Machine learning models to predict the bioaccessibility of parent and substituted polycyclic aromatic hydrocarbons (PAHs) in food: Impact on accurate health risk assessment.

Journal: Journal of hazardous materials
PMID:

Abstract

Food intake is the primary pathway for polycyclic aromatic hydrocarbons (PAHs) to enter the human body. Once ingested, PAHs tend to accumulate, posing health risks. To accurately assess the risk of PAHs from food, concentrations of 10 parent PAHs (PPAHs) and 15 substituted PAHs (SPAHs) were detected across 34 commonly consumed foods. Results indicated that SPAHs concentrations (3.89-11.6 ng/g dw) were higher than PPAH concentrations (1.66-3.43 ng/g dw) in shrimp and shellfish and freshwater fish. Four machine learning algorithms were used to predict the bioaccessibility of PAHs in foods, with the random forest model performing the best (R =0.987, RMSE=5.99). Feature variable importance analysis revealed that lipid and protein contents in food are critical variables influencing PAH bioaccessibility. Subsequently, the bioaccessibility of 25 PAHs in various foods was predicted to explore its impact on health risk assessment. Consequently, the carcinogenic risks considering bioaccessibility (5.62 ×10-7.12 ×10) was about an order of magnitude lower than that ignoring bioaccessibility (1.52 ×10-1.69 ×10), yet it still exceeded 10, indicating potential carcinogenic risks. Although PPAHs and alkylated PAHs were predominant in foods, 6-nitrochrysene was the main compound inducing both non-carcinogenic and carcinogenic risks owing to its high toxicity. This study developed a novel method for assessing pollutant bioaccessibility and evaluating its impact on health risk assessment, which provides a valuable model for managing massive hazardous pollutants and is essential for improving the accuracy of health risk assessment.

Authors

  • Xiao Zhang
    Merck & Co., Inc., Rahway, NJ, USA.
  • Xiaolei Wang
    Ministry of Education Key Laboratory of Pollution Processes and Environmental Criteria, Tianjin Key Laboratory of Environmental Remediation and Pollution Control, College of Environmental Science and Engineering of Nankai University, Tianjin 300350, China.
  • Fei Wu
    Zhejiang University, 38 Zheda Road, Hangzhou 310058, Zhejiang, China.
  • Weigang Liang
    State Key Laboratory of Environmental Criteria and Risk Assessment, Chinese Research Academy of Environmental Sciences, Beijing 100012, China.
  • Sixian Wang
    Institute of Eco-Environmental and Soil Sciences, Guangdong Academy of Sciences, Guangzhou 510650, China.
  • Jinglin Liang
    Institute of Eco-Environmental and Soil Sciences, Guangdong Academy of Sciences, Guangzhou 510650, China.
  • Xiaoli Zhao
    College of Pharmacy, Nanjing University of Chinese Medicine, Nanjing, PR China. Electronic address: xlee_zhao@njucm.edu.com.
  • Fengchang Wu
    State Key Laboratory of Environmental Criteria and Risk Assessment, Chinese Research Academy of Environmental Sciences, Beijing 100012, P. R. China.