Data for (Study ST003895)
(Analysis AN006398)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 |
|---|---|---|---|---|---|
| 10-Hydroxy-2-decenoic acid | 1.3262 | 0.8843 | 0.7888 | 1.0622 | 0.9386 |
| 10-Hydroxydecanoic acid | 1.1056 | 0.9659 | 0.9253 | 1.0632 | 0.9399 |
| "1,11-Undecanedicarboxylic acid" | 0.9831 | 1.0179 | 1.1114 | 0.9614 | 0.9263 |
| 12(13)Ep-9-KODE | 1.0122 | 1.0746 | 0.8959 | 1.0156 | 1.0017 |
| "12alpha-12-Hydroxy-7,13-abietadien-18-oic acid" | 0.6179 | 1.1811 | 1.1944 | 1.0991 | 0.9075 |
| "1,2-Cyclohexanedicarboxylic acid" | 1.0282 | 0.9141 | 1.0213 | 0.9441 | 1.0923 |
| "1,2-Dilauroyl-sn-glycero-3-phosphocholine" | 1.0100 | 1.0329 | 0.9892 | 0.9963 | 0.9716 |
| "1-(3,4-dihydroxyphenyl)-2-methyl-1-Propanone" | 1.2131 | 0.9808 | 0.8520 | 0.9527 | 1.0013 |
| "1,3,5-Trihydroxybenzene" | 0.9670 | 1.0196 | 1.0287 | 0.9938 | 0.9909 |
| "1,3-Dicyclohexylurea" | 0.7638 | 1.1230 | 1.1264 | 0.8767 | 1.1101 |
| 13-Docosenamide | 0.9258 | 1.0565 | 0.9799 | 1.0987 | 0.9391 |
| "(13E)-11a-Hydroxy-9,15-dioxoprost-13-enoic acid" | 0.8821 | 0.8873 | 1.1965 | 1.1449 | 0.8892 |
| 13-HOTE | 1.0200 | 0.9935 | 0.9907 | 0.9710 | 1.0248 |
| ( )13-HpODE | 1.0417 | 0.8987 | 1.2358 | 0.9898 | 0.8341 |
| "15,16-DiHODE" | 0.8344 | 1.1325 | 1.0013 | 0.9127 | 1.1192 |
| 15-Hexadecynoic acid | 1.0464 | 0.9392 | 0.9956 | 0.9485 | 1.0703 |
| "(15Z)-9,12,13-Trihydroxy-15-octadecenoic acid" | 0.9552 | 0.9698 | 1.0948 | 0.9530 | 1.0272 |
| 19-Hydroxyprostaglandin E1 | 0.9521 | 1.0958 | 0.9305 | 1.0206 | 1.0011 |
| 1-Cyclohexene-1-carboxylic acid | 0.8293 | 1.5271 | 0.6182 | 0.8092 | 1.2162 |
| 1-Hexadecanoyl-2-octadecadienoyl-sn-glycero-3-phosphocholine | 1.0247 | 0.9972 | 1.0232 | 0.9983 | 0.9567 |
| 1-Hydroxy-2-naphthoic acid | 0.9380 | 0.9515 | 1.0572 | 0.9312 | 1.1222 |
| 1-O-Hexadecyl-2-arachidonoyl-sn-glycero-3-phosphocholine | 0.9890 | 1.0669 | 1.0000 | 0.9908 | 0.9533 |
| (20R)-17-Hydroxypregnenolone sulfate | 0.9591 | 1.0296 | 1.0018 | 0.9486 | 1.0608 |
| 2-((2R)-2-Hydroxycyclohexyl)acetic acid | 0.7653 | 1.6219 | 0.5502 | 0.9881 | 1.0745 |
| 2-(4-Methylphenyl)-1-propanol | 0.9873 | 1.0002 | 0.9647 | 1.0680 | 0.9798 |
| "2,6-Di-tert-butylbenzoquinone" | 0.9784 | 1.0143 | 1.1476 | 0.8929 | 0.9669 |
| (2-Acetyloxy-3-octadecoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate | 0.9946 | 1.0153 | 0.9893 | 1.0389 | 0.9618 |
| 2-Amino-3-(1-pyrazolyl)propanoic acid | 1.0715 | 0.9767 | 0.9694 | 0.9756 | 1.0068 |
| 2-Aminoisobutyric acid | 0.9283 | 0.9913 | 1.0202 | 1.0636 | 0.9967 |
| 2-Butyloctyl sulfate | 1.3423 | 0.8350 | 0.9297 | 1.1173 | 0.7757 |
| "(2E,4Z)-9-Oxo-2,4-octadecadienoic acid" | 1.1757 | 0.9123 | 1.0186 | 0.9879 | 0.9056 |
| 2-Hydroxy-3-methylbutyric acid | 0.8843 | 1.1294 | 0.9762 | 0.9945 | 1.0156 |
| 2-Hydroxyglutaric acid | 1.0041 | 1.0137 | 0.9696 | 1.0084 | 1.0042 |
| "2-Methoxy-3,4-dimethylphenyl acetate" | 0.9578 | 1.0369 | 0.9697 | 1.0115 | 1.0241 |
| 2-Methylglutaric acid | 1.0535 | 1.0596 | 1.0278 | 0.9466 | 0.9124 |
| 2-Octenoylcarnitine | 1.0710 | 0.9635 | 0.9232 | 0.9900 | 1.0522 |
| 2^-O-Methyluridine | 0.6113 | 1.0908 | 1.2538 | 1.1008 | 0.9433 |
| 2-Piperidinone | 1.0009 | 1.0318 | 1.0386 | 1.0161 | 0.9126 |
| 2-Propenoic acid | 1.1018 | 1.0016 | 0.9170 | 1.0214 | 0.9582 |
| 2-Propylglutaric acid | 1.0338 | 1.0324 | 1.0316 | 0.9598 | 0.9424 |
| "(2R)-2-Hydroxy-3-[(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)oxy]propyl (9Z,12Z)-octadeca-9,12-dienoate" | 1.1522 | 0.9030 | 0.8725 | 1.0073 | 1.0650 |
| 2-Tridecenal | 1.0071 | 0.9800 | 1.0371 | 0.9735 | 1.0023 |
| 3-(2-Ethylhexyl)phthalic acid | 0.8094 | 1.6928 | 0.4796 | 0.9672 | 1.0510 |
| "3,4-Dihydroxymandelic acid" | 0.9856 | 1.0234 | 1.0210 | 1.0230 | 0.9469 |
| "3,4-Dimethylbenzaldehyde" | 0.9930 | 1.0934 | 0.9318 | 1.0108 | 0.9710 |
| "3alpha,7alpha,12beta-Trihydroxy-5beta-cholanoic acid" | 1.1113 | 0.9536 | 0.9443 | 0.9619 | 1.0289 |
| 3alpha-Hydroxy-5alpha-pregnan-20-one sulfate | 0.8743 | 1.2636 | 0.9610 | 0.9052 | 0.9959 |
| "3a-Methyl-2,3,4,5,5a,10,10a,10b-octahydro-1H-cyclopenta[a]fluorene-2,3,7-triol" | 1.0324 | 1.0596 | 0.9692 | 1.0034 | 0.9353 |
| 3-Amino-4-methylpentanoic acid | 0.7715 | 1.1431 | 1.0027 | 0.9776 | 1.1050 |
| "3-Aminopiperidine-2,6-dione" | 1.0149 | 0.9730 | 0.9674 | 1.0288 | 1.0159 |
| 3-Carboxy-4-methyl-5-propyl-2-furanpropionic acid | 0.9639 | 0.9389 | 0.9157 | 1.0247 | 1.1568 |
| 3-Hydroxybenzoic acid | 0.9955 | 1.0270 | 1.0561 | 0.9606 | 0.9608 |
| 3-Hydroxycholest-5-en-7-one | 1.0481 | 0.9377 | 1.0347 | 1.0248 | 0.9547 |
| 3-Hydroxyisovalerylcarnitine | 0.8748 | 1.1060 | 1.0469 | 0.9953 | 0.9770 |
| 3-Hydroxymethylglutaric acid | 0.8269 | 0.8161 | 1.3569 | 0.8204 | 1.1797 |
| 3-Isopropylmalic acid | 0.9612 | 1.3998 | 0.5480 | 0.9389 | 1.1520 |
| 3-Methylindole | 1.0061 | 1.0670 | 0.9851 | 0.9859 | 0.9559 |
| 3-oxocholest-4-en-26-oate | 1.0239 | 0.9818 | 0.9776 | 1.0260 | 0.9905 |
| 3-Oxoglutaric acid | 0.9429 | 1.0280 | 1.0122 | 1.0409 | 0.9760 |
| 3-Phenoxypropylene di(acetate) | 0.7835 | 1.4630 | 0.5854 | 0.9981 | 1.1700 |
| 3-Phenyllactic acid | 0.9607 | 1.0275 | 0.9781 | 1.0066 | 1.0271 |
| "(3x,5a,9x,10b)-O-(3-Hydroxy-6-oxo-7-drimen-11-yl)umbelliferone" | 0.9895 | 1.1121 | 0.9229 | 0.9983 | 0.9772 |
| "4-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde" | 0.8946 | 1.5105 | 0.4911 | 0.9423 | 1.1615 |
| "4,6-Dinitro-O-cresol" | 1.0246 | 1.0223 | 0.9641 | 0.8572 | 1.1319 |
| 4-Acetamidobutanoic acid | 1.0032 | 1.0088 | 1.0023 | 0.9935 | 0.9922 |
| 4-Chlorophenoxyacetic acid | 0.7998 | 1.1064 | 1.2211 | 0.8881 | 0.9846 |
| 4-Hydroxydodecanoic acid | 0.9520 | 0.9359 | 1.0332 | 0.9084 | 1.1705 |
| 4-Nitrophenol | 1.1627 | 0.9060 | 0.9805 | 0.8304 | 1.1204 |
| 4-Pyridoxic acid | 1.0822 | 0.9733 | 0.9571 | 0.9603 | 1.0271 |
| 4-tert-Butylphenol | 1.0105 | 1.0403 | 1.0160 | 0.9760 | 0.9572 |
| 5a-Androstan-3b-ol | 0.9938 | 1.0146 | 0.9784 | 0.9760 | 1.0371 |
| 5-Bromotryptophan | 0.9441 | 1.0718 | 1.0200 | 0.9676 | 0.9964 |
| 5-Hydroxyindole | 1.0330 | 0.9959 | 0.9553 | 1.0102 | 1.0056 |
| 5-Hydroxyindoleacetic acid | 0.8154 | 1.1155 | 1.3709 | 0.7909 | 0.9073 |
| 5-KETE | 1.0347 | 0.9280 | 1.0830 | 0.9855 | 0.9688 |
| "5-Methyl-4-((1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-1,3-benzenediol" | 0.9298 | 1.2759 | 0.6989 | 0.9444 | 1.1511 |
| "(5Z)-11-Oxoprosta-5,9,12,14-tetraene-1-oic acid" | 0.7958 | 0.9539 | 1.1941 | 1.0972 | 0.9589 |
| "(5Z,8Z)-Tetradecadienoylcarnitine" | 1.3330 | 0.8307 | 0.9363 | 1.0524 | 0.8477 |
| 5Z-Dodecenoic acid | 1.0119 | 1.0613 | 1.0204 | 1.0164 | 0.8899 |
| 7a-Hydroxy-cholestene-3-one | 1.0836 | 0.8591 | 1.0210 | 1.0875 | 0.9488 |
| 7alpha-Hydroxy-3-oxo-4-cholestenoate | 1.0705 | 0.9956 | 1.0521 | 0.9916 | 0.8901 |
| 7-Epi-12-hydroxyjasmonic acid | 0.7093 | 1.0481 | 1.1305 | 1.1253 | 0.9868 |
| "8,13-Abietadien-18-oic acid" | 1.2221 | 0.8756 | 0.7253 | 1.0122 | 1.1649 |
| 8-oxononanoic acid | 0.9940 | 1.0572 | 1.0482 | 1.0332 | 0.8674 |
| "9,10-DHOME" | 1.4763 | 0.8575 | 0.9374 | 1.0428 | 0.6861 |
| "9,10-Epoxy-18-hydroxy-octadecanoic acid" | 0.9711 | 1.0102 | 1.0162 | 0.9670 | 1.0355 |
| "9,10-Epoxyoctadecenoic acid" | 0.9914 | 1.0210 | 1.0215 | 0.9899 | 0.9762 |
| "9,10-Epoxystearic acid" | 1.0062 | 1.0054 | 1.0153 | 0.9639 | 1.0093 |
| 9-cis-Retinal | 1.2156 | 0.8909 | 0.9419 | 1.0527 | 0.8989 |
| 9(S)-HOTrE | 0.9810 | 0.9710 | 1.0339 | 1.0105 | 1.0036 |
| 9(S)-HpODE | 0.9221 | 1.0366 | 1.1771 | 0.8763 | 0.9879 |
| "(9Z,12Z)-6-hydroxyoctadeca-9,12-dienoic acid" | 0.9817 | 1.0276 | 1.0072 | 0.9700 | 1.0136 |
| Acetaminophen glucuronide | 1.1390 | 0.8242 | 0.8172 | 1.1118 | 1.1078 |
| Acoric acid | 0.9226 | 1.0307 | 0.9682 | 1.0074 | 1.0711 |
| Alanine | 0.9911 | 0.9906 | 0.9644 | 1.0298 | 1.0241 |
| Alanylglycine | 0.9967 | 1.0009 | 1.0151 | 1.0313 | 0.9560 |
| allo-Inositol | 0.9805 | 0.9543 | 0.9837 | 0.9855 | 1.0961 |
| Alloxanthin | 0.9853 | 0.9606 | 1.1121 | 0.9528 | 0.9892 |
| Allysine | 1.0443 | 1.0007 | 0.9429 | 1.0278 | 0.9843 |
| alpha-Hydroxyisobutyric acid | 0.7988 | 0.9856 | 1.5372 | 0.8787 | 0.7997 |
| alpha-Ionone | 0.9665 | 0.9422 | 1.0198 | 1.0222 | 1.0494 |
| alpha-Ketoisovaleric acid | 1.0674 | 0.9845 | 0.9747 | 0.9937 | 0.9796 |
| alpha-Linolenic acid | 0.9809 | 1.0337 | 1.0539 | 0.9582 | 0.9733 |
| Androstenediol 3-sulfate | 0.9441 | 1.0522 | 1.0503 | 0.9617 | 0.9918 |
| Arabinonic acid | 0.9811 | 1.0107 | 0.9502 | 1.0260 | 1.0320 |
| Arabinopyranose | 0.9145 | 1.0996 | 0.9535 | 0.9583 | 1.0740 |
| Arachidic acid | 1.1694 | 0.8642 | 0.9809 | 0.8573 | 1.1282 |
| Arachidonic acid | 0.7152 | 1.0116 | 1.2554 | 1.1212 | 0.8966 |
| Arginine | 1.0295 | 0.9760 | 0.9378 | 1.0643 | 0.9924 |
| Auberganol | 1.0177 | 0.9829 | 1.0052 | 1.0285 | 0.9657 |
| Avocadene 1-acetate | 1.0258 | 1.0213 | 1.0636 | 1.0051 | 0.8842 |
| Azelaic acid | 1.0796 | 1.0544 | 0.9085 | 0.9103 | 1.0472 |
| Benzaldehyde | 0.9857 | 1.0332 | 0.9698 | 1.0068 | 1.0044 |
| Benzoic acid | 0.9713 | 1.0798 | 0.9935 | 1.0042 | 0.9512 |
| beta-Muricholic Acid | 0.9358 | 1.0949 | 0.8806 | 1.1054 | 0.9833 |
| Bilirubin | 1.0497 | 0.9500 | 0.9870 | 0.9713 | 1.0421 |
| Biliverdin | 1.1198 | 1.0041 | 0.9357 | 0.9988 | 0.9416 |
| Blumenol C glucoside | 2.8909 | 0.5034 | 0.6513 | 0.4961 | 0.4583 |
| But-2-enoic acid | 0.9635 | 0.9973 | 0.9885 | 1.0248 | 1.0259 |
| C75 trans | 1.0235 | 1.0919 | 1.0171 | 0.8977 | 0.9698 |
| Caffeine | 1.0064 | 0.9333 | 0.8434 | 1.3843 | 0.8326 |
| Chenodeoxycholic acid | 0.9798 | 1.0284 | 0.9735 | 0.9803 | 1.0380 |
| Chenodeoxycholic acid 24-acyl-D-glucuronide | 0.9971 | 0.9747 | 1.0763 | 0.9604 | 0.9914 |
| Cholesterol sulfate | 1.0152 | 0.9414 | 1.0026 | 1.0070 | 1.0338 |
| Cholic acid | 1.6666 | 0.7457 | 0.5358 | 1.1499 | 0.9019 |
| Cinnamaldehyde | 0.9857 | 1.0750 | 0.9454 | 1.0081 | 0.9858 |
| cis-12-Oxophytodienoic acid | 1.0055 | 0.9973 | 1.0383 | 0.9472 | 1.0117 |
| cis-4-Hydroxyproline | 0.9387 | 1.0433 | 1.0742 | 0.9482 | 0.9957 |
| cis-Aconitic acid | 0.8818 | 1.0630 | 1.0183 | 1.0087 | 1.0282 |
| cis-Vaccenic acid | 0.6618 | 1.5404 | 0.6542 | 0.9860 | 1.1576 |
| Citramalic acid | 0.8945 | 1.0465 | 1.0461 | 1.0245 | 0.9884 |
| Citrulline | 1.0675 | 0.9699 | 1.0516 | 0.9764 | 0.9346 |
| Copalic acid | 0.8768 | 1.3636 | 0.6178 | 1.0725 | 1.0694 |
| Corticosterone | 1.0767 | 1.0245 | 1.0271 | 0.9382 | 0.9336 |
| Cortisol | 1.2737 | 0.8118 | 0.8457 | 1.1090 | 0.9598 |
| Creatinine | 0.8815 | 1.1049 | 0.9660 | 1.0277 | 1.0198 |
| Curcumol | 1.0619 | 0.9421 | 0.9655 | 0.8867 | 1.1438 |
| Decanoylcarnitine | 1.5277 | 0.7767 | 1.0521 | 0.8896 | 0.7539 |
| Decenoylcarnitine | 1.6657 | 0.7330 | 0.9052 | 0.9293 | 0.7668 |
| Dehydroepiandrosterone | 0.8724 | 1.0467 | 1.0020 | 1.0470 | 1.0319 |
| Dehydroepiandrosterone sulfate | 0.9116 | 1.0696 | 1.0631 | 0.9364 | 1.0193 |
| Deoxycholic acid | 1.7346 | 0.8146 | 0.8270 | 0.8664 | 0.7574 |
| Deoxycholylglycine | 0.8184 | 1.0852 | 1.0060 | 1.2048 | 0.8856 |
| Deoxycorticosterone acetate | 1.7104 | 0.7090 | 1.0177 | 0.9152 | 0.6476 |
| Dephostatin | 1.0108 | 0.9850 | 1.0067 | 0.9965 | 1.0011 |
| DG(16:0/18:1(9Z)/0:0) | 0.9600 | 1.0328 | 0.9901 | 0.9787 | 1.0384 |
| "DG(16:0/18:2(9Z,12Z)/0:0)" | 1.0764 | 0.9696 | 0.9778 | 0.9858 | 0.9905 |
| "DG(18:0/18:2(9Z,12Z)/0:0)" | 0.9399 | 1.0854 | 0.9774 | 0.9798 | 1.0175 |
| "DG(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/0:0)" | 0.9058 | 1.1035 | 0.9670 | 0.9801 | 1.0437 |
| DG(18:1(9Z)/16:0/0:0) | 1.0264 | 0.9899 | 1.0319 | 0.9565 | 0.9953 |
| "DG(18:2(9Z,12Z)/18:1(9Z)/0:0)" | 1.0197 | 1.0098 | 0.9178 | 1.0507 | 1.0019 |
| "DG(18:2(9Z,12Z)/18:2(9Z,12Z)/0:0)" | 1.0000 | 0.9857 | 0.9688 | 1.0416 | 1.0039 |
| Didodecyl thiobispropanoate | 1.1050 | 1.0748 | 0.7678 | 0.9876 | 1.0647 |
| Diethyl fumarate | 1.0107 | 1.0047 | 1.0045 | 1.0070 | 0.9732 |
| Diethylhexyl adipate | 0.9578 | 0.9704 | 1.0745 | 1.0249 | 0.9724 |
| Diethyl malonate | 1.0181 | 1.0754 | 0.9932 | 0.9380 | 0.9753 |
| Diethyltoluamide | 0.9054 | 1.0207 | 1.0612 | 0.9488 | 1.0638 |
| Dihydro-5-propyl-2(3H)-furanone | 1.0572 | 1.0359 | 0.9913 | 0.9201 | 0.9955 |
| Dihydrouracil | 0.9890 | 0.9883 | 1.0374 | 0.9884 | 0.9969 |
| Diisooctyl phthalate | 0.9820 | 1.0070 | 1.0499 | 1.0094 | 0.9517 |
| Dimethyl adipate | 1.0436 | 0.9373 | 0.9646 | 0.9324 | 1.1220 |
| DNP-DL-Methionine | 0.9205 | 1.0410 | 0.9609 | 1.0825 | 0.9950 |
| Docosanamide | 0.9515 | 1.0970 | 0.9676 | 1.0736 | 0.9102 |
| Docosanoic acid | 1.1586 | 0.7787 | 1.0281 | 0.9686 | 1.0660 |
| Dodecadienoic acid | 0.9672 | 1.0299 | 0.9991 | 0.9774 | 1.0264 |
| Dodecanoylcarnitine | 1.3312 | 0.8212 | 0.9679 | 1.0603 | 0.8194 |
| Dodecyl gallate | 0.8495 | 1.0030 | 1.0432 | 1.1739 | 0.9304 |
| "(E,E)-Piperlonguminine" | 1.2056 | 0.9338 | 1.0376 | 0.8589 | 0.9641 |
| Eicosapentaenoic acid | 1.0714 | 0.8798 | 0.9753 | 1.0241 | 1.0492 |
| "ent-6,16-Kauradien-19-oic acid" | 0.5584 | 1.0938 | 1.2136 | 1.1540 | 0.9802 |
| "(ent-7alpha)-7-Hydroxy-8(14),15-pimaradien-19-oic acid" | 0.6713 | 1.0876 | 1.1911 | 1.0685 | 0.9815 |
| Epitestosterone sulfate | 0.9505 | 1.0521 | 1.0687 | 0.9673 | 0.9614 |
| Epsilon-caprolactam | 0.9901 | 1.0282 | 1.1180 | 0.8709 | 0.9928 |
| Ergothioneine | 1.0124 | 0.9971 | 1.0894 | 0.9716 | 0.9296 |
| Erucic acid | 0.9312 | 1.0539 | 0.9910 | 1.1202 | 0.9037 |
| Erythrose | 0.9786 | 1.0192 | 0.9637 | 1.0422 | 0.9963 |
| Esculentic acid (Diplazium) | 0.9848 | 1.0361 | 1.0398 | 0.9379 | 1.0014 |
| Estreptoquinasa | 1.1676 | 1.0235 | 0.8586 | 0.9538 | 0.9964 |
| Ethylenediaminetetraacetic acid | 1.0222 | 0.9868 | 1.0016 | 1.0149 | 0.9745 |
| Ethylmalonic acid | 0.9546 | 1.2156 | 1.0691 | 0.6810 | 1.0796 |
| Etidocaine | 0.9481 | 1.0906 | 1.0150 | 0.9415 | 1.0048 |
| Fasoracetam | 0.9928 | 1.0414 | 0.9973 | 0.9968 | 0.9716 |
| Galactaric acid | 0.9113 | 1.0466 | 0.9330 | 1.0353 | 1.0738 |
| Galactosylceramide (d18:1/16:0) | 0.9312 | 1.0383 | 0.9608 | 0.9769 | 1.0928 |
| gamma-Aminobutyric acid | 0.9724 | 1.0229 | 1.0111 | 0.9781 | 1.0155 |
| gamma-Glutamylleucine | 0.8338 | 1.1932 | 1.0619 | 0.8640 | 1.0470 |
| gamma-Linolenic acid | 1.0561 | 0.9396 | 1.0660 | 0.9686 | 0.9698 |
| Ganglioside GD3 (d18:1/16:0) | 0.9273 | 1.0464 | 0.9996 | 0.9750 | 1.0517 |
| Gluconic acid | 0.9389 | 1.0158 | 1.0240 | 0.9845 | 1.0367 |
| Glucose | 0.9663 | 0.9859 | 0.8727 | 1.1208 | 1.0543 |
| Glutamic acid | 0.9439 | 0.9958 | 0.9867 | 1.0349 | 1.0386 |
| Glutamylglutamine | 1.0165 | 1.0194 | 1.0257 | 1.0417 | 0.8967 |
| Glutamylserine | 1.0563 | 0.9563 | 1.0237 | 1.0328 | 0.9309 |
| Glutaric acid | 0.9906 | 1.0261 | 1.0472 | 0.9440 | 0.9921 |
| Glycerophosphocholine | 1.0434 | 0.9848 | 0.9528 | 1.0401 | 0.9788 |
| Glyceryl monolinoleate | 0.7947 | 1.0169 | 1.1097 | 1.0351 | 1.0436 |
| Glycocholic acid | 0.7202 | 0.9909 | 0.8970 | 1.4665 | 0.9254 |
| Glycodeoxycholic acid | 0.7667 | 1.1400 | 0.8938 | 1.1723 | 1.0271 |
| Glycoursodeoxycholic acid | 0.8015 | 1.0917 | 1.0038 | 1.1671 | 0.9359 |
| Glycyl-Threonine | 0.9267 | 1.0767 | 1.0063 | 0.9937 | 0.9965 |
| Hexadecanedioic acid | 1.0580 | 0.9680 | 1.0248 | 0.9712 | 0.9780 |
| Hexaethylene glycol | 0.7624 | 0.9520 | 0.8561 | 1.7496 | 0.6799 |
| hexaminolevulinate | 1.0170 | 0.9767 | 1.0234 | 1.0000 | 0.9829 |
| Hexanoylcarnitine | 1.5091 | 0.7834 | 0.9538 | 0.8910 | 0.8628 |
| Hippuric acid | 1.1647 | 0.9079 | 0.8552 | 1.0543 | 1.0180 |
| Homovanillic acid sulfate | 1.1328 | 0.9509 | 0.8548 | 1.0908 | 0.9707 |
| Hydroxytyrosol Acetate | 1.0392 | 1.2065 | 0.7192 | 0.9185 | 1.1167 |
| Imidazoleacetic acid | 0.8730 | 1.1208 | 1.1834 | 0.9017 | 0.9211 |
| Indole-3-acetic acid | 0.9968 | 1.0180 | 0.9817 | 0.9932 | 1.0103 |
| Indole-4-carboxaldehyde | 0.7946 | 1.1007 | 1.3912 | 0.8561 | 0.8574 |
| Indoleacrylic acid | 0.9126 | 1.1200 | 1.0032 | 0.9881 | 0.9761 |
| Indolelactic acid | 0.9956 | 1.0389 | 0.9856 | 0.9679 | 1.0120 |
| Indoline | 0.9655 | 1.0330 | 0.9758 | 1.0151 | 1.0106 |
| Indoxyl sulfate | 1.0354 | 0.9735 | 0.9634 | 0.9969 | 1.0307 |
| IS | 0.9921 | 0.9843 | 0.9649 | 1.0421 | 1.0166 |
| Isocitric acid | 0.9098 | 1.0381 | 1.0238 | 1.0413 | 0.9871 |
| Isohyodeoxycholic acid | 2.0219 | 0.5345 | 0.9294 | 1.0195 | 0.4946 |
| Isokobusone | 0.9306 | 1.1477 | 0.8408 | 1.0025 | 1.0784 |
| Isopimaric acid | 0.7172 | 1.0760 | 1.1478 | 1.0062 | 1.0528 |
| Isoquinoline | 0.7304 | 1.2366 | 1.1716 | 0.7925 | 1.0689 |
| Isovalerylcarnitine | 0.6538 | 1.2667 | 1.4003 | 0.7711 | 0.9081 |
| Ketoleucine | 0.9996 | 1.0600 | 1.0324 | 0.9242 | 0.9839 |
| Kynurenine | 0.8667 | 1.1661 | 1.1706 | 0.8847 | 0.9119 |
| Lactic acid | 1.0161 | 0.9967 | 0.9958 | 0.9171 | 1.0743 |
| Lauroyl diethanolamide | 1.0467 | 0.9954 | 0.9930 | 1.0400 | 0.9249 |
| Lenticin | 0.9768 | 1.0391 | 1.0420 | 0.9798 | 0.9623 |
| Leucine | 0.7309 | 1.1884 | 1.1341 | 0.9037 | 1.0429 |
| Linoelaidic acid | 0.9590 | 1.0371 | 1.0749 | 0.9941 | 0.9349 |
| Linoleyl carnitine | 1.0524 | 0.9803 | 0.9462 | 1.0296 | 0.9914 |
| "L,L-Cyclo(leucylprolyl)" | 1.0216 | 1.0207 | 0.9673 | 1.0047 | 0.9858 |
| Lubiminol | 1.0357 | 0.9963 | 0.9813 | 1.0339 | 0.9528 |
| "LysoPC(0:0/18:2(9Z,12Z))" | 0.9635 | 0.9788 | 0.8936 | 0.8753 | 1.2888 |
| LysoPC(14:0/0:0) | 0.9289 | 0.9960 | 0.9147 | 0.9532 | 1.2072 |
| LysoPC(15:0/0:0) | 0.9715 | 1.0533 | 0.9596 | 1.0229 | 0.9926 |
| LysoPC(16:0/0:0) | 0.9792 | 0.9399 | 1.0441 | 0.9720 | 1.0648 |
| LysoPC(17:0/0:0) | 0.9825 | 1.0303 | 0.9500 | 1.0631 | 0.9741 |
| LysoPC(18:0) | 0.9769 | 0.9511 | 0.9740 | 0.9509 | 1.1471 |
| LysoPC(18:1(9Z)) | 1.0154 | 0.9406 | 0.9909 | 0.9763 | 1.0769 |
| "LysoPC(18:2(9Z,12Z)/0:0)" | 1.0327 | 0.9234 | 0.9843 | 0.9462 | 1.1135 |
| LysoPC(20:0/0:0) | 1.0281 | 0.9551 | 0.9742 | 1.0502 | 0.9924 |
| LysoPC(22:0/0:0) | 0.9392 | 1.0301 | 0.9877 | 1.0188 | 1.0242 |
| LysoPC(24:0/0:0) | 0.9624 | 1.0675 | 0.9883 | 0.9865 | 0.9952 |
| LysoPC(O-18:0/0:0) | 1.0569 | 0.9818 | 0.9404 | 1.0472 | 0.9737 |
| LysoPC(P-16:0/0:0) | 0.9122 | 1.0695 | 0.9523 | 1.0282 | 1.0379 |
| LysoPC(P-18:0/0:0) | 1.0684 | 0.9946 | 0.9278 | 1.0226 | 0.9865 |
| LysoPE(16:0/0:0) | 0.9950 | 1.0503 | 0.8940 | 0.9288 | 1.1319 |
| LysoPE(18:0/0:0) | 0.9881 | 0.9989 | 0.9554 | 0.9407 | 1.1168 |
| LysoPE(18:1(9Z)/0:0) | 0.9784 | 1.0054 | 1.2150 | 0.9150 | 0.8862 |
| Mandelic acid | 1.0715 | 0.9351 | 0.7667 | 1.1383 | 1.0883 |
| Mesaconic acid | 0.9319 | 1.0129 | 1.0068 | 1.0031 | 1.0453 |
| Mesterolone | 0.9638 | 1.1400 | 0.8481 | 1.0100 | 1.0381 |
| Methionine sulfoxide | 0.9751 | 0.9810 | 1.1042 | 1.0727 | 0.8670 |
| Methoxypyrazine | 1.0686 | 1.0085 | 0.9912 | 0.9555 | 0.9763 |
| "Methyl 4,8-decadienoate" | 0.9713 | 1.0657 | 0.9814 | 0.9814 | 1.0003 |
| Methyl gallate | 0.9502 | 1.4478 | 0.6504 | 0.9097 | 1.0419 |
| Methyl jasmonate | 0.9586 | 0.9791 | 0.9281 | 0.9840 | 1.1502 |
| Methyl linoleate | 0.9863 | 1.0261 | 1.0082 | 0.9569 | 1.0224 |
| Methylmalonic acid | 0.9841 | 0.9767 | 1.0493 | 0.9305 | 1.0593 |
| Metyrosine | 0.9552 | 1.0800 | 0.9584 | 1.0097 | 0.9968 |
| MG(0:0/16:0/0:0) | 0.9869 | 1.0068 | 0.9971 | 0.9708 | 1.0384 |
| MG(22:1(13Z)/0:0/0:0) | 0.9431 | 1.0551 | 0.9890 | 1.1156 | 0.8971 |
| Monobutylphthalate | 0.9909 | 0.8914 | 1.2019 | 0.9343 | 0.9815 |
| Monoethylhexyl phthalic acid | 1.0110 | 0.9673 | 1.0537 | 0.9646 | 1.0034 |
| Monoethyl phthalate | 1.1050 | 0.9531 | 0.9819 | 1.0049 | 0.9551 |
| Monoisobutyl phthalic acid | 1.0708 | 1.0097 | 1.0007 | 0.9767 | 0.9420 |
| Monomethyl phthalate | 0.9598 | 1.0482 | 1.0160 | 0.9912 | 0.9848 |
| Monooctyl phthalate | 0.9717 | 1.0159 | 1.0300 | 0.9937 | 0.9886 |
| Monoolein | 0.7961 | 1.4084 | 1.2432 | 0.8985 | 0.6538 |
| N-[(3s)-2-Oxotetrahydrofuran-3-Yl]butanamide | 0.9966 | 0.9504 | 1.0244 | 1.0059 | 1.0228 |
| N6-Carboxymethyllysine | 0.9678 | 1.0456 | 1.0697 | 0.9734 | 0.9436 |
| "N6,N6,N6-Trimethyl-L-lysine" | 1.1115 | 0.9235 | 0.9294 | 1.0385 | 0.9971 |
| N-Acetylaminooctanoic acid | 1.0188 | 0.9981 | 0.9586 | 1.0177 | 1.0068 |
| N-Acetylaspartic acid | 0.9663 | 1.0082 | 1.0622 | 1.0213 | 0.9421 |
| N-Acetylglutamine | 1.0039 | 0.9917 | 1.0451 | 1.0084 | 0.9509 |
| N-Acetyl-L-alanine | 1.0241 | 0.9810 | 0.9977 | 1.0182 | 0.9790 |
| N-Acetylleucine | 0.8088 | 1.1607 | 1.2028 | 0.8398 | 0.9879 |
| N-Acetyltryptophan | 0.8702 | 1.2042 | 1.0873 | 0.8503 | 0.9880 |
| N-Acetylvanilalanine | 0.9793 | 1.0240 | 1.0131 | 0.9944 | 0.9891 |
| Nicotinamide N-oxide | 0.9262 | 1.0953 | 1.0209 | 1.0020 | 0.9556 |
| N-Isobutyloctadeca-trans-2-trans-4-dienamide | 0.9841 | 1.0158 | 1.0217 | 0.9772 | 1.0011 |
| N-methyl-L-glutamic Acid | 0.9573 | 1.0197 | 1.0719 | 1.0030 | 0.9480 |
| Norvaline | 0.8968 | 1.0925 | 1.0303 | 0.9706 | 1.0098 |
| N-Phenylacetylglutamine | 1.1414 | 0.9780 | 1.0024 | 0.9462 | 0.9320 |
| Nutriacholic acid | 0.9664 | 1.0456 | 1.0228 | 1.0055 | 0.9598 |
| Octadecenoylcarnitine | 1.0215 | 0.9716 | 1.0020 | 1.0439 | 0.9609 |
| Octanoylcarnitine | 1.4140 | 0.8111 | 1.0182 | 0.9911 | 0.7655 |
| Oleamide | 0.7819 | 1.3993 | 1.2551 | 0.9137 | 0.6499 |
| Oligomycin | 1.0218 | 0.9893 | 1.0528 | 0.9248 | 1.0112 |
| o-Phenetidine | 0.9496 | 1.0591 | 1.0223 | 0.9789 | 0.9901 |
| Ornithine | 0.9882 | 1.0554 | 1.0920 | 0.9181 | 0.9463 |
| Orotidine | 1.0561 | 0.9813 | 0.9717 | 1.0678 | 0.9231 |
| o-Tyrosine | 0.8366 | 1.0372 | 1.0799 | 0.9140 | 1.1324 |
| Oxandrolone | 1.0648 | 1.5921 | 0.9349 | 0.4461 | 0.9621 |
| Oxibendazole | 1.0793 | 0.9641 | 1.0174 | 0.9803 | 0.9589 |
| Palmitelaidic acid | 1.0690 | 1.1130 | 0.9163 | 0.9346 | 0.9671 |
| Palmitoleic acid | 1.0323 | 0.9345 | 1.0670 | 0.9816 | 0.9846 |
| Paracetamol sulfate | 1.0382 | 0.8343 | 0.8942 | 1.3806 | 0.8527 |
| PC(14:0/14:0) | 0.9101 | 1.0787 | 1.2637 | 0.8888 | 0.8586 |
| PC(14:0/16:0) | 0.9807 | 1.0307 | 1.0832 | 0.9689 | 0.9365 |
| PC(16:0/14:0) | 0.9937 | 1.0022 | 1.1208 | 0.9720 | 0.9114 |
| PC(16:0/16:0) | 1.0037 | 1.0497 | 0.9899 | 1.0096 | 0.9471 |
| PC(16:0/18:0) | 1.0280 | 0.9937 | 0.9635 | 1.0089 | 1.0059 |
| PC(16:0/18:1(9Z)) | 1.0929 | 0.9148 | 1.0393 | 0.9896 | 0.9634 |
| "PC(16:0/20:4(5Z,8Z,11Z,14Z))" | 0.9688 | 1.0140 | 0.9926 | 0.9656 | 1.0589 |
| "PC(16:0/20:5(5Z,8Z,11Z,14Z,17Z))" | 0.9594 | 1.0754 | 1.0264 | 0.9774 | 0.9614 |
| "PC(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" | 0.9871 | 1.0660 | 0.9905 | 0.9940 | 0.9623 |
| PC(16:1(9Z)/16:1(9Z)) | 1.0074 | 1.0436 | 1.0003 | 1.0184 | 0.9304 |
| "PC(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" | 1.0024 | 1.0414 | 1.0118 | 1.0054 | 0.9390 |
| PC(18:0/16:0) | 1.1016 | 0.9115 | 1.1107 | 0.8742 | 1.0021 |
| PC(18:0/18:0) | 0.9882 | 1.0498 | 0.9958 | 0.9985 | 0.9677 |
| PC(18:0/18:1(9Z)) | 0.9430 | 1.0961 | 1.0116 | 0.9778 | 0.9715 |
| "PC(18:0/18:2(9Z,12Z))" | 0.9569 | 0.9779 | 0.9764 | 0.9465 | 1.1423 |
| "PC(18:0/20:4(5Z,8Z,11Z,14Z))" | 0.9909 | 1.0376 | 1.0283 | 0.9973 | 0.9458 |
| "PC(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" | 0.9640 | 1.0747 | 1.0089 | 0.9858 | 0.9666 |
| PC(18:1(9Z)/14:0) | 0.9825 | 1.0562 | 1.0256 | 0.9929 | 0.9428 |
| PC(18:1(9Z)/16:0) | 0.9903 | 1.0478 | 0.9992 | 0.9769 | 0.9857 |
| PC(18:1(9Z)/18:1(9Z)) | 0.9927 | 1.0470 | 1.0037 | 1.0008 | 0.9558 |
| "PC(18:2(9Z,12Z)/18:2(9Z,12Z))" | 1.0116 | 1.0320 | 1.0139 | 1.0030 | 0.9395 |
| "PC(18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z))" | 0.9661 | 1.1262 | 0.9966 | 0.9506 | 0.9605 |
| "PC(20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z))" | 1.0118 | 1.0551 | 0.9771 | 1.0024 | 0.9535 |
| "PC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:0)" | 0.9855 | 1.0261 | 0.9832 | 0.9733 | 1.0319 |
| "PC(O-16:0/20:3(8Z,11Z,14Z))" | 0.9690 | 1.0832 | 0.9689 | 0.9933 | 0.9856 |
| "PC(O-16:0/20:5(5Z,8Z,11Z,14Z,17Z))" | 0.9804 | 1.0935 | 0.9670 | 1.0055 | 0.9535 |
| "PC(O-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" | 0.9897 | 1.0441 | 0.9831 | 1.0103 | 0.9728 |
| PC(O-18:1(9Z)/16:0) | 0.9783 | 1.0606 | 0.9508 | 0.9753 | 1.0350 |
| PC(P-18:0/18:1(9Z)) | 1.0145 | 0.9372 | 0.9764 | 1.0311 | 1.0408 |
| "PC(P-18:0/20:4(5Z,8Z,11Z,14Z))" | 0.9829 | 1.0484 | 1.0186 | 0.9858 | 0.9643 |
| "PC(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" | 0.9900 | 1.0468 | 0.9764 | 1.0099 | 0.9770 |
| p-Cresol | 1.0324 | 1.0255 | 1.0003 | 0.9692 | 0.9726 |
| p-Cresol sulfate | 1.0173 | 0.9996 | 1.0163 | 0.9494 | 1.0174 |
| p-Cymene | 0.9559 | 0.9751 | 1.0059 | 1.0362 | 1.0269 |
| PE(16:0/18:1(11Z)) | 1.0027 | 0.6810 | 0.9835 | 1.2862 | 1.0466 |
| "PE(16:0/18:2(9Z,12Z))" | 0.9112 | 1.0973 | 1.1063 | 0.9317 | 0.9535 |
| "PE(16:0/20:4(5Z,8Z,11Z,14Z))" | 0.9264 | 1.0399 | 1.0450 | 0.9310 | 1.0576 |
| "PE(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" | 0.8753 | 1.1428 | 1.0063 | 0.9551 | 1.0205 |
| PE(18:0/18:1(9Z)) | 0.8855 | 1.1139 | 1.1041 | 0.9061 | 0.9905 |
| "PE(18:0/20:4(5Z,8Z,11Z,14Z))" | 0.9628 | 1.0085 | 0.9897 | 0.9592 | 1.0798 |
| "PE(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" | 0.9758 | 1.0511 | 0.9917 | 0.9880 | 0.9934 |
| PE(18:1(9Z)/18:1(9Z)) | 0.7580 | 1.1810 | 1.5037 | 0.7724 | 0.7849 |
| "PE(18:2(9Z,12Z)/18:2(9Z,12Z))" | 1.1777 | 0.9766 | 1.0138 | 0.9625 | 0.8694 |
| PE-NMe2(16:0/16:0) | 0.9102 | 1.0897 | 1.1546 | 0.9159 | 0.9296 |
| Pentaethylene glycol | 0.8115 | 0.9105 | 0.7970 | 1.7638 | 0.7172 |
| "PE(P-18:0/20:4(5Z,8Z,11Z,14Z))" | 1.0594 | 0.9773 | 1.1252 | 0.8983 | 0.9398 |
| "PE(P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))" | 0.9884 | 1.0380 | 0.9980 | 0.9870 | 0.9885 |
| Phenacemide | 1.1532 | 0.9623 | 0.9600 | 0.9530 | 0.9715 |
| Phenylalanine | 0.9805 | 1.0321 | 0.9735 | 1.0363 | 0.9776 |
| Phenylalanylproline | 1.0775 | 0.8932 | 0.9960 | 1.0629 | 0.9703 |
| Phthalic acid | 1.2190 | 0.8778 | 0.8124 | 1.0157 | 1.0751 |
| PI(16:0/18:1(9Z)) | 0.9534 | 1.0303 | 0.9950 | 0.9752 | 1.0461 |
| "PI(18:0/20:4(5Z,8Z,11Z,14Z))" | 0.9821 | 0.9809 | 0.9578 | 0.9662 | 1.1131 |
| Pi-Methylimidazoleacetic acid | 0.9546 | 1.0075 | 1.0119 | 1.1004 | 0.9256 |
| Pipecolic acid | 0.9750 | 1.0081 | 1.0504 | 0.9454 | 1.0211 |
| piperidine-1-carboxamide | 1.1657 | 0.9073 | 1.0798 | 0.9272 | 0.9200 |
| Piperine | 1.3121 | 1.0036 | 1.1262 | 0.8006 | 0.7576 |
| Polygodial | 0.9913 | 0.9795 | 1.1566 | 0.9629 | 0.9096 |
| Pregnenolone sulfate | 0.9703 | 0.9934 | 0.9972 | 1.0109 | 1.0282 |
| Proline | 0.9067 | 1.0534 | 1.0199 | 1.0085 | 1.0115 |
| Propionylcarnitine | 0.8920 | 1.1689 | 1.1122 | 0.8911 | 0.9357 |
| Propylenediamine tetra-acetic acid | 1.0194 | 0.9973 | 1.0209 | 0.9828 | 0.9796 |
| Prostaglandin E1 | 1.1875 | 0.7486 | 1.1815 | 0.7116 | 1.1709 |
| Prostaglandin F1a | 0.8395 | 1.5685 | 0.4495 | 0.9284 | 1.2141 |
| Prostaglandin H1 | 0.9408 | 1.1401 | 0.9277 | 0.9475 | 1.0438 |
| Prostaglandin lactone-diol | 1.0449 | 1.0371 | 0.9993 | 0.9283 | 0.9904 |
| PS(18:0/18:1(9Z)) | 1.1094 | 1.0767 | 0.8690 | 1.0333 | 0.9116 |
| Psilostachyin | 1.0024 | 1.0925 | 0.9426 | 0.9550 | 1.0075 |
| Pyroglutamic acid | 1.0940 | 0.9043 | 0.9767 | 1.0374 | 0.9876 |
| Quinic acid | 0.9818 | 1.0174 | 0.9577 | 1.0378 | 1.0054 |
| (R)-2-Hydroxyhexadecanoic acid | 0.9654 | 1.0293 | 0.9868 | 1.0545 | 0.9641 |
| (R)-3-Hydroxy-Octadecanoic acid | 0.9138 | 0.9794 | 1.0372 | 1.0994 | 0.9703 |
| (R)C(S)S-Alliin | 1.0286 | 1.0189 | 0.9468 | 1.0318 | 0.9739 |
| (S)-3-Hydroxybutyric acid | 0.8087 | 1.0682 | 1.0961 | 0.9818 | 1.0452 |
| (+)-Sabinene | 0.7406 | 1.4423 | 0.6423 | 1.0095 | 1.1653 |
| Sedoheptulose | 0.9574 | 1.0484 | 1.0160 | 0.9291 | 1.0491 |
| SM(d18:1/12:0) | 0.9537 | 1.0803 | 1.0119 | 0.9857 | 0.9685 |
| SM(d18:1/16:0) | 0.9647 | 1.0663 | 0.9914 | 0.9730 | 1.0046 |
| SM(d18:1/18:0) | 0.9402 | 0.9216 | 1.1381 | 1.0720 | 0.9281 |
| SM(d18:1/18:1(9Z)) | 0.9963 | 1.0352 | 1.0056 | 0.9968 | 0.9662 |
| SM(d18:1/22:0) | 0.8247 | 0.7140 | 1.1020 | 1.1666 | 1.1928 |
| SM(d18:1/24:0) | 1.0269 | 1.1369 | 1.0411 | 1.0194 | 0.7757 |
| SM(d18:1/24:1) | 0.9448 | 0.7498 | 0.9892 | 1.0481 | 1.2682 |
| Spermine | 1.2511 | 1.1658 | 1.0292 | 0.7848 | 0.7691 |
| Sphinganine 1-phosphate | 0.9127 | 1.0150 | 1.0525 | 0.9265 | 1.0932 |
| Sphingosine | 0.9959 | 1.0031 | 1.0095 | 0.9605 | 1.0310 |
| Sphingosine 1-phosphate | 0.9145 | 1.0600 | 1.0437 | 0.9620 | 1.0197 |
| Stearamide | 0.9484 | 1.1069 | 1.0348 | 1.0529 | 0.8571 |
| Stearic acid | 0.9717 | 0.9893 | 1.0024 | 0.9689 | 1.0677 |
| Stearidonic acid | 1.0629 | 0.9723 | 0.9604 | 1.0174 | 0.9869 |
| Stearolic acid | 0.9899 | 1.0162 | 1.0239 | 0.9569 | 1.0132 |
| Succinamide | 0.8585 | 0.8636 | 1.3653 | 0.8860 | 1.0266 |
| Succinic acid | 1.0793 | 1.0082 | 1.0078 | 0.8978 | 1.0069 |
| Succinic acid-d4 | 0.8393 | 0.8061 | 1.6830 | 0.7976 | 0.8739 |
| Succinic acid semialdehyde | 0.9443 | 1.0330 | 0.9378 | 1.0496 | 1.0354 |
| Taurochenodesoxycholic acid | 0.8296 | 0.9960 | 0.9802 | 1.2449 | 0.9493 |
| Taurocholic acid | 0.8239 | 0.9800 | 0.8963 | 1.3051 | 0.9946 |
| Taurodeoxycholic Acid | 0.8010 | 0.9795 | 0.9594 | 1.3140 | 0.9460 |
| Tauroursodeoxycholic acid | 0.8878 | 0.9633 | 1.0640 | 1.1092 | 0.9757 |
| Testosterone | 0.8705 | 1.4800 | 0.4432 | 1.0459 | 1.1605 |
| Tetradecanedioic acid | 0.8120 | 1.2192 | 1.3341 | 0.7551 | 0.8796 |
| Tetradecenoylcarnitine | 1.2852 | 0.8270 | 0.9788 | 1.0828 | 0.8262 |
| Tetraethylene glycol | 1.4530 | 0.9586 | 0.8710 | 0.8396 | 0.8778 |
| Tetranor 12-HETE | 1.0468 | 0.9549 | 0.9702 | 0.9500 | 1.0782 |
| Theobromine | 1.0206 | 1.0645 | 0.9375 | 1.0245 | 0.9530 |
| Threonic acid | 0.9776 | 1.0250 | 0.9019 | 1.0337 | 1.0619 |
| Threonine | 0.9411 | 1.0322 | 0.9362 | 1.0473 | 1.0432 |
| tributyl phosphate | 0.9713 | 0.9772 | 0.9481 | 1.1022 | 1.0011 |
| Tricosanoic acid | 1.0026 | 1.0848 | 1.0248 | 0.9928 | 0.8950 |
| Triethylene glycol dimethacrylate | 1.0304 | 1.2830 | 0.7241 | 0.9569 | 1.0056 |
| Trigonelline | 1.1614 | 0.9071 | 0.8854 | 1.0214 | 1.0248 |
| Triphenyl phosphate | 0.7627 | 3.1192 | 0.2281 | 0.7163 | 0.1736 |
| TRIS(3-CHLOROPROPYL)PHOSPHATE | 1.0350 | 0.9876 | 1.0210 | 0.9812 | 0.9752 |
| Tyrosine | 0.9600 | 1.0745 | 0.9830 | 1.0127 | 0.9699 |
| Ureidoisobutyric acid | 0.9951 | 1.0151 | 1.0503 | 0.9592 | 0.9803 |
| Uric acid | 0.9193 | 0.9144 | 1.1038 | 0.9283 | 1.1342 |
| Uridine | 1.1185 | 0.9167 | 0.8406 | 1.1263 | 0.9979 |
| Urobilin | 0.9450 | 1.0586 | 1.0559 | 0.9144 | 1.0261 |
| Urocanic acid | 0.9272 | 1.0609 | 1.0059 | 1.0108 | 0.9951 |
| Ursodeoxycholic acid | 0.9950 | 1.0909 | 1.0504 | 0.8996 | 0.9642 |
| Valeric acid | 1.0166 | 1.0313 | 1.0388 | 0.9636 | 0.9498 |
| Valylserine | 0.9633 | 1.0274 | 1.0708 | 0.9693 | 0.9692 |
| Vanillic acid | 0.9180 | 1.2667 | 0.5766 | 1.0712 | 1.1675 |
| Vitamin A | 0.8953 | 1.1270 | 0.8007 | 0.9507 | 1.2263 |
| Xestoaminol C | 1.0642 | 0.9664 | 0.9177 | 1.0285 | 1.0232 |
| xi-5-Dodecanolide | 0.9859 | 1.0160 | 1.0269 | 0.9614 | 1.0097 |
Factors:
| F1 | Time:0 |
| F2 | Time:120 |
| F3 | Time:180 |
| F4 | Time:30 |
| F5 | Time:60 |