in the form of commercial contrast-agent solutions, enables cheap, quantitative, and efficient high-throughput mixture analysis.

KEYWORDS:

NMR spectroscopy; analytical chemistry; co-solute paramagnetic relaxation enhancement; gadolinium chelate; metabolomics

PMID:
31398278
DOI:
10.1002/anie.201908006

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