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. 2025 Feb 25;59(9):4364–4375. doi: 10.1021/acs.est.4c13902

Table 5. Identified Metabolites Associated with Lipophilic POP Mixtures in the Teen-LABS Cohort, 2007-2012a.

            overall effectb partial effectsc
group metabolites m/z RT column ψ (95% CI) p-value p,p′-DDE p,p′-DDT HCB PCB118 PCB153 PBDE47
lipid palmitoleate 253.2173 335.12 C18- –0.682 (−1.134, −0.229) 0.005 –0.238 0.013 –0.241 0.150 –0.309 –0.056
lipid [C18.4]-stearidonic acid 275.2017 304.52 C18- –0.873 (−1.336, −0.409) 0.001 –0.163 –0.075 –0.185 0.019 –0.274 –0.194
lipid [C18.2]-11-octadecen-9-ynoic acid 277.2173 323.27 C18- –0.713 (−1.177, −0.249) 0.004 –0.355 0.208 –0.325 –0.038 –0.197 –0.007
lipid [C20.4]-arachidonic acid 303.2329 340.71 C18- –0.793 (−1.277, −0.308) 0.002 –0.208 –0.108 –0.233 0.077 –0.146 –0.174
amino acid histidine 154.0623 18.53 C18- –0.689 (−1.139, −0.239) 0.004 –0.464 0.309 –0.307 –0.195 0.081 –0.113
amino acid acetoacetate 101.0242 173.66 HILIC- –0.779 (−1.26, −0.298) 0.003 –0.319 –0.029 –0.229 –0.048 0.011 –0.164
amino acid 3-hydroxyanthranilate 152.0351 126.77 HILIC- –0.663 (−1.146, −0.18) 0.010 –0.073 –0.123 –0.234 0.005 –0.162 –0.076
amino acid asparagine 133.0608 294.41 HILIC+ –0.671 (−1.109, −0.233) 0.004 –0.252 –0.148 –0.191 0.272 –0.281 –0.071
amino acid indole-3-acetate 176.0706 74.06 HILIC+ –0.729 (−1.234, −0.223) 0.007 –0.150 –0.192 –0.210 0.156 –0.204 –0.130
nucleotide derivatives hypoxanthine 137.0458 148.33 HILIC+ –0.699 (−1.163, −0.235) 0.005 –0.034 –0.124 –0.186 –0.010 –0.094 –0.252
nucleotide derivatives inosine 269.0882 183.31 HILIC+ –0.700 (−1.192, −0.208) 0.007 –0.162 –0.270 –0.216 0.004 –0.022 –0.033
others NN-dimethylarginine 203.1503 367.35 HILIC+ –0.614 (−1.054, −0.175) 0.008 –0.217 –0.093 –0.109 0.022 –0.237 0.021
a

Note: Models were adjusted for race/ethnicity (non-Hispanic white, others), age at baseline (continuous), patient’s sex (male, female), parents’ annual income (<$25,000, $25,000 to $74,999, ≥75,000, unknown), and BMI at the baseline (continuous).

b

Overall effect of the lipophilic POP mixture on adipose tissue metabolome was estimated by quantile g-computation. Estimates are interpreted as the overall mixture effect on the log2 intensity of a maternal metabolite for a simultaneous quartile increase in each POPs.

c

Partial effects were the estimates of each POP relative to the overall effect of POP mixtures either in the positive direction or the negative direction. Abbreviation: m/z, mass-to-charge ratio; RT, retention time; POP, persistent organic pollutant; p,p′-DDE, dichlorodiphenyldichloroethylene; p,p′-DDT, dichlorodiphenyltrichloroethane; HCB, hexachlorobenzene; PCB, polychlorinated biphenyls; PBDE, polybrominated diphenyl ethers; and HILIC, hydrophilic interaction liquid chromatography.