Data for (Study ST002459)
(Analysis AN004012)Values for each metabolite have been scaled by dividing by the mean across all factors Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study| Metabolite | F1 | F2 | F3 | F4 | F5 | F6 | F7 |
|---|---|---|---|---|---|---|---|
| 10-Hydroxydecanoic acid | 0.0719 | 0.1812 | 0.1398 | 1.1439 | 1.2289 | 0.1837 | 1.1626 |
| 11-beta-hydroxyandrosterone | NA | NA | NA | 2.8014 | 0.9785 | 0.2854 | 1.0890 |
| 12,13-DiHOME | NA | NA | NA | 0.8536 | 0.8274 | 1.0979 | 0.9910 |
| 12,13-EpOME / 9,10-EpOME | 0.2770 | 0.3007 | 0.3691 | 0.8728 | 1.5605 | 0.4141 | 1.1600 |
| 13(S)-HODE | NA | NA | NA | 0.7858 | 1.3890 | 0.0705 | 1.6159 |
| 17beta-dihydroepiandrosterone sulphate | NA | NA | NA | 0.8275 | 0.6805 | 1.2812 | 1.0991 |
| 18:0-18:2 PC (1-stearoyl-2-linoleoyl-sn-glycero-3-phosphocholine) | 0.0070 | 0.0253 | 0.0108 | 1.0350 | 0.9957 | 1.0548 | 1.0467 |
| 18:1-18:1 SM | NA | 0.0052 | 0.0019 | 1.0414 | 1.1836 | 0.8348 | 1.0039 |
| 18:2 (Cis) PC (1,2-dilinoleoyl-sn-glycero-3-phosphocholine_DLPC) | 0.0017 | NA | NA | 1.0273 | 0.5793 | 1.4419 | 0.9876 |
| 18:2 PE (1,2-dilinoleoyl-sn-glycero-3-phosphoethanolamine) | NA | NA | NA | 0.6503 | 0.8613 | 0.7863 | 1.4699 |
| 1-Arachidonoylglycerol | NA | NA | NA | 1.0838 | 0.8194 | 0.9704 | 1.1807 |
| 1H,1H,2H,2H-Perfluorooctane sulfonate | 3.5334 | 3.0982 | 4.3817 | 1.2586 | 0.7909 | 0.9414 | 0.8799 |
| 1-Hydroxy-2-Naphthoic acid | NA | NA | NA | NA | NA | 1.1665 | 0.7502 |
| 1-Linoleoylglycerol_2 | NA | NA | NA | 0.6106 | 0.8084 | 0.5112 | 1.5870 |
| 1-Oleoyl Lysophosphatidic Acid | 0.1104 | 0.1306 | 0.0943 | 1.1921 | 1.1404 | 0.3912 | 1.4501 |
| 21-Hydroxypregnenolone | NA | NA | NA | 0.8805 | 1.1590 | 0.1675 | 1.0541 |
| 2,2^,4,4^-tetrahydroxybenzophenone | NA | NA | NA | 0.6364 | 0.6187 | 1.3887 | 1.1157 |
| 2,4,6-Trichlorophenol | NA | NA | NA | NA | 0.6232 | NA | 1.0685 |
| 2-Hydroxybutyric acid | 0.0685 | 0.1110 | 0.1622 | 1.2694 | 0.7816 | 1.1383 | 1.0838 |
| 2-Undecanone | NA | 0.4624 | 0.3304 | 0.9627 | 1.1110 | 0.4474 | 1.0390 |
| 3,4-Dihydrox benzoic acid | 0.1222 | 0.3034 | 1.5391 | 1.0363 | 0.5584 | 1.2990 | 1.1736 |
| 3,5,6-Trichloro-2-pyridinol | NA | NA | NA | 1.2874 | 0.8116 | 1.1171 | 0.9391 |
| 3-hydroxyanthranilic acid | NA | NA | NA | 0.9145 | 1.6493 | 0.1527 | 1.1183 |
| 3-Hydroxybenzoic acid | NA | NA | NA | 3.3134 | 0.8071 | 0.5547 | 0.8243 |
| 3-Hydroxybutyric acid | 0.0580 | 0.4383 | 0.2949 | 1.1244 | 1.0496 | 0.9085 | 1.0799 |
| 3-Methoxy-4-Hydroxymandelic acid | NA | NA | NA | NA | 0.5967 | 0.7451 | 1.5489 |
| 3-Methoxytyramine | 0.9610 | 0.8030 | 0.8575 | 1.0150 | 1.0072 | 1.0143 | 0.9872 |
| 3-Methyl-2-Oxovaleric acid | NA | NA | NA | 1.3475 | 0.5291 | 1.4865 | 0.8622 |
| 4-Aminobenzoic acid / Anthranilic acid | NA | NA | NA | 0.7931 | 1.0211 | 0.1159 | 1.1172 |
| 4-Hydroxybenzoic acid | NA | NA | NA | 0.6734 | 1.2063 | 0.4192 | 0.8802 |
| 4-Hydroxybenzophenone | 0.5001 | 0.5990 | 0.7053 | 0.8631 | 1.0555 | 1.0909 | 0.9460 |
| 4-(Methlynitrosamino)-1-(3-pyridyl)-1-butanol | NA | NA | NA | 1.0127 | 1.3817 | 0.8029 | 0.8110 |
| 4-methylcatechol | NA | 0.4656 | 2.3479 | 0.9918 | 0.8577 | 0.3219 | 1.1984 |
| 4-Nitrophenol | 0.6117 | 0.1853 | 0.3551 | 1.0583 | 0.7245 | 0.5296 | 1.7677 |
| 5alpha-androstan-3alpha, 17beta-diol 3-glucosiduronate | NA | NA | NA | 0.7227 | 1.4761 | 0.3518 | 1.0358 |
| 5beta-Pregnane-3alpha,20alpha-diol glucuronide | NA | NA | NA | 1.1874 | 0.6280 | 1.2477 | 0.9202 |
| 5-Hydroxyindoleacetic acid | NA | NA | NA | 1.3319 | 0.9764 | 0.7150 | 1.1917 |
| 6-Carboxyhexanoic acid | NA | NA | NA | 1.0381 | 0.7599 | 0.3498 | 1.2159 |
| 9,10-DiHOME | NA | NA | NA | 0.8896 | 1.0223 | 0.9974 | 1.0192 |
| 9S-HODE | NA | NA | NA | 0.9075 | 1.3539 | 0.0759 | 1.6027 |
| 9S-HpODE/ 13S-HpODE | NA | NA | NA | 0.1342 | 1.8366 | 0.0959 | 1.3722 |
| Adipic acid / 3-Methylglutaric acid | 0.4918 | 0.3982 | 0.6260 | NA | 0.8073 | 0.1239 | 1.3001 |
| Adrenic Acid | NA | NA | NA | 0.8114 | 0.5078 | 0.9998 | 1.5587 |
| Alpha- linolenic acid / Gamma-Linolenic acid | NA | NA | NA | 0.9070 | 0.4909 | 1.5783 | 0.9635 |
| Alpha-Tocotrienol | NA | NA | NA | 0.2661 | 0.4203 | 0.0629 | 1.3437 |
| Androsterone glucuronide / Etiocholanolone glucuronide | NA | NA | NA | 1.2543 | 0.5248 | 1.4225 | 0.9632 |
| Arachidic acid | 0.2915 | 1.6897 | 0.6153 | 0.9739 | 1.7684 | 0.4865 | 0.7692 |
| Arachidonic Acid | NA | 0.0016 | NA | 0.9346 | 0.6530 | 0.5713 | 1.8172 |
| Arachidonoyl PAF C-16 | NA | 0.0278 | 0.0134 | 1.0341 | 0.7102 | 1.3954 | 0.9134 |
| Azelaic acid | 0.3183 | 0.1972 | 0.2881 | 1.4491 | 1.0468 | 0.2284 | 1.6482 |
| Behenic acid | 0.0788 | 1.8894 | 0.0933 | 0.9286 | 2.5223 | 0.0839 | 0.1483 |
| Bilirubin | NA | NA | NA | 0.5875 | 0.0339 | 2.4353 | 0.0807 |
| Bisphenol A | NA | NA | NA | NA | NA | NA | 1.0000 |
| Bisphenol F | NA | NA | NA | 0.3199 | 0.7057 | 2.0680 | 1.4760 |
| Bisphenol S | NA | NA | NA | 0.1690 | 4.3324 | 5.3647 | 2.8637 |
| Butyl Paraben | 0.8499 | 0.7636 | 1.1135 | 0.9823 | 0.8761 | 1.1648 | 1.0120 |
| C16 Sphingomyelin (d18:1/16:0) | 0.0016 | 0.0045 | 0.0023 | 1.2014 | 1.1582 | 0.8781 | 1.0037 |
| Caprylic acid | 0.0633 | 0.0913 | 0.0760 | 1.3299 | 1.3374 | 0.1384 | 1.5107 |
| Ceramide d18:1/16:0 | NA | NA | NA | 0.6596 | 1.0156 | 0.8616 | 1.2425 |
| Ceramide d18:1/18:1 (9z) | NA | NA | NA | 0.8290 | 0.9950 | 1.1413 | 0.9239 |
| Chenodeoxycholic acid | 0.2654 | 0.2482 | 0.3122 | 1.1154 | 0.6792 | 1.3470 | 1.0137 |
| Cholesterol | NA | NA | NA | 0.5809 | 0.9832 | 0.5810 | 1.1549 |
| Cholesterol Sulfate | 0.0141 | 0.0158 | 0.0286 | 0.8610 | 0.6844 | 1.4153 | 1.0582 |
| Cholic acid | 0.9088 | 0.8364 | 0.9611 | 1.2569 | 1.0025 | 0.9886 | 0.9294 |
| Cis-Resveratrol | NA | 1.5867 | 0.1730 | 0.4709 | 1.4260 | 0.2395 | 0.3143 |
| cis-Vaccenic Acid / Elaidate/ Oleic acid / Petroselinic acid | 0.0174 | 0.0156 | 0.0214 | 0.9002 | 0.5587 | 1.4711 | 1.1144 |
| Corticosterone / Cortexolone | NA | NA | NA | 1.2119 | 0.8385 | 0.8079 | 1.2791 |
| Cortisol | NA | NA | NA | 0.8422 | 0.4868 | 1.6352 | 0.9336 |
| Cortisone | NA | NA | NA | 0.6816 | 0.6462 | 1.4208 | 1.0127 |
| Cortolone | NA | NA | NA | 1.3835 | 0.8373 | 0.9461 | 1.0817 |
| cx-MiDP (MCNP) (Mono(2,7-dimethyl-7-carboxyheptyl) phthalate) | NA | NA | NA | 0.3503 | 2.3768 | 8.4416 | 0.5445 |
| cx-MiNP (MCOP) (Mono(2,6-dimethyl-6-carboxyhexyl) phthalate) | NA | NA | NA | 1.2321 | 1.1980 | 0.8576 | 0.2266 |
| Dehydroepiandrosterone Sulfate | 0.0007 | 0.0058 | 0.0009 | 0.8270 | 0.4927 | 1.6444 | 1.0345 |
| Deoxycholic acid | NA | NA | NA | 1.1763 | 0.5161 | 1.4999 | 0.9313 |
| Dibenzyl phosphate (DBZP) | NA | NA | NA | NA | NA | 1.3764 | 0.6236 |
| Dibutyl phosphate (DBUP) | NA | NA | NA | NA | 0.4820 | 0.3532 | 1.7927 |
| Didecanoyl-Glycerophosphocholine | NA | NA | NA | 0.8889 | 0.5985 | 1.3820 | 1.0586 |
| Diethylphosphate (DEP) | 0.2898 | 0.2875 | 0.1984 | 1.2173 | 0.8626 | 1.1834 | 0.9599 |
| Diethylthiophosphate (DETP) | NA | NA | NA | 0.8352 | 0.4820 | 1.2417 | 0.9972 |
| Dihomo-Gamma-Linolenic acid | NA | NA | NA | 0.8393 | 0.6215 | 0.9767 | 1.4584 |
| Dimethylphosphate (DMP) | NA | NA | NA | 1.0350 | 1.1011 | 0.8330 | 1.0536 |
| Dipalmitoyl-Phosphoethanolamine | NA | NA | NA | 0.4955 | 1.3240 | 0.5350 | 1.3186 |
| Di-p-cresylphosphate | NA | NA | NA | NA | 1.1486 | NA | 0.9009 |
| Docosahexaenoic acid | NA | NA | NA | 0.8053 | 0.4321 | 1.4853 | 1.1511 |
| Docosahexaenoyl PAF C-16 | NA | NA | NA | 0.9687 | 0.9241 | 1.0627 | 1.0243 |
| Docosapentaenoic Acid | NA | NA | NA | 0.8940 | 0.5342 | 1.0632 | 1.4399 |
| Dodecanedioic acid | 0.2351 | 0.3534 | 0.5657 | 1.3807 | 0.9246 | 0.5534 | 1.4564 |
| Eicosapentaenoic acid | 0.0485 | 0.0622 | 0.0529 | 0.9303 | 0.6479 | 0.8655 | 1.6161 |
| Eicosapentaenoyl PAF C-16 | NA | 0.0258 | 0.0132 | 1.0310 | 0.5847 | 1.5569 | 0.9018 |
| Epipregnanolone sulphate / Epiallopregnanolone sulfate | NA | NA | NA | 0.4817 | 0.6643 | 1.6360 | 0.9185 |
| Erucic acid | NA | 0.0987 | 1.1164 | 0.8242 | 0.3226 | 0.2904 | 2.4612 |
| Estriol 16alpha-(beta-D-glucuronide) | NA | NA | NA | 0.7521 | 1.3044 | 0.2613 | 1.5216 |
| Estrone sulfate | NA | NA | NA | 0.5899 | 0.6333 | 1.3796 | 0.8737 |
| Ethyl glucuronide | 0.0338 | 0.0706 | 0.2132 | 1.0995 | 0.8404 | 1.2028 | 1.0721 |
| Ethyl Paraben | 0.4189 | 0.2454 | 0.3170 | 0.7880 | 0.8786 | 1.2529 | 0.9715 |
| Ethyl sulfate | 4.6822 | 2.9985 | 4.7228 | NA | 0.2373 | 0.0303 | 0.0438 |
| Glycochenodeoxycholic acid | NA | NA | NA | 1.2941 | 0.4663 | 1.5188 | 0.8916 |
| Glycocholic acid | NA | NA | NA | 1.4967 | 0.4911 | 1.4881 | 0.8460 |
| Glycodeoxycholic Acid | NA | NA | NA | 1.3000 | 0.4763 | 1.4976 | 0.9164 |
| Glycolithocholic acid | NA | NA | NA | 0.9712 | 0.3258 | 1.6991 | 1.0137 |
| Glycoursodeoxycholic Acid | NA | NA | NA | 1.1408 | 0.4874 | 1.4767 | 0.9318 |
| Heptadecanoic acid | 0.0372 | 0.1329 | 0.0428 | 1.0621 | 1.3282 | 0.6338 | 1.1194 |
| Hexadecanol | 0.0293 | 0.1854 | 0.0435 | 1.0619 | 1.3070 | 0.6300 | 1.1071 |
| Hippuric acid | NA | NA | NA | 0.8105 | 0.7066 | 1.3001 | 0.9873 |
| Homogentisic acid | 0.2185 | 0.9020 | 2.9137 | 1.0463 | 0.6852 | 0.4050 | 1.2576 |
| Hydroxyphenyllactic acid | NA | NA | NA | 1.5882 | 0.7866 | 0.9377 | 1.0366 |
| Hyocholic Acid | 0.5935 | 0.6411 | 0.8391 | 1.2015 | 0.8452 | 1.1528 | 0.9654 |
| Hyodeoxycholic acid / Ursodeoxycholic acid | NA | NA | 0.1357 | 1.1634 | 0.5354 | 1.4056 | 1.0176 |
| Indole-3-Acetic acid | NA | NA | NA | 0.9147 | 0.5958 | 1.2574 | 0.8363 |
| Indole-3-Carboxylic acid | NA | NA | NA | 0.9246 | 1.4429 | 0.4264 | 1.1466 |
| Indole-3-Ethanol | NA | NA | NA | 1.2380 | 0.9581 | 0.8917 | 1.0664 |
| Indoleacetaldehyde | NA | NA | NA | 0.6043 | 1.0743 | 0.5908 | 1.3170 |
| Indoxyl Sulfate | NA | NA | NA | 0.8868 | 0.4965 | 1.5462 | 0.9971 |
| Itaconic acid / 2-Methylmaleic acid | 0.3653 | 0.4941 | 1.1450 | 1.1901 | 0.9831 | 0.7723 | 1.2053 |
| Lauric acid | NA | 0.1005 | NA | 1.0068 | 0.7803 | 1.0581 | 1.1758 |
| Lignoceric Acid | 0.0957 | 0.9766 | 0.1508 | 1.1019 | 2.1662 | 0.3109 | 0.5371 |
| Linoleic acid | 0.0067 | 0.0070 | 0.0067 | 0.9280 | 0.5649 | 1.6368 | 0.9340 |
| Lithocholic acid | NA | NA | NA | 1.0089 | 0.7576 | 1.3545 | 0.8847 |
| Lithocholyltaurine | NA | NA | NA | 1.0646 | 0.6465 | 1.2602 | 1.0706 |
| Lovastatin Hydroxy Acid | 0.6837 | 0.5718 | 0.9004 | 1.3264 | 0.9360 | 0.9765 | 1.0039 |
| LysoPC (14:0) | NA | NA | NA | 0.9162 | 0.5967 | 1.3635 | 1.0692 |
| LysoPC(16:0) | 0.0009 | 0.0020 | 0.0011 | 1.0110 | 0.7753 | 1.2360 | 1.0958 |
| LysoPC (17:0) | NA | NA | NA | 0.8784 | 0.6239 | 1.3901 | 1.0288 |
| LysoPC(18:0) | 0.0010 | 0.0027 | 0.0014 | 0.9740 | 0.6872 | 1.3367 | 1.0962 |
| LysoPC (18:1) | 0.0006 | 0.0008 | 0.0008 | 0.9159 | 0.5926 | 1.5365 | 1.0115 |
| LysoPC(20:0) | NA | NA | NA | 0.7631 | 0.4905 | 1.1688 | 1.4146 |
| LysoPC(22:0) | NA | NA | NA | 0.8925 | 0.7207 | 1.0743 | 1.2428 |
| LysoPC(24:0) | NA | NA | NA | 0.8368 | 0.9543 | 1.1396 | 0.9288 |
| LysoPC(26:0) | NA | NA | NA | 0.9384 | 1.2169 | 0.6131 | 1.1917 |
| LysoPE (16:0) | NA | 0.0029 | 0.0030 | 1.0796 | 0.9676 | 0.4004 | 1.6779 |
| LysoPE (18:0) | NA | NA | NA | 1.0374 | 0.7443 | 0.6689 | 1.5737 |
| LysoPE (18:1) | NA | 0.0027 | NA | 0.9739 | 0.9748 | 0.5092 | 1.5437 |
| Malic acid | 0.0983 | 0.4155 | 0.6893 | 0.7943 | 1.3752 | 0.2679 | 1.4959 |
| Mandelic acid / 3-Hydroxyphenylacetic acid | NA | NA | NA | 1.0589 | 0.6629 | 1.4731 | 0.8433 |
| MBP (Mono-n-butyl phthalate) / MiBP (Mono-isobutyl phthalate) | 0.3095 | 0.3286 | 0.3947 | 0.9858 | 1.7918 | 0.3768 | 0.6581 |
| m-Coumaric acid | NA | NA | NA | 0.3488 | 0.8971 | 0.7226 | 2.5862 |
| MCPP (Mono (3-carboxpropyl) phthalate) | NA | NA | NA | 1.0000 | NA | NA | NA |
| MEHP (Mono-2-ethylhexyl phthalate) | 0.5993 | 0.7463 | 0.7176 | 0.9430 | 1.5094 | 0.6851 | 0.8603 |
| MEP (Mono-ethyl phthalate) | NA | NA | NA | 1.0219 | 1.2436 | 0.7723 | 0.9717 |
| Methyl Paraben | NA | NA | NA | 0.9713 | 0.9898 | 1.4148 | 1.3038 |
| MiNP (Mono-isononyl phthalate) | 2.9407 | 4.3974 | 2.6227 | NA | 0.5837 | 0.7317 | 0.4919 |
| Mono-(2-ethylhexyl) terephthalate | 0.7942 | 0.6771 | 0.7644 | 1.0067 | 1.0246 | 0.9987 | 1.0026 |
| Mono-isodecyl phthalate | NA | NA | NA | NA | 1.9950 | 0.0081 | 0.0020 |
| Myristic acid | 0.1137 | NA | 0.0892 | 0.8561 | 0.7149 | 1.6339 | 0.7515 |
| N-Acetylphenylalanine | NA | NA | NA | 1.0325 | 1.0775 | 0.7195 | 1.1916 |
| N-Acetyl-S-(4-hydroxy-2-buten-1-yl)-L-cysteine | 0.2150 | NA | NA | 1.0864 | 0.7733 | 1.1682 | 0.9057 |
| Naproxen | NA | NA | NA | 0.0809 | 1.8234 | 7.0883 | 2.2134 |
| Nervonic acid | NA | NA | NA | 1.0926 | 1.0129 | 0.7133 | 1.2412 |
| N-Formyl-L-Methionine | NA | NA | NA | 1.0860 | 1.2418 | 0.7736 | 1.0625 |
| N-Palmitoyl Taurine | NA | NA | NA | 0.8537 | 0.7687 | 0.4063 | 1.8765 |
| OH-MiNP (7-OH-(Mono-methyl-octyl) phthalate) | 0.2565 | 2.7736 | 0.2880 | 0.9528 | 1.8427 | 0.4618 | 0.7003 |
| Oleamide | NA | NA | NA | 0.9306 | 1.1108 | 0.0414 | 1.8722 |
| Oleoyl-glycerol | NA | NA | NA | 0.6967 | 1.1011 | 0.7121 | 1.2352 |
| Omega-Hydroxydodecanoic acid | NA | 0.5975 | NA | 0.8716 | 1.2985 | 0.4408 | 1.1891 |
| O-Octadecanoyl L-Carnitine | NA | NA | NA | 0.7669 | 1.1438 | 0.3025 | 1.3082 |
| Oxoadipic acid | 0.1546 | 0.6291 | 4.6117 | 0.8174 | 0.8970 | 0.2001 | 1.7959 |
| Oxoglutaric acid | 0.0042 | 0.0105 | 0.2054 | 1.1457 | 0.7714 | 1.1180 | 1.1439 |
| PAF C-16 | 0.0034 | 0.0045 | 0.0029 | 0.9946 | 0.5972 | 1.5215 | 0.9939 |
| PAF C-18 | NA | NA | NA | 1.1004 | 0.7911 | 0.9126 | 1.2610 |
| Palmitic acid | 0.1179 | 0.2550 | 0.2029 | 1.0447 | 0.7933 | 1.1753 | 1.1054 |
| Palmitoleic acid | 0.0134 | 0.0131 | 0.0093 | 0.9426 | 0.6582 | 1.4926 | 0.9792 |
| Palmitoylcarnitine | NA | NA | NA | 0.8592 | 1.2199 | 0.2810 | 1.5486 |
| Palmitoyl-EA | NA | NA | NA | 0.8979 | 0.8411 | 0.7960 | 1.3988 |
| PC (18:2/0:0) | 0.0004 | 0.0010 | 0.0005 | 0.9690 | 0.5887 | 1.4823 | 1.0510 |
| p-Cresol | NA | NA | NA | 0.7693 | 0.6728 | 1.3269 | 1.0322 |
| p-Cresol glucuronide | NA | NA | NA | 0.7457 | 0.7609 | 1.3058 | 0.9853 |
| p-Cresol sulfate | NA | NA | NA | 0.7749 | 0.6023 | 1.4167 | 1.0603 |
| Pentachlorophenol | NA | NA | NA | 0.7933 | 0.5183 | 1.1915 | 1.3629 |
| Perfluorodecanoic acid | 0.5282 | 0.5738 | 0.5292 | 1.0046 | 1.0023 | 0.9954 | 1.0514 |
| Perfluorododecanoic acid | 0.8433 | 0.7753 | 0.8252 | 0.9779 | 0.9871 | 0.9857 | 1.0556 |
| Perfluoroheptanesulfonic acid | NA | NA | NA | 0.9028 | 0.7411 | 1.3360 | 0.9571 |
| Perfluoroheptanoic acid | 0.1054 | 0.2494 | 0.2220 | 0.9444 | 0.9170 | 0.8688 | 1.3236 |
| Perfluorohexadecanoic acid | 0.6241 | 0.7365 | 0.7689 | 0.8123 | 1.0424 | 1.0316 | 1.0243 |
| Perfluorohexanesulphonic acid (PFHxS) | 0.6344 | 0.5765 | 0.6946 | 0.8428 | 0.9281 | 1.1442 | 1.0236 |
| Perfluorohexanoic acid | NA | 0.2520 | NA | 0.9324 | 0.9174 | 0.8748 | 1.2593 |
| Perfluorononanoic acid | 0.3737 | 0.4924 | 0.4868 | 0.9847 | 1.0042 | 0.9964 | 1.0659 |
| Perfluoro-n-pentanoic acid | NA | NA | NA | 0.9895 | 1.0723 | 0.9156 | 1.0158 |
| Perfluoro-n-tridecanoic acid | NA | NA | NA | 1.0224 | 0.9600 | 0.9572 | 1.0750 |
| Perfluorooctanesulfonic acid | 0.1277 | 0.1451 | 0.1344 | 0.8212 | 0.5840 | 1.5661 | 1.0089 |
| Perfluorooctanesulfonic acid (PFOS) (branched) | NA | NA | NA | 0.8210 | 0.5408 | 1.5309 | 0.9913 |
| Perfluorooctanoic acid | 0.2262 | 0.3546 | 0.3053 | 0.9499 | 1.0202 | 1.0173 | 1.0584 |
| Phenylacetic acid | NA | NA | NA | 1.4336 | 0.7961 | 0.9899 | 1.0501 |
| Phenylacetylglutamine | NA | NA | NA | 1.3426 | 0.6137 | 1.3363 | 0.9295 |
| Phenylglyoxylic acid | 1.1328 | 1.3758 | 2.2099 | 1.2873 | 0.6840 | 1.2388 | 0.9125 |
| Phthalic acid | NA | NA | NA | 0.8465 | 1.0303 | 1.0076 | 1.0334 |
| P-Hydroxyphenylacetic acid / 2-Hydroxyphenylacetic acid | NA | NA | NA | 0.9361 | 0.7211 | 1.4122 | 0.9295 |
| POV-PC | NA | NA | NA | 0.8707 | 1.2280 | 0.3349 | 1.4826 |
| Pregnenolone Sulfate | NA | NA | NA | 0.8201 | 0.4908 | 1.5363 | 1.0362 |
| Protoporphyrin | NA | NA | NA | 0.5300 | 0.6236 | 1.2885 | 0.5762 |
| Salicylic acid | 0.3502 | 0.2370 | 0.1484 | 1.3101 | 0.8452 | 0.6586 | 1.4709 |
| Salsolinol | 0.6498 | 0.5691 | 0.6909 | 1.0511 | 1.0174 | 1.0070 | 0.9980 |
| S-Budesonide | 0.7000 | 0.6995 | 0.7908 | 1.2630 | 0.9194 | 0.9994 | 1.0187 |
| Sebacic acid | 0.2710 | 0.2974 | 0.6221 | 1.3615 | 0.9287 | 0.4218 | 1.5893 |
| S-Hexyl-Glutathione | NA | NA | NA | 1.1781 | 0.6423 | NA | 1.2489 |
| Sphinganine-1-phosphate (d18:0) | NA | NA | NA | 1.3052 | 1.2394 | 0.4440 | 1.2092 |
| Sphingomyelin | NA | NA | NA | 0.9954 | 1.4688 | 0.6081 | 0.9247 |
| Sphingosine-1-phosphate (d18:1) | 0.0150 | 0.0376 | 0.0170 | 1.3280 | 1.0036 | 0.8086 | 1.1809 |
| Stearic acid | 0.2531 | 0.3500 | 0.5379 | 1.0589 | 0.7206 | 1.0788 | 1.2487 |
| Suberic acid | 0.3172 | 0.3531 | 0.6465 | 1.3319 | 0.9237 | 0.4298 | 1.5921 |
| Taurochenodeoxycholic Acid | NA | NA | NA | 1.1644 | 0.5013 | 1.4956 | 0.9452 |
| Taurocholic acid | NA | NA | NA | 1.1914 | 0.6793 | 1.1299 | 1.0268 |
| Taurodeoxycholic acid | NA | NA | NA | 1.0458 | 0.5588 | 1.3927 | 1.0007 |
| Taurohyodeoxycholic Acid / Tauroursodeoxycholic Acid | NA | NA | NA | 1.1170 | 0.8228 | 1.0390 | 1.0970 |
| Thioetheramide-PC | NA | NA | NA | 0.9166 | 1.6163 | 0.2817 | 1.1314 |
| Thyroxine | NA | NA | NA | 0.9901 | 0.4254 | 1.7566 | 0.8215 |
| trans,trans -Muconic acid | NA | 0.2584 | 4.9737 | 0.4114 | 0.3662 | 0.2468 | 1.4286 |
| Tricosanoic acid | NA | 0.8370 | NA | 0.4844 | 1.3097 | NA | 0.1746 |
| Xanthurenic acid | NA | NA | NA | 1.3289 | 0.9612 | NA | 0.9185 |
Factors:
| F1 | SampleType:matrix | Sampler:DBS |
| F2 | SampleType:matrix | Sampler:plasma |
| F3 | SampleType:matrix | Sampler:VAM |
| F4 | SampleType:PooledQC | Sampler:LQC |
| F5 | SampleType:sample | Sampler:DBS |
| F6 | SampleType:sample | Sampler:plasma |
| F7 | SampleType:sample | Sampler:VAM |
