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. 2021 Sep 18;11(9):638. doi: 10.3390/metabo11090638

Table 1.

Accuracy of all potential QIs for discrimination of TTC ≤ 1 h and 2 h in validation samples of healthy volunteers.

Potential QIs Median Opt. Cutoff Specificity n+/n > 1 h Sensitivity 1-(n-/n) < 1 h Median Opt. Cutoff Specificity n+/n > 2 h Sensitivity 1-(n-/n) < 2 h
Purines and Pyrimidines in serum of validation sample 1
Guanosine # 0.50 µmol/L 100% 80% 0.28 µmol/L 100% 83%
Hypoxanthine 32 µmol/L 75% 83% 37 µmol/L 86% 80%
Xanthine 1.5 µmol/L 75% 67% 1.6 µmol/L 80% 67%
Inosine # 1.25 µmol/L 86% 75% 1.13 µmol/L 100% 67%
Dihydroorotic acid 32 µmol/L 83% 75% 38 µmol/L 94% 75%
XG-ratio 0.61 80% 80% 0.93 89% 75%
HI-ratio 1.41 83% 86% 1.57 78% 100%
HG-ratio 2.06 100% 80% 2.25 88% 75%
XI-ratio 0.14 78% 83% 0.24 73% 100%
Eicosanoids in serum of validation sample 1
Tetranor-12(S)-HETE - - - 0.45 ng/mL 88% 90%
12(S)-HEPE - - - 8.17 ng/mL 100% 100%
(±)13-HODE - - - 6.83 ng/mL 83% 100%
(±)9-HODE - - - 5.31 ng/mL 62% 67%
15(S)-HETE - - - 3.36 ng/mL 100% 100%
11-HETE - - - 3.84 ng/mL 86% 75%
8(S)-HETE - - - 2.22 ng/mL 100% 100%
12-HETE - - - 15.14 ng/mL 100% 100%
5-HETE - - - 2.63 ng/mL 60% 60%
12-oxo-ETE - - - 2.62 ng/mL 100% 100%
Amino acids in serum of validation sample 2
Arginine # 86.15 µmol/L 64% 67% 83.4 µmol/L 70% 65%
Ornithine 91.24 µmol/L 67% 69% 106.31 µmol/L 74% 67%
OA-ratio 0.01 78% 77% 0.05 75% 75%
Purines and Pyrimidines in EDTA plasma of validation sample 1
Hypoxanthine 12 µmol/L 50% 71% 11.5 µmol/L 80% 75%
Inosine # 0.5 µmol/L 100% 33% 0.5 µmol/L 89% 0%
Dihydroorotic acid 12.2 µmol/L 50% 75% 12.65 µmol/L 67% 71%
HI-ratio 1.54 40% 75% 1.51 67% 80%
Eicosanoids in EDTA plasma of validation sample 1
(±)13-HODE - - - 5.45 ng/mL 78% 67%
(±)9-HODE - - - 2.49 ng/mL 88% 67%
5-HETE - - - 0.41 ng/mL 67% 50%
Amino acids in EDTA plasma of validation sample 2
Arginine # 51.24 µmol/L 73% 69% 46.62 µmol/L 75% 65%
Ornithine 87.94 µmol/L 71% 67% 110.38 µmol/L 88% 67%
OA-ratio 0.23 85% 73% 0.3 78% 83%

The table displays the calculated median optimal cutoffs for all identified potential QIs in validation sample 1 and 2 in serum and EDTA plasma. # Cutoff values for arginine, inosine and guanosine (concentration decreases over time) are calculated for a TTC ≥ 1 or 2 h, respectively. QIs with the highest sensitivity and specificity are highlighted in bold.