Metabolomics-based biomarker analysis of dihydroxypropyl mercapturic acid isomers from 3-monochloropropane-1,2-diol and glycidol for evaluation of toxicokinetics in rats and daily internal exposure in humans

Wei Jia, Di Wu, Xinyu Chen, Lei Mao, Hong Miao, Dawei Chen, Yiping Ren, Yu Zhang*

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

10 Citations (Scopus)

Abstract

3-Monochloropropane-1,2-diol (3-MCPD), glycidol, and their esters are some major sources of risk factors during food processing. Here we showed the biomarker analysis of 2,3-dihydroxypropyl mercapturic acid (DHPMA) isomers which derived from the metabolism of 3-MCPD, glycidol, and their esters in urine of rats and humans. Iso-DHPMA, a novel urinary metabolite, was discovered and detected in urine of rats, which were orally administered with glycidol but not 3-MCPD. Using the quadrupole-orbitrap high-resolution mass spectrometry, we confirmed that iso-DHPMA appeared a specific biomarker which derived from glycidol. The limit of quantification (signal-to-noise ratio, 10:1) of the analytes in urine of rats and humans were 1.33 ng/mL and 1.56 ng/mL, respectively. Acceptable within-laboratory reproducibility (RSD<9.0%) and spiking recovery (94.7%–100.1%) substantially supported the use of current method for robust biomarker analysis, which was successfully applied to the toxicokinetic study of DHPMA in rats and short-term internal exposure to 3-MCPD and glycidol in humans.

Original languageEnglish
Pages (from-to)329-336
Number of pages8
JournalTalanta
Volume204
Early online date12 Jun 2019
DOIs
Publication statusPublished - 01 Nov 2019
Externally publishedYes

Bibliographical note

Funding Information:
We thank Waters Corporation for their technical support of mass spectrometry instrumentation. This work was financially supported by the National Key Research and Development Program of China (Grant No. 2017YFC1600500 ), National Natural Science Foundation of China (Grant No. 21677043 ) and China National Program for Support of Top-notch Young Professionals.

Publisher Copyright:
© 2019 Elsevier B.V.

Keywords

  • 2,3-Dihydroxypropyl mercapturic acid
  • 3-Monochloropropane-1,2-diol
  • Glycidol
  • Internal exposure
  • Isomers
  • Toxicokinetics

ASJC Scopus subject areas

  • Analytical Chemistry

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