Data for (Study ST000105)
(Analysis AN000173)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 | F8 | F9 | F10 | F11 | F12 | F13 | F14 | F15 | F16 | F17 | F18 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 10-HYDROXYDECANOATE | 1.0940 | 1.1080 | 0.7691 | 1.0526 | 1.1103 | 1.1469 | 1.3487 | 1.2734 | 0.9240 | 0.8311 | 0.7845 | 1.2742 | 0.9819 | 0.7329 | 0.7373 | 1.1543 | 0.8694 | 0.7537 |
| 11-BETA-HYDROXYANDROST-4-ENE-3,17-DIONE | 0.6680 | 1.5263 | 0.3731 | 0.8090 | 0.5245 | 0.5791 | NA | 1.3759 | 1.0802 | 0.4748 | 0.3022 | 0.5701 | 3.6590 | 0.2710 | 3.3478 | 1.2916 | 0.3347 | 0.3806 |
| 1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE | 0.7138 | 1.2493 | 0.4929 | 1.1248 | 0.4508 | 0.9964 | 1.7389 | 1.0980 | 1.4014 | 0.8367 | 0.8625 | 1.8752 | 0.3888 | 0.4764 | 1.1191 | 0.6987 | 1.2331 | 0.5788 |
| 1,2-DIPALMITOYL-SN-GLYCEROL | 0.6984 | 0.4066 | 1.6671 | 1.4333 | 1.2384 | 0.3562 | 0.3782 | 0.3849 | 1.6435 | 2.1987 | NA | 0.6018 | 0.4563 | 0.4340 | 1.0638 | 1.2877 | 0.3150 | 0.6958 |
| 12-HYDROXY-DODECANOIC ACID | 1.1981 | 1.1220 | 0.7576 | 0.7828 | 1.2927 | 1.1869 | 1.1241 | 1.0607 | 0.6482 | 1.1386 | NA | 1.0418 | 1.0797 | 1.3434 | 0.6001 | 0.9195 | 1.0568 | 0.7973 |
| [13C]-ARGININE | 1.0580 | 0.9616 | 1.0885 | 0.9890 | 1.0036 | 0.9798 | 1.3514 | 1.0231 | 1.2421 | 1.0016 | 0.7855 | 1.0343 | 0.9803 | 0.9185 | 1.1245 | 0.9621 | 0.9877 | 0.8343 |
| [13C]-ASPARTIC ACID | 0.9563 | 1.0492 | 0.8096 | 0.9142 | NA | NA | NA | 1.5352 | NA | NA | NA | 0.8896 | 1.0418 | NA | 1.2755 | 1.0656 | 1.0301 | 0.9001 |
| [13C]-GLUTAMATE | 1.0290 | 1.0097 | 1.0104 | 0.9931 | 0.9723 | 0.8889 | 1.0790 | 1.0035 | 1.2225 | 0.9620 | 1.2532 | 1.0537 | 1.0282 | 0.9279 | 0.9879 | 0.9481 | 0.9839 | 0.9594 |
| [13C]-ISOLEUCINE | 0.7582 | NA | 1.3319 | NA | NA | NA | NA | 1.0859 | 1.2474 | 0.6210 | NA | NA | 0.7088 | 1.6492 | 0.9275 | 0.9954 | NA | 0.7968 |
| [13C]-LEUCINE | 1.0368 | 0.9871 | 1.0240 | 1.0251 | 0.9933 | 0.9162 | 0.9896 | 0.9916 | 1.0195 | 0.9874 | 0.9754 | 1.0294 | 1.0234 | 1.0004 | 0.9716 | 0.9827 | 1.0175 | 0.9591 |
| [13C]-LYSINE | 1.0024 | 0.9479 | 1.0873 | 1.0089 | 0.8783 | 0.8281 | 0.9034 | 0.9742 | 0.9298 | 1.0801 | 0.9402 | 1.1222 | 0.9455 | 1.0199 | 0.9516 | 0.9856 | 1.0469 | 1.0787 |
| [13C]-METHIONINE | 1.0088 | 0.9761 | 1.0032 | 1.0273 | 0.9980 | 0.9272 | 1.0037 | 0.9978 | 1.0412 | 0.9920 | 1.0223 | 1.0346 | 1.0026 | 1.0276 | 0.9958 | 0.9493 | 1.0221 | 1.0023 |
| [13C]-PHENYLALANINE | 0.9461 | 0.9607 | 1.0515 | 1.0350 | 0.9705 | 0.8927 | 1.0619 | 0.9587 | 1.0650 | 1.0223 | 1.0546 | 1.0430 | 0.9770 | 1.0160 | 1.0568 | 1.0281 | 0.9774 | 0.9877 |
| [13C]-PROLINE | 0.9771 | 0.9297 | 1.0709 | 1.0320 | 1.0181 | 0.9347 | 0.9077 | 0.8945 | 1.1423 | 1.0463 | 0.9300 | 1.0595 | 0.9130 | 1.0469 | 1.0269 | 1.0217 | 0.9671 | 0.9993 |
| [13C]-THREONINE | 1.0583 | 0.9654 | 0.9970 | 1.0607 | 1.0058 | 0.9849 | 1.0106 | 0.9786 | 1.1203 | 1.0059 | 1.0049 | 1.0706 | 0.9508 | 0.9369 | 0.9654 | 0.8945 | 1.0734 | 0.9412 |
| [13C]-TYROSINE | 1.0522 | 0.9546 | 1.0035 | 1.0594 | 0.9907 | 0.8757 | 0.9272 | 0.9904 | 1.0466 | 1.0045 | 0.9234 | 1.0276 | 1.0606 | 1.0096 | 0.9324 | 0.9603 | 1.0714 | 0.9558 |
| [13C]-VALINE | 1.0334 | 0.9957 | 1.0015 | 0.9944 | 1.0101 | 0.9574 | 1.0623 | 1.0049 | 1.0726 | 0.9673 | 0.9976 | 1.0316 | 1.0167 | 1.0205 | 0.9906 | 0.9543 | 1.0140 | 0.9748 |
| 17ALPHA-HYDROXYPROGESTERONE | 1.0381 | 1.0721 | 0.9155 | 1.3261 | 1.1093 | 0.8993 | 1.1757 | 0.7712 | 0.5309 | NA | NA | 1.5203 | 0.7484 | 0.8616 | 0.8534 | 1.0321 | 0.4312 | 1.0534 |
| 1-METHYLADENOSINE | 0.7787 | 0.8551 | 1.0693 | 1.0862 | 1.0345 | 0.9408 | 0.8374 | 0.7134 | 1.0079 | 0.8718 | 0.9866 | 1.0839 | 0.8145 | 1.2694 | 1.3253 | 0.8501 | 1.0837 | 1.2041 |
| 1-NAPHTHYLAMINE | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 1-OLEOYL-RAC-GLYCEROL | 0.8602 | 1.1485 | 0.3362 | 0.3640 | 1.6070 | 3.0318 | 5.8101 | 2.3154 | 0.5010 | 1.1721 | 0.0604 | 0.5090 | 0.9516 | 0.2222 | 3.2896 | 1.1831 | 0.7258 | 0.2259 |
| 2`,4`-DIHYDROXYACETOPHENONE | 0.8927 | 0.9692 | 0.9970 | 1.0711 | 0.9180 | 0.9123 | 0.7380 | 0.8156 | 0.9529 | 1.0825 | 1.2874 | 0.9020 | 0.9524 | 1.0928 | 0.9091 | 1.0200 | 1.0526 | 1.1759 |
| 2,6-DIHYDROXYPYRIDINE | 1.0975 | 0.9377 | 1.1078 | 0.9271 | 1.0947 | 0.9997 | 1.2520 | 0.8627 | 0.9395 | 0.8419 | 1.0741 | 1.1361 | 0.9681 | 0.9142 | 1.0934 | 1.1969 | 0.8771 | 0.9597 |
| 2-AMINO-2-DEOXYHEXOPYRANOSE | 0.8538 | 0.9548 | 0.9281 | 1.0166 | 1.0717 | 0.9602 | 0.7741 | 0.9216 | 0.9977 | 1.1197 | 1.5291 | 1.1208 | 1.0233 | 1.2176 | 0.9599 | 0.9152 | 0.9556 | 1.1505 |
| 2-AMINOPHENOL | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 2`-DEOXYADENOSINE | 0.6939 | 0.9421 | 0.8687 | NA | 0.6059 | 0.7295 | 0.9481 | 1.3986 | 1.1164 | 0.8449 | NA | NA | 1.7636 | 0.8478 | 1.0194 | 1.3357 | 1.5073 | 0.7517 |
| 2`-DEOXYADENOSINE 5`-DIPHOSPHATE | 0.9708 | 0.9822 | 1.0395 | 0.9780 | NA | 1.0140 | NA | 1.1245 | 1.1871 | 0.9643 | NA | 1.0707 | NA | 0.9040 | NA | 0.9435 | 0.8469 | 1.0721 |
| 2`-DEOXYADENOSINE 5`-MONOPHOSPHATE | 0.9646 | 0.5785 | 0.7787 | 1.4445 | NA | NA | NA | NA | 1.3985 | 0.9499 | NA | NA | NA | 1.0782 | NA | 1.0267 | NA | NA |
| 2`-DEOXYCYTIDINE | 0.5715 | NA | 1.3370 | 1.3515 | 0.9196 | NA | NA | NA | NA | 1.0021 | NA | NA | 0.6109 | 0.8218 | NA | 0.5540 | NA | 0.7914 |
| 2-DEOXY-D-GLUCOSE | 0.8970 | 0.9583 | 1.0296 | 0.9520 | 0.8674 | 0.8836 | 0.9012 | 0.9677 | 0.8135 | 0.9729 | 0.8906 | 1.0339 | 0.9391 | 0.9806 | 1.2426 | 1.1961 | 1.0862 | 1.1159 |
| 2`-DEOXYGUANOSINE | 0.6210 | 0.3539 | 2.5070 | 1.0173 | 0.7699 | 0.3037 | 0.0446 | 0.1601 | 0.6312 | 1.5802 | 1.3555 | 0.2697 | 0.5019 | 2.0225 | 0.3056 | 0.3627 | 1.1811 | 2.0280 |
| 2`-DEOXYGUANOSINE 5`-MONOPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID | NA | 0.8988 | 1.2194 | NA | NA | 0.7358 | NA | 1.2675 | NA | NA | NA | NA | NA | NA | NA | 0.9574 | NA | NA |
| 2-HYDROXYBUTYRIC ACID | 0.8414 | 1.0463 | 1.2220 | 0.9742 | 0.9634 | 0.8526 | 0.9063 | 0.7663 | 0.6757 | 1.4851 | 1.4003 | 1.0030 | 0.8115 | 1.0155 | 1.0512 | 0.8302 | 0.8439 | 1.2369 |
| 2-HYDROXYPHENYLACETIC ACID | 1.5837 | 1.4445 | 1.1124 | 0.8438 | 2.2942 | 1.4004 | 1.6896 | 1.5594 | 0.6137 | 0.6580 | 0.3381 | 0.3686 | 0.7441 | 0.4686 | 0.4175 | 1.0390 | 0.9581 | 0.4131 |
| 2-METHYLGLUTARIC ACID | 1.0648 | 0.9169 | 1.1561 | 1.0335 | 1.1364 | 0.9451 | 1.9184 | 0.9487 | 0.8952 | 0.7942 | 0.6896 | 1.0449 | 0.9706 | 0.9181 | 0.8292 | 0.9349 | 1.0775 | 1.0230 |
| 2-METHYLMALEATE | 1.0057 | 0.8729 | 1.1718 | 1.1782 | 0.6297 | 0.9050 | 1.2038 | 0.9053 | 0.9969 | 1.0807 | 0.5485 | 0.8205 | 0.8147 | 0.9011 | 0.8357 | 0.9216 | 1.1652 | 1.0483 |
| 2-QUINOLINECARBOXYLIC ACID | NA | 0.3317 | 0.4948 | 0.3494 | 0.1792 | 0.3330 | NA | 0.3317 | 0.3123 | 0.4298 | NA | NA | 0.4182 | NA | 1.2184 | 3.1489 | 1.0220 | 1.9094 |
| 3-(2-HYDROXYPHENYL)PROPANOATE | 0.9300 | 0.9872 | 1.0743 | 0.8667 | 0.8762 | 1.0175 | NA | 0.4112 | 0.9299 | 1.1763 | 0.6303 | 0.7811 | 1.0241 | 1.0080 | 0.6544 | 1.1613 | 1.1825 | 1.2449 |
| 3,4-DIHYDROXYBENZOATE | 1.2632 | 0.8683 | 1.0786 | 0.9548 | 1.2478 | 1.1739 | NA | 0.8898 | 0.7677 | 1.2449 | 1.0864 | 1.5723 | 1.0666 | 0.6857 | 1.2136 | 1.1943 | 0.7183 | 0.9026 |
| 3,4-DIHYDROXY-L-PHENYLALANINE | NA | NA | NA | 1.0024 | NA | 1.1215 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8737 | NA |
| 3,4-DIHYDROXYPHENYLACETATE | 0.9749 | NA | 0.8549 | 1.2251 | 0.3194 | 0.6540 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.6246 | 1.2167 | 1.3169 |
| 3,4-DIHYDROXYPHENYL GLYCOL | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 3-(4-HYDROXYPHENYL)LACTATE | 1.4140 | 0.4998 | 2.3893 | 1.1200 | 0.5490 | 0.4635 | NA | NA | 0.4329 | 1.5161 | NA | 0.6185 | NA | NA | NA | 0.4023 | 0.3556 | 0.8629 |
| 3-(4-HYDROXYPHENYL)PYRUVATE | 1.2431 | 0.9499 | 0.8348 | 0.8780 | 1.1017 | 1.5543 | 0.3239 | 0.9048 | 1.2627 | 0.6917 | 0.7757 | 0.3437 | 1.0920 | 0.5997 | 0.7584 | 0.7552 | 1.6271 | 1.2581 |
| 3-ALPHA,11-BETA,17-ALPHA,21-TETRAHYDROXY- 5-ALPHA-PREGNAN-20-ONE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 3ALPHA-HYDROXY-5BETA-CHOLANATE | NA | NA | NA | 1.3171 | 1.1949 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.7731 | NA | 0.9418 |
| 3BETA-HYDROXY-5ALPHA-PREGNAN-20-ONE | 1.5332 | 0.9852 | 0.7577 | 0.8389 | 1.0578 | 0.7405 | NA | 0.5588 | 0.4485 | NA | NA | 0.7144 | 1.2119 | 0.4867 | 1.6196 | 1.8663 | 0.4765 | 1.2995 |
| 3-(CYSTEIN-S-YL)ACETAMINOPHEN (*) | 1.1567 | 1.0124 | 0.8719 | 0.9336 | 1.0596 | 1.0525 | 0.9483 | 1.0002 | 0.9957 | 1.0583 | NA | 0.9334 | 0.9693 | 1.0282 | 0.7370 | 1.0936 | 1.2289 | 0.9898 |
| 3-DEHYDROCARNITINE | 1.0999 | 0.8154 | NA | NA | NA | NA | NA | NA | 0.8687 | NA | NA | 1.6207 | NA | 0.7660 | NA | 0.9569 | NA | NA |
| 3-DEHYDROSHIKIMATE | 1.0890 | 1.0249 | 1.0390 | 1.0882 | NA | NA | NA | 1.4134 | 1.2471 | 0.5341 | NA | 0.5134 | NA | 1.4388 | NA | 0.9500 | 0.9786 | 0.8559 |
| 3`-DEPHOSPHO COA | 0.7575 | 0.8462 | 0.8618 | 0.8439 | NA | NA | 0.9511 | 1.2877 | 0.5043 | NA | 1.3718 | 1.1310 | NA | 1.9727 | 1.1420 | 1.0668 | 1.2422 | 0.5062 |
| 3-HYDROXY-3-METHYLGLUTARATE | 0.9756 | 1.2022 | 1.0558 | 0.9900 | 1.0563 | 1.3330 | 1.5032 | 1.0170 | 0.8610 | NA | NA | 0.7787 | NA | 0.8838 | 1.2989 | 0.9201 | 0.9577 | 0.6997 |
| 3-HYDROXYANTHRANILATE | 1.0529 | 1.0682 | 0.8000 | 1.0730 | 0.7419 | 0.5847 | 1.1822 | 0.2521 | 1.0900 | 1.1603 | 1.6019 | 1.5783 | 1.0493 | 0.8821 | 1.0505 | 0.9986 | 1.0825 | 1.2159 |
| 3-HYDROXYBENZALDEHYDE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 |
| 3-HYDROXY-DL-KYNURENINE | 1.1249 | 0.8621 | 1.3113 | 1.1251 | 0.9362 | 0.9211 | NA | 0.5993 | 1.0682 | 1.0742 | 0.8232 | 0.9500 | 0.8870 | 1.0179 | 0.8393 | 0.8750 | 1.0662 | 0.9768 |
| 3-METHOXY-L-TYROSINE | 0.9239 | 0.9596 | 0.9915 | 0.9642 | 1.0825 | 1.0894 | 1.5728 | 1.1269 | 1.2025 | 1.2143 | 1.1440 | 1.1280 | 1.0909 | 1.0318 | 1.0604 | 0.9409 | 0.8611 | 0.8497 |
| 3-METHOXYTYRAMINE | 0.0712 | NA | NA | 0.1554 | NA | 0.1139 | NA | NA | NA | NA | NA | NA | NA | NA | 3.6595 | NA | NA | NA |
| 3-METHYL-2-OXINDOLE | 0.6901 | 0.8335 | 1.0084 | 0.9400 | 1.0638 | 1.1354 | 0.4676 | 0.8458 | 1.0392 | 1.2226 | NA | 1.1903 | 1.2083 | 0.9783 | 1.2700 | 0.8314 | 1.1600 | 1.1205 |
| 3-UREIDOPROPIONIC ACID | NA | NA | 0.9704 | 0.7878 | 1.2785 | NA | NA | NA | 1.0221 | 0.3937 | NA | NA | NA | 0.9694 | NA | NA | NA | 1.2634 |
| 4-ACETAMIDOBUTANOATE | 0.8032 | 1.0898 | 1.1652 | 1.1418 | 0.8853 | 0.6245 | NA | 1.5019 | 1.0407 | 0.6482 | NA | 0.9532 | NA | NA | 1.0510 | 0.9317 | 0.7948 | 0.7479 |
| 4-AMINOBENZOATE | 1.2297 | 0.9169 | 0.8459 | 1.0403 | 1.0046 | 0.7707 | NA | 0.8488 | 0.6897 | 0.7156 | NA | 1.0979 | 0.6453 | 0.6667 | 0.7046 | 1.3434 | 1.5180 | 1.1250 |
| 4-AMINOBENZOYLGLUTAMIC ACID | 1.1800 | 0.9046 | NA | 0.8420 | 1.3579 | 0.9422 | 0.8407 | NA | NA | 0.7448 | NA | 0.6270 | 0.8986 | 0.7484 | 0.7476 | 1.0730 | 2.6306 | 1.1144 |
| 4-COUMARATE | 0.5925 | 1.0069 | 0.7407 | 1.0071 | 1.0599 | 0.3536 | 0.7856 | 1.0433 | 0.8161 | 1.0650 | NA | 1.1389 | 0.9502 | 0.7139 | 1.7482 | 2.0986 | 0.9155 | 1.1230 |
| 4-GUANIDINOBUTANOIC ACID | 0.9841 | 1.3468 | NA | 0.2826 | 0.9056 | 1.0761 | NA | 1.7674 | NA | 1.3049 | NA | 0.2626 | 0.4205 | NA | 1.0822 | 1.2162 | 0.2809 | NA |
| 4-HYDROXY-3-METHOXYMANDELIC | NA | NA | 0.8220 | 0.8810 | 1.6922 | NA | NA | NA | NA | 1.2179 | NA | NA | NA | 0.4659 | NA | NA | NA | NA |
| 4-HYDROXY-3-METHOXYMANDELIC ACID | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA |
| 4-HYDROXY-3-METHOXYPHENYLGLYCOL | NA | 1.0864 | 1.3857 | NA | NA | 1.0151 | NA | 0.9095 | NA | NA | NA | NA | NA | NA | NA | 0.7509 | NA | NA |
| 4-HYDROXYBENZALDEHYDE | NA | NA | NA | NA | NA | NA | NA | 1.1767 | 0.8233 | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 4-METHYL-2-OXOPENTANOATE | 1.3559 | 1.2401 | 1.1777 | 1.0263 | 1.3032 | 1.1699 | 1.5007 | 0.9317 | 0.6921 | 1.3941 | 0.0962 | 0.1252 | 1.2847 | 0.1294 | 0.8326 | 1.1049 | 0.8624 | 0.3875 |
| 4-METHYLCATECHOL | 0.9529 | 0.9299 | 1.0470 | 1.0391 | 0.8966 | 0.6765 | 1.3621 | 0.7942 | 0.9236 | 0.5556 | NA | 1.2649 | 0.7863 | 1.0616 | 0.6812 | 1.2242 | 1.0745 | 1.0945 |
| 4-NITROPHENYL PHOSPHATE | 0.8047 | 0.7451 | 0.7333 | 0.9985 | 1.3669 | 1.1945 | NA | NA | 1.2304 | 0.3923 | 1.0018 | 0.8412 | NA | 1.4091 | 0.9003 | 1.0047 | 1.0823 | 1.1326 |
| 4-PYRIDOXATE | 0.5642 | 0.9352 | NA | NA | 0.3387 | 0.4833 | 1.4621 | 0.6674 | NA | NA | NA | NA | 0.6354 | NA | 1.5069 | 1.1609 | 0.7770 | 1.9416 |
| 5-AMINOIMIDAZOLE RIBOTIDE (*) | 1.2182 | 1.1506 | 0.7339 | 0.7426 | 1.1952 | 1.5142 | 2.5603 | 1.0682 | 0.8685 | 0.6523 | 0.9239 | 0.6627 | 1.3447 | 0.8648 | 0.7940 | 1.2707 | 1.1253 | 0.7657 |
| 5-AMINOLEVULINIC ACID | 1.1540 | 1.2011 | 1.0546 | 1.2027 | 1.1162 | 0.6386 | NA | NA | 1.3658 | 0.8481 | NA | 1.0468 | NA | 0.5781 | NA | NA | 0.4379 | 1.4333 |
| 5`-DEOXYADENOSINE | 0.8578 | 0.4297 | 2.2229 | 1.3156 | 0.5673 | 0.2476 | 0.3925 | 0.4130 | 0.4816 | 3.0601 | 1.3031 | 0.4951 | 0.5439 | 1.2850 | 0.3395 | 0.4086 | 1.1286 | 1.4909 |
| 5-HYDROXYINDOLE-3-ACETIC ACID | 1.1340 | 1.0523 | 1.1303 | 0.9411 | 1.0557 | 1.3817 | NA | 1.1667 | 0.9102 | 0.9099 | 0.6186 | 0.5412 | 1.2330 | 0.7365 | 0.9583 | 1.2994 | 0.7271 | 0.8293 |
| 5-HYDROXY-L-TRYPTOPHAN | 1.4570 | 0.7225 | 1.1729 | 0.9453 | 1.0816 | 0.5689 | NA | 0.6898 | NA | 1.0122 | NA | 0.8636 | 0.7704 | 0.2748 | 0.8558 | 0.7320 | NA | 2.9244 |
| 5-HYDROXYMETHYLURACIL | NA | 1.0327 | NA | 0.9215 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0458 | NA | NA |
| 5-HYDROXYPENTANOIC ACID | 0.8963 | 0.9975 | 0.8779 | 1.1239 | 1.2032 | 1.1540 | 1.2165 | 0.7901 | 1.0176 | 1.1457 | 0.8464 | 0.9229 | 1.0255 | 1.2355 | 0.8801 | 0.8181 | 1.0557 | 0.9857 |
| 5-METHYLCYTOSINE | 0.9623 | 0.9114 | NA | NA | NA | 1.0042 | NA | 1.4081 | NA | NA | NA | NA | NA | NA | NA | NA | 0.7517 | NA |
| 5`-METHYLTHIOADENOSINE | 0.8708 | 1.0320 | 0.8499 | 0.8851 | 0.9088 | 0.8915 | 0.6301 | 0.9228 | 1.0787 | 0.9283 | NA | 1.0607 | 0.9552 | 0.8274 | 1.5064 | 1.6288 | 1.1524 | 1.0357 |
| 5-OXO-PROLINE | 0.7290 | 0.5586 | 0.6008 | 0.9799 | NA | NA | 0.8087 | 0.7594 | NA | 0.8126 | NA | 0.9840 | 1.0567 | 1.5518 | 1.0670 | NA | 1.3179 | 1.2082 |
| 5-VALEROLACTONE | 0.6787 | 0.8166 | 1.1900 | 1.3287 | 0.9153 | 0.8439 | 0.5668 | 0.7487 | 1.4258 | 1.3180 | 1.4038 | 1.1633 | 0.6542 | 1.2026 | 0.5041 | 0.7121 | 0.8398 | 1.3493 |
| 6,7-DIHYDROBIOPTERIN | 1.2556 | NA | NA | NA | NA | 0.9428 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8016 |
| 6-HYDROXYDOPAMINE | 0.9569 | 0.8531 | 0.9976 | 1.0509 | NA | NA | 0.5956 | 0.8236 | 0.7980 | 1.3355 | 1.1286 | 1.0037 | NA | 0.9201 | NA | NA | 1.1434 | 1.1304 |
| 6-PHOSPHOGLUCONIC ACID | 0.8763 | 0.9776 | 0.7915 | NA | 1.1372 | 0.7100 | NA | NA | NA | 1.1716 | NA | NA | 0.8595 | NA | 1.5999 | NA | NA | NA |
| 7-AMINOCEPHALOSPORANIC ACID | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| ADENOSINE | 0.5626 | 0.1738 | 2.4334 | 0.9112 | 0.4854 | 0.1197 | 0.0480 | 0.1436 | 0.4341 | 1.8967 | 1.0705 | 0.2314 | 0.4255 | 1.6810 | 0.1502 | 0.2675 | 0.8990 | 2.0345 |
| ADENOSINE 3`,5`-CYCLIC MONOPHOSPHATE | 0.8727 | 0.7950 | 1.1759 | 1.0419 | 0.9580 | 1.0248 | 0.7460 | 0.7081 | 1.1331 | 1.2427 | 0.9872 | 1.0126 | 0.8723 | 1.1428 | 0.9281 | 0.8627 | 1.0351 | 1.1573 |
| ADENOSINE 5`-MONOPHOSPHATE | 0.9965 | NA | 1.4062 | 0.6936 | NA | NA | NA | NA | NA | 0.6376 | NA | NA | NA | 0.8526 | NA | NA | NA | 1.1373 |
| ADENOSINE 5`-MONOPHOSPHATE (*) | 0.6459 | NA | 1.3102 | 0.7791 | NA | NA | NA | NA | NA | 0.6628 | NA | NA | NA | 0.7864 | NA | NA | NA | 1.2265 |
| ADENOSINE DIPHOSPHATE | 0.9143 | 0.9550 | 1.0111 | 0.9266 | 0.9316 | NA | NA | 1.1113 | 1.0306 | 1.0139 | 0.9392 | 0.9800 | 1.1181 | 1.0650 | NA | 1.1350 | 0.9885 | 1.0937 |
| ALANINE | 0.9203 | 0.9375 | 1.0012 | 0.9918 | 1.2381 | 1.3959 | 0.9240 | 1.0266 | 1.1978 | 1.1146 | 1.1807 | 1.1871 | 0.8467 | 0.8605 | 1.0544 | 1.0020 | 0.7877 | 0.9436 |
| ALLANTOIN | 1.2485 | 0.6516 | 0.8172 | 0.9379 | 2.2689 | NA | NA | 0.5140 | 0.8031 | NA | NA | 1.2757 | NA | 1.9039 | NA | NA | 1.6774 | 0.9403 |
| ALPHA-KETO-GLUTARATE | 0.9444 | 0.7911 | 1.5011 | 1.2494 | 1.1985 | 0.7942 | 0.4944 | NA | 1.5549 | 1.6056 | NA | NA | 0.7536 | NA | 1.1550 | 0.8829 | 0.6511 | 0.9999 |
| ALPHA-LIPOAMIDE | 1.2267 | 0.7583 | 0.7743 | NA | NA | 0.6802 | 0.6707 | 0.7973 | NA | 0.8914 | NA | NA | 0.4720 | 0.5533 | NA | 3.7512 | NA | NA |
| ALPHA-TOCOPHEROL | 1.0040 | 1.0857 | 0.8915 | 1.0004 | 1.0665 | 1.1139 | 1.1110 | 1.1156 | 0.9695 | 0.7780 | 1.4525 | 1.0974 | 0.9053 | 1.0647 | 1.0477 | 0.8011 | 0.9535 | 1.0309 |
| AMINOHYDROXYBENZOIC ACID | 0.5823 | 1.2651 | 0.8850 | 1.2147 | 1.6004 | 0.6063 | NA | NA | NA | 0.9522 | NA | NA | NA | NA | 1.0140 | 0.8244 | 1.3373 | 0.9080 |
| AMINOHYDROXYBUTANOIC ACID | 0.9287 | 1.0716 | 1.5431 | 1.0563 | 1.0501 | 1.2396 | 1.0963 | 1.0928 | 1.1570 | 1.2761 | 0.8805 | 0.7925 | 1.0139 | 0.6377 | NA | 0.7791 | 1.0059 | 0.6199 |
| ANDROSTERONE | 0.8762 | 0.9373 | 0.8649 | 0.9764 | NA | 0.7128 | NA | NA | NA | NA | NA | 0.1613 | 0.7339 | 1.2746 | 1.6857 | 0.9344 | 1.5439 | 0.8439 |
| ANILINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| ANTHRANILATE | 0.8877 | 0.9354 | 1.2160 | 1.0718 | 0.9501 | 0.7970 | 0.7521 | 1.1824 | 0.8615 | 0.8813 | 1.3101 | 1.1705 | 1.0251 | 1.1540 | 0.9992 | 0.8717 | 0.8274 | 1.0902 |
| ARACHIDONOYLGLYCEROPHOSPHOCHOLINE (*) | 1.2577 | 0.8193 | 1.0369 | 0.9052 | 0.7665 | 0.6992 | 0.8845 | 1.1641 | 0.8440 | 0.8609 | 0.7282 | 0.8823 | 0.7037 | 0.9324 | 1.2061 | 1.1629 | 1.2744 | 1.2277 |
| ARG-VAL-TRP | 1.5057 | 1.2877 | 0.7138 | 0.6730 | 1.2735 | 1.1657 | 0.7870 | 1.0948 | 0.6609 | 0.8115 | 1.0133 | 0.6597 | 1.3426 | 0.6362 | 0.7921 | 1.0218 | 0.9829 | 0.9652 |
| ASCORBATE | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| ASPARAGINE | 0.9104 | 0.8853 | 1.2238 | 0.9597 | 0.7558 | 0.6415 | NA | 0.8881 | 0.6596 | 1.0583 | 1.8973 | 1.1171 | 0.9998 | 1.1505 | 1.4223 | 0.8954 | 1.2567 | 0.9953 |
| ASPARTATE | NA | NA | 0.4379 | 0.5912 | NA | NA | NA | NA | NA | 0.7674 | NA | NA | NA | NA | NA | 1.1416 | 2.0620 | NA |
| AZELAIC ACID | 1.2453 | 1.1663 | 1.2092 | 1.1577 | 0.7796 | 1.0052 | 0.7878 | 1.7043 | 0.5010 | 0.6536 | 0.3372 | 0.9550 | 1.0459 | 0.4986 | 0.4474 | 1.1484 | 0.8015 | 0.7372 |
| BENZENEDICARBOXYLIC ACID | 0.5036 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.4964 | NA |
| BENZOIN | NA | NA | 0.2663 | 0.2017 | NA | NA | NA | NA | NA | NA | NA | NA | 0.8259 | NA | NA | 1.8530 | NA | NA |
| BETAINE | 1.5359 | 1.2252 | 0.7810 | 0.7720 | 0.9837 | 1.2401 | 1.5918 | 1.5164 | 0.8150 | 0.8921 | 0.8069 | 0.7291 | 1.1963 | 0.6371 | 1.0796 | 0.9229 | 0.8519 | 0.7190 |
| BILIVERDIN | 1.0098 | 1.0285 | 0.9273 | 1.2536 | 0.8807 | 0.8353 | 2.0447 | 1.0110 | 0.6103 | 0.7853 | 1.1791 | 1.0943 | 1.3267 | 1.5247 | 0.5746 | 0.8732 | 0.8826 | 1.0989 |
| BIOPTERIN | NA | 1.0385 | NA | NA | NA | NA | 0.9615 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| BIOTIN | 0.7146 | 0.6279 | 0.6524 | 0.6541 | 0.6123 | 0.7598 | 0.4252 | 0.6611 | 0.6062 | 0.7072 | 0.3693 | 0.8304 | 0.7291 | 0.7157 | 0.5833 | 0.6716 | 0.6888 | 4.6020 |
| BIS(2-ETHYLHEXYL)PHTHALATE | 1.2866 | 1.1242 | 1.0417 | 0.9363 | 1.0830 | 1.1787 | 1.2128 | 1.1211 | 0.5241 | 1.1426 | 0.0762 | 1.0014 | 1.2731 | 0.8254 | 0.9701 | 0.8920 | 1.0940 | 0.7198 |
| BISPHOSPHOGLYCERATE | NA | NA | 0.9215 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0785 | NA |
| BOC-ALA (+NA) | 1.2034 | 1.1511 | 0.7936 | 0.9430 | 1.0675 | 1.1988 | 0.9815 | 1.0188 | 0.8499 | 1.0445 | 1.0028 | 0.8629 | 1.2581 | 0.9706 | 0.7032 | 1.0235 | 0.8361 | 0.9843 |
| BOC-ALA-OH | 1.2045 | 1.1547 | 0.7911 | 0.9425 | 1.0649 | 1.2016 | 0.9821 | 1.0220 | 0.8511 | 1.0458 | 1.0066 | 0.8565 | 1.2648 | 0.9677 | 0.7026 | 1.0219 | 0.8356 | 0.9811 |
| BOC-ASN | 0.9841 | 0.9493 | 1.0366 | 1.0352 | 1.0089 | 0.9163 | 0.9439 | 0.9847 | 1.0302 | 1.0657 | 1.0608 | 0.9655 | 0.9374 | 1.0243 | 1.0272 | 1.0340 | 0.9574 | 1.0226 |
| BOC-ASP-OH | 0.9953 | 0.9486 | 1.0344 | 1.0444 | 1.0072 | 0.9121 | 0.9026 | 0.9655 | 1.0093 | 1.1020 | 1.1335 | 0.9332 | 0.9473 | 1.0288 | 0.9729 | 1.0570 | 0.9269 | 1.0355 |
| BOC-GLY-OH | 1.0048 | NA | 1.5392 | 0.3825 | NA | 1.0151 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0536 | NA |
| BOC-HIS-OH | 0.7946 | 0.9417 | 0.9498 | 1.3923 | 1.3585 | 1.4250 | 1.5337 | 0.7784 | 0.9145 | 0.8822 | 1.1209 | 1.2855 | 0.8756 | 0.9210 | 0.7673 | 0.8086 | 0.8122 | 0.9723 |
| BOC-LYS-OH | 0.6351 | 0.7189 | 0.7430 | 1.3474 | 1.1992 | 1.1665 | NA | 0.3659 | 1.1252 | 0.8024 | 0.8735 | 0.4009 | 1.1920 | 1.4786 | 0.8382 | 1.1734 | 1.5400 | 1.0306 |
| BOC-MET-OH | NA | 0.6649 | NA | NA | NA | 1.4079 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9271 | NA |
| BOC-PHE-OH | 1.2369 | 1.1403 | 0.7909 | 0.9303 | 1.0857 | 1.1619 | 0.9188 | 1.0224 | 0.9103 | 1.0582 | 1.1181 | 0.8698 | 1.1346 | 1.0257 | 0.6641 | 1.0327 | 0.8200 | 1.0061 |
| BOC-PRO-OH | 1.0452 | 0.9216 | 1.2065 | 0.7085 | 0.8099 | 0.9756 | NA | 0.7173 | NA | 1.1676 | NA | 1.2501 | 0.9610 | 0.7998 | 1.2786 | 1.0488 | 1.0843 | 1.6148 |
| BOC-SER-OH | 0.6260 | 0.6922 | 1.3585 | NA | NA | NA | NA | 1.1141 | NA | 0.6994 | NA | 1.3876 | NA | NA | 1.4132 | 1.4881 | 0.8743 | 1.2365 |
| BRADYKININ (*) | 0.6844 | 0.5063 | 0.9283 | 0.8265 | 0.7784 | NA | NA | 1.0854 | NA | 2.6950 | NA | NA | 0.9150 | 0.5750 | NA | NA | 1.5360 | NA |
| BRADYKININ DES-ARG(9) (*) | 0.9142 | 1.1236 | 0.8863 | 1.1887 | 1.1004 | 1.0887 | 0.1518 | 1.1931 | 1.2507 | 1.2028 | 1.1312 | 1.2735 | 0.5037 | 0.6598 | 0.9697 | 1.0689 | 0.5704 | 0.7815 |
| BRADYKININ HYDROXY-PRO(3) (*) | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| BUTYRYLCARNITINE (*) | 0.7634 | 0.9413 | 0.9544 | 0.9345 | 0.9637 | 1.0570 | 0.5903 | 1.0327 | 1.0795 | 1.1467 | 0.6170 | 0.8003 | 0.8173 | 1.1082 | 1.1745 | 1.2331 | 0.9782 | 1.3361 |
| CADAVERINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| CAFFEIC ACID | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| CAFFEINE | NA | 1.3651 | 0.7726 | 2.8830 | NA | 0.0530 | 0.8860 | 0.0779 | 0.2904 | 0.4958 | 2.0131 | 0.2947 | 0.2896 | 0.5453 | 0.4655 | NA | 0.9830 | 0.6142 |
| CAPECITABINE | 1.1574 | 0.8988 | NA | NA | 1.3272 | 0.8213 | NA | 1.0752 | 0.6816 | NA | NA | NA | NA | NA | NA | 1.1258 | NA | 0.8076 |
| CARNOSINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| CERAMIDE PHOSPHOCHOLINE (*) | 1.8381 | 1.1896 | 0.8023 | 0.8103 | 1.1633 | 1.3450 | 1.0199 | 0.9770 | 0.9512 | 0.6695 | 0.5379 | 0.9418 | 0.7200 | 0.5444 | 0.5604 | 0.5132 | 1.9018 | 0.6721 |
| C-GLYCOSYLTRYPTOPHAN (*) | 0.7995 | 0.8847 | 0.9911 | 0.9973 | 1.0273 | 0.8913 | 0.6935 | 0.8767 | 1.0905 | 1.0381 | 0.7416 | 0.9833 | 0.9808 | 1.0564 | 1.3228 | 1.1960 | 1.0540 | 1.1210 |
| CHOLIC ACID | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| CINNAMOYLGLYCINE (*) | 0.9070 | 0.8836 | 1.3075 | 1.0446 | 0.7570 | 0.8662 | 0.7144 | 1.0697 | 1.0320 | 1.2703 | 0.7419 | 0.9232 | 0.9144 | 0.6383 | 1.2031 | 1.0853 | 1.2277 | 0.8486 |
| CINNAMOYLGLYCINE (*) | 0.8553 | 0.7708 | 1.1162 | 1.0297 | 0.8152 | 0.8858 | 0.5417 | 0.8379 | 1.2535 | 1.0732 | 0.7364 | 0.6861 | 0.8354 | 1.0116 | 1.0552 | 1.1460 | 1.2226 | 1.2557 |
| CIS-4-DECENOYL CARNITINE (*) | 0.7106 | 0.7285 | 1.0670 | 1.1779 | 0.8885 | 0.9313 | 0.5619 | 0.6745 | 1.7973 | 1.5509 | 0.8097 | 1.4897 | 0.7411 | 0.8291 | 0.7691 | 0.7999 | 1.3884 | 1.0688 |
| CIS-7,10,13,16-DOCOSATETRAENOIC ACID | 1.1434 | 1.0315 | NA | NA | 1.0328 | 0.9717 | 0.9609 | NA | NA | NA | NA | 0.9704 | 1.0389 | NA | NA | 0.8361 | 0.5297 | NA |
| CIS-ACONITATE | 0.8678 | 0.9656 | 0.8680 | 1.0186 | 1.1374 | 0.9818 | NA | 0.6535 | 0.5778 | 1.1239 | 0.9756 | 0.6463 | 0.5712 | NA | 1.6366 | 1.0931 | 0.9402 | 1.0625 |
| CITRAMALATE | 0.9866 | 1.1881 | 0.6430 | 0.9565 | 1.7155 | 0.7521 | 0.6790 | 1.1068 | 0.5336 | 0.8869 | NA | 0.5304 | 0.7993 | NA | 1.5649 | 1.0784 | 1.1422 | 0.8262 |
| CITRATE | 1.2174 | 0.9038 | 1.1705 | 0.8852 | 1.3677 | 1.0395 | 0.9250 | 0.8041 | 1.7541 | 1.0991 | 0.7279 | 1.1059 | 0.7449 | 0.7317 | 1.2701 | 0.9390 | 1.0725 | 0.6870 |
| CITRULLINE | 1.1072 | 1.0653 | 1.0317 | 0.8907 | 1.0093 | 0.9350 | 0.9617 | 1.0540 | 0.9091 | 0.8426 | 0.8228 | 1.0092 | 1.0694 | 0.9321 | 1.1094 | 1.1125 | 0.9624 | 0.9164 |
| CORTICOSTERONE | 2.6928 | 0.7946 | 0.0754 | 0.6799 | 2.3652 | NA | NA | 2.5686 | NA | 1.4173 | NA | 0.1085 | 0.0670 | NA | 0.0573 | 1.3079 | 0.0501 | 1.3074 |
| CORTISOL | 0.8401 | 0.7025 | 1.3932 | 1.0647 | 0.5189 | 0.6017 | NA | 0.4723 | 1.0486 | 1.2598 | 1.3496 | 1.1885 | 0.5904 | 1.4272 | 0.6192 | 0.6136 | 1.0973 | 1.2009 |
| CORTISOL 21-ACETATE | 0.9311 | 1.3341 | 0.8205 | 0.4964 | 1.2078 | 0.6837 | 0.4786 | 0.7264 | 2.3296 | 0.5731 | NA | 1.2515 | 0.7173 | 0.8663 | 0.1278 | 0.8716 | 1.8029 | 0.7802 |
| CORTISONE | 1.3097 | 0.8450 | 0.6701 | 1.4046 | 0.5110 | 1.6434 | 2.9888 | 1.1521 | 1.8979 | 0.0934 | NA | 0.7360 | 0.6066 | 0.1050 | 1.3442 | 1.0827 | 1.3790 | 0.9322 |
| COTININE (*) | 0.5413 | 0.1321 | 2.5236 | 0.6449 | 1.3510 | 0.8745 | NA | NA | 1.6681 | 1.3962 | NA | 0.2501 | NA | 0.7858 | 0.5637 | 0.6390 | 0.8359 | 0.6793 |
| CREATINE | 0.9577 | 0.8853 | 1.0492 | 1.0076 | 1.2194 | 1.4682 | 0.9217 | 1.0510 | 1.1390 | 1.2356 | 1.2690 | 1.2620 | 0.8072 | 0.9121 | 0.9302 | 1.0014 | 0.7375 | 0.9040 |
| CREATININE | 0.9652 | 0.8220 | 1.0880 | 0.9340 | 1.0066 | 0.9806 | 0.5979 | 0.7119 | 0.9839 | 0.9096 | 0.7766 | 0.8978 | 1.0896 | 1.2363 | 1.1740 | 1.1242 | 1.1993 | 1.1301 |
| CREATININE FROM COMPLEX | 1.0065 | 0.8116 | 1.1369 | 0.9516 | 0.9815 | 0.9568 | 0.5711 | 0.6122 | 1.0062 | 0.8865 | 0.6963 | 0.8498 | 1.1478 | 1.3013 | 1.0586 | 1.0293 | 1.2985 | 1.1355 |
| CYCLOHEX-1-ENECARBOXYLIC ACID | NA | NA | 0.7560 | 1.0952 | NA | NA | NA | NA | 1.3813 | 0.7523 | NA | NA | NA | 1.1967 | NA | NA | NA | 0.7949 |
| CYCLOHEXANE-1,3-DIONE | 0.8736 | 1.0633 | 1.1763 | 1.2099 | 1.2629 | 0.7366 | 0.5635 | 0.4905 | 1.1704 | 1.4772 | NA | 0.8675 | 1.2900 | 0.6684 | 0.5799 | 0.9154 | 0.5579 | 0.8261 |
| CYSTATHIONINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA |
| CYSTEINE | 0.7370 | 0.7594 | 0.9736 | 1.3414 | 0.6804 | 0.7306 | 0.5653 | 0.6409 | 1.1241 | 1.2598 | 1.6866 | 1.5296 | 0.9258 | 1.8689 | 0.4471 | 0.6082 | 0.7678 | 1.5028 |
| CYSTINE | 0.9574 | 1.2087 | 1.1498 | 0.9211 | 0.8104 | 0.7106 | 1.9418 | 0.5773 | 1.0095 | 0.8542 | 0.0575 | 1.8388 | 1.0518 | 0.6704 | 0.8327 | 0.9824 | 1.0490 | 1.0371 |
| CYTIDINE | NA | 1.0278 | 0.6061 | 0.9921 | 0.9721 | 0.8191 | NA | 0.8902 | NA | 0.6679 | NA | 1.0041 | NA | NA | 1.3344 | NA | 1.1727 | 1.0212 |
| CYTIDINE 5`-DIPHOSPHOCHOLINE | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| CYTOSINE | 1.0588 | 0.9770 | 0.9697 | 0.9857 | 1.0107 | 0.9151 | 0.6691 | 0.9275 | 0.9647 | 0.9209 | 0.7153 | 0.9876 | 1.0027 | 1.1418 | 1.1536 | 0.9275 | 1.0904 | 1.0746 |
| DECANOYLCARNITINE (*) | 0.5196 | 0.4403 | 1.4587 | 1.3854 | 0.7358 | 0.6567 | NA | 0.4604 | 2.1716 | 1.8832 | 0.9794 | 1.2494 | 0.5914 | 0.9337 | 0.6378 | 0.5392 | 1.5105 | 1.1470 |
| DEOXYCHOLATE | 1.0263 | 0.9208 | 1.5304 | 0.9468 | 0.6695 | 2.7382 | 0.0427 | 0.3342 | 2.4358 | 1.5365 | 0.2163 | 0.2342 | 0.3048 | 0.1297 | 1.8474 | 1.6479 | 0.3100 | 0.4890 |
| DEOXYCORTICOSTERONE | 1.0266 | 1.1827 | 0.7241 | 1.2974 | 1.1722 | 2.0248 | NA | 0.9252 | 1.1414 | 0.4261 | 0.3410 | 1.3714 | 0.3510 | 0.3563 | 0.9700 | 1.2135 | 0.4947 | 0.9456 |
| DEOXYRIBOSE | NA | 0.8751 | 0.7698 | 1.1138 | 1.5488 | 0.8672 | NA | 1.1496 | 0.9121 | NA | NA | NA | 0.8477 | 0.9052 | NA | 1.2417 | NA | 0.8785 |
| DEOXYURIDINE | 0.9106 | 0.8712 | 1.0109 | 1.1666 | 0.8496 | 1.0346 | NA | 1.0271 | 0.7601 | 0.9772 | 0.8987 | 1.1701 | 0.8443 | 1.0859 | 1.1291 | 1.0316 | 0.9176 | 1.0238 |
| DETHIOBIOTIN | 0.3261 | 0.4222 | 1.2725 | 0.2212 | NA | NA | NA | NA | 0.2209 | 0.2122 | NA | NA | NA | NA | NA | 0.6931 | 2.6211 | 1.7726 |
| D-GLUCONO-1,5-LACTONE | 0.8826 | 1.0648 | 0.8321 | 1.0154 | NA | NA | NA | NA | NA | NA | NA | 1.6422 | 0.7280 | NA | NA | 0.8267 | 0.6704 | 1.6810 |
| DIACYL-GLYCEROPHOSPHOCHOLINE (C50H82NO8P PROBABLY) | 0.1506 | 0.5361 | 0.2449 | 1.3134 | 0.1195 | 0.1722 | NA | NA | 2.9660 | 1.7743 | 0.5382 | 1.3115 | 0.0842 | 0.4828 | 2.1126 | 0.9489 | 0.6316 | 1.7205 |
| DIACYLGLYCEROPHOSPHOGLYCEROL (*) | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.7595 | 0.7386 | 1.5019 | NA | NA | NA | NA |
| DIACYL-PHOSPHATIDYLCHOLINE | 1.3066 | 1.1331 | 0.3677 | 1.0973 | 1.3800 | 0.6170 | 0.7754 | 0.8812 | 0.8463 | NA | NA | 0.9653 | 1.0563 | 0.7145 | 0.9120 | 1.2026 | 0.8467 | 1.0756 |
| DIETHANOLAMINE | 0.7087 | 0.7970 | 1.5601 | 1.0687 | 0.9301 | NA | NA | NA | 0.7382 | NA | NA | 1.6695 | 0.9996 | NA | NA | 0.9560 | 0.8844 | 0.7364 |
| DIETHYL AMINOMALONATE | NA | 0.0910 | 1.8565 | NA | 0.1052 | NA | NA | NA | NA | NA | NA | 1.9473 | NA | NA | NA | NA | NA | NA |
| DIHEXOSE | 1.0435 | 1.3824 | 0.6944 | 0.5996 | 1.3569 | 1.5544 | 0.5157 | 1.3602 | 1.0239 | 0.3064 | NA | 0.3411 | 1.5861 | 0.9232 | 1.9114 | 1.1423 | 0.4739 | 0.6437 |
| DIHYDROFOLATE | NA | NA | 1.1940 | 0.9636 | NA | NA | NA | NA | NA | NA | NA | 0.8091 | NA | NA | NA | NA | NA | 1.1061 |
| DIHYDROOROTATE | 1.5197 | 0.7564 | 0.5952 | 1.3165 | NA | NA | NA | 0.9769 | 0.6910 | NA | NA | 0.7794 | 1.6771 | NA | 1.0879 | 1.0699 | 0.9707 | 0.7762 |
| DIHYDROXYBENZOIC ACID | 1.2561 | 1.5030 | 0.3445 | 0.4846 | 0.8153 | 0.4977 | 0.5704 | NA | 2.1380 | 0.6486 | NA | 0.4806 | 0.5970 | 0.4668 | 0.7838 | 2.3914 | 0.6259 | 1.4821 |
| DI-LINOLEOYL-3-SN-PHOSPHATIDYLCHOLINE (POSSIBLY) | 0.9617 | 0.8137 | 1.3580 | 1.1633 | 0.8566 | 0.5053 | 0.5048 | 0.8450 | 2.5103 | 0.3788 | 2.6411 | 0.9714 | 0.5021 | 0.7545 | 0.5068 | 1.2215 | 0.8372 | 1.3907 |
| DI-LINOLEOYL-3-SN-PHOSPHATIDYLCHOLINE (PROBABLY) | 0.7984 | 1.0189 | 1.1508 | 1.0694 | NA | 0.0857 | NA | 1.1312 | 0.8485 | 0.9013 | 0.9050 | 0.9023 | NA | 0.8976 | 1.0681 | 1.1215 | 0.8638 | 1.1422 |
| DIMETHYLARGININE (*) | 0.9405 | 0.7643 | 1.1781 | 1.0153 | 1.2093 | 1.0505 | 0.4641 | 0.8399 | 1.2066 | 1.1209 | 0.8439 | 1.2878 | 0.8147 | 1.2152 | 1.1707 | 1.0117 | 0.9350 | 0.9467 |
| DIMETHYLBENZIMIDAZOLE | 1.9699 | 0.5755 | NA | 0.5515 | 0.5910 | NA | NA | 0.4055 | 0.3613 | 0.7599 | 0.3331 | 2.4327 | NA | NA | 1.2192 | 0.3690 | 1.4077 | 0.9806 |
| DIMETHYLGUANOSINE (*) | 0.8593 | 0.8813 | 1.0442 | 0.9813 | 1.0620 | 0.9966 | 0.8087 | 1.0338 | 1.1399 | 1.0703 | 0.9316 | 1.1093 | 0.8749 | 0.9468 | 1.1769 | 1.1214 | 1.0216 | 1.0363 |
| DIMETHYL MALEATE | 1.2616 | 0.9768 | 1.2401 | 0.9827 | 1.0208 | 0.9228 | 0.7256 | 0.7402 | 0.8446 | 1.1045 | 1.8404 | 0.8452 | 0.8062 | 0.7826 | 1.0445 | 1.0036 | 0.8954 | 0.9759 |
| DIMETHYLXANTHINE | 0.6149 | 1.1281 | 1.1817 | 0.9922 | 0.2814 | 0.8622 | 0.7158 | 1.3639 | 0.9379 | 1.9422 | 2.7321 | 0.6639 | NA | 0.6856 | 0.7680 | 0.6022 | 1.5510 | 1.0550 |
| DIMETHYLXANTHINE (*) | 0.7616 | 0.5680 | 1.4055 | 1.0999 | 0.4523 | 0.2890 | 0.2831 | 0.3429 | 1.1244 | 0.7527 | 0.4833 | 0.5927 | 1.1733 | 2.2726 | 1.1767 | 0.3368 | 1.6946 | 1.3303 |
| DIOLEOYLPHOSPHATIDYLCHOLINE | 1.0840 | 1.0717 | 0.7594 | 0.8852 | 1.0315 | 1.4344 | 1.4761 | 1.0920 | 0.9455 | 1.3900 | 0.9918 | 1.0653 | 0.7148 | 0.9973 | 0.8642 | 1.2112 | 0.8140 | 0.8961 |
| DIPALMITOYLGLYCEROL (*) | 0.2805 | 1.6718 | 1.2798 | 0.9320 | 0.9492 | 0.7514 | 0.9346 | 1.1371 | 0.2309 | 0.2639 | 0.7041 | 0.3810 | 1.7094 | 0.5733 | 1.3612 | 0.6402 | 0.9780 | 0.5450 |
| DI-TERT-BUTYL DICARBONATE | 0.0787 | 0.0377 | 9.3686 | 0.0787 | NA | 0.1356 | NA | 0.0689 | NA | NA | 0.0526 | NA | NA | NA | 0.0831 | 0.0564 | 0.0372 | 0.0678 |
| DOCOSAHEXAENOIC ACID | 1.1589 | 0.7744 | 1.0661 | 0.9259 | 1.1511 | 0.8424 | 0.8149 | 0.9853 | 1.3074 | 1.2182 | 1.1352 | 0.7010 | 0.7058 | 0.5318 | 1.7185 | 1.1693 | 1.1379 | 0.8057 |
| DOCOSAHEXAENOYLGLYCEROPHOSPHOCHOLINE (*) | 0.9982 | 0.8470 | 0.9606 | 1.0714 | 0.8009 | 0.8173 | 0.9984 | 0.9112 | 0.8644 | 1.1648 | 0.8846 | 0.8735 | 0.8168 | 0.8641 | 1.1243 | 1.2964 | 1.0838 | 1.2058 |
| DOCOSAHEXAENOYLGLYCEROPHOSPHOETHANOLAMINE (*) | 0.7973 | 0.8014 | 0.6409 | 0.8588 | 0.9885 | 0.6085 | NA | 0.7835 | 0.6616 | 0.6469 | NA | 0.5113 | 0.6960 | 0.6219 | 0.8175 | 3.2990 | 1.0025 | 0.8680 |
| DOCOSAPENTAENOYLGLYCEROPHOSPHOCHOLINE | 1.0059 | 0.6219 | 1.2687 | 1.2945 | 0.6130 | 0.5269 | 0.5931 | 0.7780 | 2.6689 | 0.6354 | 0.7319 | 0.4021 | 0.4046 | 0.6305 | 0.6623 | 1.1057 | 1.0507 | 1.2344 |
| DOPAMINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9948 | NA | 1.0052 | NA |
| EDTA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| EDTA (*) | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| EICOSATRIENOYLGLYCEROPHOSPHOCHOLINE (*) | 1.3244 | 1.0091 | 0.9117 | 0.8192 | 0.8745 | 1.1815 | 1.5062 | 1.4247 | 0.8590 | 0.8531 | 0.5814 | 0.7224 | 0.8516 | 0.6755 | 1.2194 | 0.9603 | 1.3943 | 0.9182 |
| ENKEPHALINE, (D-ALA)2-LEU | 1.2388 | 1.0254 | 1.0120 | 0.7784 | NA | 1.1807 | NA | NA | NA | 0.8160 | 0.5925 | NA | NA | NA | 1.7145 | NA | 0.9185 | 1.1324 |
| EPINEPHRINE | 0.8540 | 0.9735 | 0.9134 | 0.9924 | 0.9100 | 0.9159 | 1.0639 | 0.9686 | 0.8455 | 1.0213 | 1.4539 | 1.1729 | 1.0374 | 1.2617 | 0.8223 | 1.0771 | 0.9490 | 1.2084 |
| ERYTHRITOL | 1.0062 | 0.9205 | NA | 1.0292 | NA | 0.9547 | 1.0235 | NA | 1.0576 | 0.9941 | 1.0245 | NA | NA | 0.9678 | 0.8916 | NA | 1.0331 | 1.1000 |
| ESTRADIOL 17 ALPHA | NA | 0.1472 | 0.3369 | 1.1232 | NA | 0.7783 | NA | NA | 1.2386 | NA | 0.7798 | 1.5472 | NA | 1.4297 | 0.2134 | 1.5282 | 0.8567 | NA |
| ESTRONE | 1.8182 | 0.9584 | 0.6472 | 0.7520 | 0.7731 | 1.0244 | 0.7871 | 1.0445 | 1.8298 | 0.7877 | NA | 0.6410 | NA | 0.6901 | NA | 2.6630 | 0.6771 | 0.9724 |
| ETHANOLAMINE | 1.1132 | 0.9957 | 1.0287 | 0.8217 | NA | NA | NA | 1.4725 | NA | 0.8300 | NA | NA | NA | NA | 1.2334 | NA | 0.7237 | NA |
| ETHYL 3-INDOLE ACETATE | 0.7931 | 0.7661 | 0.8765 | 0.8239 | 0.6344 | 0.7128 | NA | 1.1153 | 0.9769 | 0.8411 | 0.6997 | 0.7543 | 0.9418 | 0.9371 | 0.7610 | 1.1772 | 1.8713 | 1.7020 |
| ETHYL 4-OXOCYCLOHEXANECARBOXYLATE | 0.6567 | 0.8341 | 1.0676 | 1.2327 | 0.8944 | 0.7760 | 1.2190 | 0.8328 | 1.2823 | 1.1390 | 1.3652 | 1.0275 | 0.8683 | 1.1360 | 0.9258 | 0.9044 | 1.1709 | 1.1102 |
| ETHYLMALONIC ACID | 1.0523 | 0.9819 | 0.9314 | 1.0568 | 1.0813 | 1.0033 | 0.7780 | 1.0562 | 1.0631 | 1.0412 | 0.8857 | 1.3002 | 0.8738 | 0.7730 | 1.0260 | 0.9703 | 0.8420 | 1.0399 |
| FERULATE | 0.8806 | 0.8189 | 1.0209 | 1.0818 | 0.6486 | 0.8634 | 1.3979 | 0.8098 | 1.2648 | 1.5894 | 0.7097 | 0.9883 | 0.8154 | 0.7129 | 0.8937 | 1.6694 | 0.8021 | 0.9919 |
| FLAVIN ADENINE DINUCLEOTIDE | NA | 1.1827 | NA | 0.7102 | 0.7437 | 1.3296 | NA | NA | NA | 1.0241 | NA | NA | NA | NA | NA | NA | 0.9616 | NA |
| FOLIC ACID | NA | 0.7219 | 0.7711 | 0.6666 | NA | NA | NA | 3.9008 | NA | NA | NA | NA | 3.7473 | NA | NA | 0.4998 | 0.5413 | 0.6353 |
| FORMYL-L-METHIONINE | NA | 0.9583 | 0.8658 | 0.6098 | 1.5532 | NA | NA | NA | NA | NA | NA | NA | NA | 0.7729 | NA | NA | 1.3945 | 1.0358 |
| GAMMA-BUTYROLACTONE | 1.1020 | 0.8003 | 1.2229 | 1.6597 | 0.6626 | 0.3043 | 0.4599 | 0.6837 | 1.3800 | 1.9012 | NA | 0.7894 | 1.3839 | 0.2496 | 0.9063 | 0.8859 | 0.7048 | 0.5617 |
| GAMMA-GLUTAMYLISOLEUCINE (*) | 1.0639 | 0.6223 | 1.2192 | 0.6485 | 0.6827 | 0.6889 | NA | 1.7657 | 0.6803 | 0.6549 | 0.5640 | 1.6509 | 0.6467 | 0.6721 | 0.9973 | 1.4449 | 1.8691 | 1.0699 |
| GAMMA-GLUTAMYLMETHIONINE (*) | 1.1311 | 0.6810 | 1.4137 | 0.6761 | 0.7058 | 0.7702 | 0.7135 | 1.5467 | 0.8095 | 0.7391 | 0.7370 | 1.2389 | 0.7462 | 0.7290 | 0.9423 | 1.2110 | 1.7634 | 1.0418 |
| GAMMA-GLUTAMYLPHENYLALANINE (*) | 1.0490 | 0.9097 | 0.9563 | 0.8697 | 1.0260 | 0.9514 | NA | 1.1973 | 0.7736 | 0.8626 | 0.5986 | 1.3433 | 0.6848 | 0.8557 | 1.2741 | 1.5438 | 1.2047 | 0.8270 |
| GAMMA-GLUTAMYLTYROSINE (*) | 0.8770 | 0.8860 | 0.9847 | 0.9114 | 1.0040 | 1.0043 | 1.0727 | 1.3702 | 1.0252 | 0.9686 | 1.1793 | 1.4689 | 0.8527 | 0.9271 | 1.2592 | 1.1161 | 1.0492 | 0.9165 |
| GLUCOSAMINE 6-PHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| GLUTAMIC ACID | 0.2055 | 0.6584 | 0.6057 | 0.9110 | 0.2099 | NA | NA | 1.5852 | NA | NA | 0.0820 | 3.3564 | 2.3291 | NA | 0.6103 | 1.1876 | 1.4431 | 0.8691 |
| GLUTAMINE | 1.0196 | 0.9699 | 1.0263 | 0.9888 | 1.0237 | 0.9698 | 1.0846 | 1.0179 | 1.1389 | 1.0738 | 0.9229 | 1.0254 | 1.0506 | 0.9772 | 1.0291 | 0.9555 | 0.9306 | 0.9776 |
| GLUTARATE | 1.0366 | 0.8930 | 0.8926 | 1.1533 | 0.9064 | 0.8586 | 1.0474 | 1.2167 | 1.3805 | 0.9983 | 0.5991 | 1.2740 | 0.9516 | 0.7321 | 1.1244 | 1.0780 | 1.0505 | 0.8939 |
| GLUTAROYL CARNITINE (*) | 0.8726 | 0.6876 | 1.2813 | 1.1124 | 0.9604 | 1.3814 | 1.5088 | 0.3479 | 1.3576 | 1.1203 | 0.0966 | 1.0712 | 0.7344 | 0.9181 | 1.9363 | 1.1360 | 0.9473 | 0.8707 |
| GLUTATHIONE | NA | NA | 0.6728 | 1.1377 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.7765 | NA | NA | NA | NA |
| GLYCERALDEHYDE 3-PHOSPHATE DIETHYL ACETAL | 0.7899 | 0.9780 | 0.7848 | 0.9597 | NA | 0.7759 | NA | 1.2774 | 0.6814 | 1.2945 | NA | NA | 1.1140 | 0.7363 | 0.7055 | NA | 1.2781 | 1.9395 |
| GLYCERIC ACID | 1.1671 | 1.0969 | 0.8579 | 0.9667 | 1.3263 | 1.1038 | 0.9764 | 1.0493 | 0.8998 | 0.9504 | 1.2169 | 1.1413 | 0.8236 | 0.7955 | 1.0408 | 1.0069 | 0.7855 | 0.9315 |
| GLYCEROPHOSPHORYLCHOLINE (*) | 1.1730 | 0.8780 | 0.9313 | 0.9109 | 0.8715 | 1.9643 | 0.8390 | 1.0090 | 0.7152 | 0.6744 | 0.9701 | 0.9284 | 1.2094 | 1.0268 | 0.6329 | 1.3467 | 0.9537 | 0.8949 |
| GLYCINE | 1.2036 | 0.8972 | 1.2005 | 1.0300 | 0.8407 | 0.7976 | 1.2198 | 0.8570 | 1.0410 | 1.0724 | 0.9492 | 0.8817 | 1.0557 | 0.9862 | 0.9107 | 0.9926 | 0.9964 | 0.9415 |
| GLYCOCHOLATE | 1.3739 | 1.0953 | 0.7249 | 0.7594 | 1.7718 | 0.6710 | NA | 1.2134 | 0.8432 | 1.0039 | NA | 0.7844 | 1.5370 | 0.6640 | 1.1079 | 1.0733 | 0.9387 | 0.8090 |
| GLYCOLITHOCHOLIC ACID ETHYL ESTER | 0.8603 | 0.8108 | 1.1186 | 1.1413 | 0.1936 | 0.7558 | NA | NA | 1.5504 | NA | NA | 0.2001 | 1.1718 | 0.3393 | 0.5391 | 0.4491 | NA | 1.3422 |
| GUANINE | 0.9718 | 0.9760 | 1.0488 | 0.9755 | 1.0994 | 1.0688 | 0.9384 | 1.0488 | 1.0894 | 0.9265 | 1.0985 | 0.9855 | 1.0692 | 1.0294 | 0.8989 | 0.7745 | 1.1363 | 1.0819 |
| GUANOSINE | 0.8168 | 0.6790 | 1.4925 | 1.0634 | 1.3002 | 0.7766 | 0.0405 | 0.2018 | 1.0679 | 1.3559 | 1.0754 | 0.5451 | 0.7413 | 1.3621 | 0.7488 | 0.5673 | 1.4079 | 1.5743 |
| GUANOSINE 5`-DIPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| GULONO-1,4-LACTONE | 0.7378 | 0.8095 | 0.7302 | 1.0398 | NA | 1.1060 | NA | 0.8906 | NA | 0.9375 | NA | NA | 1.1682 | 1.5535 | NA | 1.0871 | NA | 0.9367 |
| HEPTADECANOYLGLYCEROPHOSPHOCHOLINE (*) | 1.2848 | 0.8583 | 0.3085 | 0.8248 | 1.0128 | 0.8435 | 0.8112 | 1.1597 | 0.8601 | 0.6401 | NA | NA | 0.8531 | 0.5992 | NA | 0.7110 | 2.5528 | 0.9758 |
| HEXITOL | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| HEXOSE | 0.9457 | 0.9883 | 0.9782 | 1.0056 | 0.9818 | 0.9702 | 1.0155 | 0.9618 | 1.0690 | 1.0927 | 1.1617 | 1.0379 | 0.9986 | 1.0002 | 0.9684 | 0.9935 | 0.9830 | 1.0476 |
| HEXOSE (*) | 0.9724 | 0.9715 | 0.9852 | 1.0159 | 0.9602 | 0.9408 | 1.1471 | 0.9792 | 1.0345 | 1.0626 | 1.1569 | 1.0541 | 0.9774 | 1.0055 | 0.9904 | 0.9745 | 1.0160 | 1.0370 |
| HIPPURATE | 0.8772 | 0.8807 | 1.1911 | 1.1654 | 0.5403 | 1.2104 | 0.2958 | 1.1700 | 1.0586 | 3.0992 | 0.6835 | 0.7923 | 0.4758 | 0.7829 | 1.1239 | 0.7360 | 0.9898 | 0.6858 |
| HISTIDINE | 1.1484 | 0.8826 | 1.0593 | 1.1280 | 1.1358 | 1.0634 | 1.2160 | 1.0777 | 1.3115 | 0.9855 | 0.7056 | 0.9703 | 0.8450 | 0.6953 | 1.2257 | 0.8879 | 0.9430 | 0.7787 |
| HISTIDINE (*) | 1.1975 | 0.9651 | 1.1697 | 1.0218 | 1.2214 | 1.1582 | 1.4563 | 1.0901 | 1.1507 | 1.0759 | 1.5769 | 1.1915 | 0.9193 | 0.7853 | 0.7763 | 0.7249 | 0.8476 | 0.7746 |
| HISTIDINOL | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| HOMOGENTISATE | 0.7995 | 0.7583 | 1.1614 | 1.1363 | 1.0207 | 0.6991 | 0.5683 | 0.7615 | 1.0867 | 1.1082 | 1.4134 | 1.2129 | 0.5238 | 1.2470 | 0.9239 | 0.8430 | 0.8791 | 1.4339 |
| HOMOSERINE | 0.9410 | 0.8629 | 1.1596 | 1.0809 | 0.9877 | 0.9859 | 0.9696 | 1.0366 | 1.1135 | 1.1346 | 0.9981 | 1.2104 | 0.8734 | 0.9262 | 1.0895 | 0.9911 | 0.9515 | 0.8858 |
| HOMOSTACHYDRINE (*) | 0.9977 | 1.3421 | 0.8449 | 1.0596 | 0.8132 | 0.7165 | 1.2365 | 1.2231 | 0.7280 | 0.7376 | 0.6471 | 0.9412 | 0.9391 | 0.9009 | 1.3171 | 0.9442 | 0.9986 | 0.8911 |
| HOMOVANILLATE | 0.7008 | 0.8007 | 1.2067 | 1.2275 | 0.8183 | 1.0171 | 2.5289 | 1.1600 | 0.6872 | 0.7904 | 0.6669 | 0.9180 | 1.0672 | 1.0645 | 1.2486 | 0.9157 | 1.0048 | 1.1239 |
| HYDROQUINONE | NA | NA | 1.0057 | NA | 0.5019 | 0.4693 | NA | NA | NA | 0.8545 | NA | NA | 0.5353 | 3.2922 | NA | NA | NA | NA |
| HYDROXYBENZALDEHYDE | NA | NA | NA | NA | NA | NA | NA | 0.9071 | NA | 1.0929 | NA | NA | NA | NA | NA | NA | NA | NA |
| HYDROXYBENZOIC ACID | NA | 1.8304 | 0.7610 | 0.7704 | NA | NA | NA | NA | 1.2052 | NA | NA | NA | NA | NA | NA | 0.8658 | 0.6553 | 0.7735 |
| HYPOXANTHINE | 0.9621 | 0.7946 | 1.0640 | 1.2796 | 0.9153 | 0.8604 | 0.7464 | 0.8815 | 1.0309 | 1.1338 | 0.5846 | 1.0030 | 1.2576 | 0.9015 | 0.9559 | 1.0713 | 1.3229 | 0.9039 |
| INDOLE-3-ACETALDEHYDE | 0.7374 | 0.7701 | 1.6160 | 0.9106 | 0.4863 | 1.0199 | NA | 0.7516 | 0.8253 | 1.1481 | NA | 0.8702 | 1.0855 | 1.0735 | 0.9442 | 0.9323 | 1.0967 | 1.0338 |
| INDOLE-3-ACETAMIDE | 1.1831 | 0.4782 | 1.2074 | NA | NA | 1.0900 | NA | NA | NA | 1.0575 | NA | 0.3685 | NA | 0.3875 | NA | NA | 1.2113 | NA |
| INDOLE-3-ACETIC ACID | 0.7481 | 0.7252 | 0.9110 | 0.8913 | 0.6107 | 0.7193 | 0.3050 | 0.6448 | 0.8752 | 0.7107 | 1.1284 | 0.9079 | 0.7114 | 0.9669 | 1.3745 | 1.3384 | 1.7936 | 1.6965 |
| INDOLE-3-ETHANOL | 0.8239 | NA | 1.4797 | NA | NA | 0.5461 | NA | 0.4585 | NA | NA | NA | 0.6500 | 0.5309 | 1.0998 | 2.7457 | 0.7142 | NA | NA |
| INDOXYL | 0.1362 | 0.1075 | 0.1319 | 1.0930 | NA | NA | NA | NA | NA | 2.2259 | NA | NA | NA | NA | NA | 2.0267 | NA | NA |
| INOSINE | 0.8628 | 0.6477 | 1.6020 | 1.0207 | 1.1420 | 0.6202 | 0.1327 | 0.3250 | 0.8438 | 1.1213 | 0.9750 | 0.5150 | 0.5713 | 1.3009 | 0.7554 | 0.6529 | 1.4170 | 1.5918 |
| INOSINE 5`-DIPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| INOSINE 5`-MONOPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| ISOCITRIC ACID | 0.7835 | 1.2769 | 0.7086 | 0.5317 | 0.6060 | 0.7424 | 1.8872 | 1.3084 | NA | NA | NA | NA | 0.9629 | 0.6039 | NA | 1.1048 | 0.8037 | 0.8587 |
| ISOVALERYLCARNITINE (*) | 0.6245 | 0.7813 | 0.9644 | 1.0730 | 0.8388 | 1.0280 | 0.7000 | 0.9146 | 1.1194 | 1.1527 | 1.0456 | 1.0772 | 0.9621 | 1.0788 | 1.3162 | 1.2784 | 1.0512 | 1.1711 |
| KYNURENIC ACID | 0.8476 | 0.7373 | 1.0928 | 1.0231 | 0.7689 | 0.8470 | 0.4681 | 0.7740 | 1.0378 | 0.8598 | 0.6899 | 1.0629 | 0.8949 | 1.1533 | 1.1740 | 1.2089 | 1.1637 | 1.3567 |
| KYNURENINE | 0.8551 | 0.8231 | 1.2535 | 1.1743 | 0.7569 | 0.7755 | 0.7159 | 0.8420 | 1.0310 | 1.0686 | 1.0143 | 1.1013 | 0.6749 | 0.9338 | 1.0727 | 1.0364 | 1.0521 | 1.1571 |
| LAUROYLCARNITINE | 0.7298 | 0.5577 | 1.3072 | 1.2165 | 0.5810 | 0.6829 | NA | NA | 1.2646 | 1.2606 | 0.6945 | 0.8851 | 0.6517 | 1.1847 | 0.9481 | 0.7226 | 1.6312 | 1.1117 |
| LEUCENOL | 1.0413 | 1.0252 | 0.8585 | 0.8377 | 1.4147 | 1.1449 | 0.9506 | 0.8045 | 1.4016 | 1.0199 | 0.8550 | 0.8826 | 0.9871 | 0.9670 | 1.0274 | 0.9831 | 1.3011 | 0.9365 |
| LEUCINE | 0.8294 | 0.9842 | 0.9607 | 1.0157 | 1.0263 | 1.0720 | 0.9376 | 1.0407 | 0.7782 | 1.0978 | 1.0061 | 0.6474 | 1.0544 | 1.0202 | 0.9477 | 1.0919 | 1.1505 | 1.1475 |
| LEUCYLPHENYLALANINE (*) | 1.0630 | 0.9853 | 0.7039 | 1.1891 | 1.1505 | 1.3823 | 1.2608 | 1.4934 | 0.9748 | 0.7338 | 0.5567 | 0.8625 | 1.4860 | 0.6937 | 1.5493 | 1.0654 | 0.6097 | 0.6262 |
| LINOLEOYLGLYCEROPHOSPHOCHOLINE (*) | 2.3244 | 0.7615 | 0.6054 | 0.7091 | 1.3937 | 2.1021 | NA | 0.1459 | 0.9310 | 1.0061 | 2.6643 | 0.7789 | 0.1543 | 1.1402 | 0.1316 | 1.1829 | 1.0871 | 0.6977 |
| LL-2,6-DIAMINOHEPTANEDIOATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| LUMICHROME | NA | 0.5438 | 0.9729 | 1.0146 | 1.1647 | NA | NA | NA | 2.1319 | 1.7968 | NA | 0.5435 | NA | NA | 0.8736 | 0.5829 | 1.1944 | 0.9571 |
| LYSINE | 0.8848 | 0.9048 | 1.0207 | 1.0300 | 0.9888 | 0.9623 | 1.0488 | 1.1659 | 0.9727 | 1.1503 | 1.1562 | 1.2525 | 0.8692 | 1.0232 | 0.9757 | 0.9359 | 0.9934 | 1.0748 |
| MALATE | 1.0508 | 0.7920 | 1.0740 | 0.9908 | 0.8668 | 0.8777 | NA | NA | 1.0963 | 1.1156 | NA | NA | 0.8374 | NA | 0.8115 | 1.0032 | 0.9320 | 1.0692 |
| MELATONIN | NA | 0.3704 | 1.2652 | 2.0359 | NA | 0.2547 | NA | 0.8318 | 0.1795 | 0.2587 | NA | 2.2014 | NA | NA | 0.1622 | NA | 0.5954 | 0.0752 |
| MENAQUINONE | 0.8081 | 1.1466 | NA | NA | 0.5716 | 1.4386 | NA | 0.9701 | NA | NA | NA | NA | NA | NA | NA | NA | 0.9484 | 1.2652 |
| METHIONINE | 0.9739 | 0.9618 | 1.0230 | 0.9855 | 0.9771 | 1.0384 | 1.0395 | 1.0527 | 0.9664 | 1.0282 | 1.2467 | 1.0098 | 1.0495 | 1.0412 | 0.9465 | 0.9126 | 1.0034 | 1.0729 |
| METHIONYLALANINE (*) | 1.0372 | 0.8867 | 1.1131 | 1.0170 | 0.8831 | 0.8605 | 0.8552 | 1.0612 | 0.9657 | 0.9490 | 0.7310 | 1.5619 | 0.8445 | 0.7531 | 1.1398 | 1.0179 | 0.9971 | 0.9571 |
| METHYL ACETOACETATE | 1.0036 | 0.4775 | 0.8626 | 0.9511 | 2.2669 | 0.3416 | NA | 0.2675 | 1.6585 | NA | NA | 1.2170 | 0.3233 | 1.3058 | 0.8142 | 1.4882 | 0.9793 | 1.1870 |
| METHYL BETA-D-GALACTOSIDE | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| METHYLGLUTAROYLCARNITINE (*) | 0.9875 | 0.7963 | 1.2384 | 1.0489 | 0.7493 | 0.7944 | 0.8173 | 0.7700 | 0.8037 | 1.0140 | 0.8823 | 1.0432 | 0.9201 | 1.0905 | 1.0438 | 1.1856 | 1.1392 | 1.1099 |
| METHYLGUANIDINE | 1.2073 | 0.7811 | 1.0223 | 0.8988 | 1.3011 | 0.8968 | NA | 0.8538 | NA | NA | NA | NA | NA | 0.9790 | 0.8461 | NA | 1.1061 | 1.0181 |
| METHYL INDOLE-3-ACETATE | 1.9163 | 1.0545 | 0.6674 | 0.6624 | 1.2390 | 0.9066 | 0.5919 | 1.1061 | 0.4754 | 0.8040 | 1.5123 | 0.8567 | 1.8505 | 1.0163 | 0.7411 | 1.0842 | 0.9488 | 0.8734 |
| METHYL JASMONATE | 1.1269 | 1.0450 | 0.8188 | 0.9172 | 1.0446 | 1.1380 | 1.0172 | 1.0478 | 1.2261 | 1.0250 | 0.9839 | 0.9373 | 0.9540 | 0.8602 | 0.7271 | 1.3406 | 0.7633 | 1.0068 |
| METHYLMALONATE | 1.2168 | 0.0308 | 0.8665 | 1.1692 | NA | 1.2265 | NA | 0.8653 | 1.2571 | NA | NA | 1.5269 | 0.0318 | NA | NA | 1.0016 | 0.9680 | 1.4717 |
| METHYL PARABEN | 0.8940 | 0.9126 | 1.0142 | 1.1258 | 0.9438 | 0.9543 | 0.6898 | 0.7861 | 1.0026 | 1.1628 | 1.3441 | 0.8508 | 0.9828 | 1.0931 | 0.8872 | 1.0283 | 0.9903 | 1.1825 |
| METHYL VANILLATE | NA | NA | 1.0781 | NA | NA | NA | NA | NA | 1.6649 | NA | NA | 0.3345 | NA | NA | NA | NA | NA | 0.9225 |
| METHYLXANTHINE (*) | 0.7249 | 0.6813 | 1.4245 | 0.7851 | 0.7317 | 0.3528 | NA | NA | 0.8582 | 0.4936 | 0.3713 | 0.4791 | 0.8728 | 1.6933 | 0.7596 | 0.3325 | 1.5986 | 1.3941 |
| MEVALOLACTONE | 0.8015 | 0.7195 | 1.3153 | 1.3199 | 0.7010 | 0.6842 | 0.5859 | 0.7616 | 1.1359 | 1.2388 | 1.1526 | 1.3825 | 0.7450 | 1.3004 | 0.5998 | 0.6248 | 1.1335 | 1.2493 |
| MONO-ETHYL MALONATE | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| MONO-METHYL GLUTARATE | NA | NA | 0.5350 | NA | 0.9038 | NA | 0.4590 | NA | NA | NA | NA | NA | NA | 0.5501 | 1.5804 | 1.2147 | 0.7140 | 2.4716 |
| MYRISTOYLGLYCEROPHOSPHOCHOLINE (*) | 1.0919 | 1.0853 | NA | 1.0801 | NA | 0.4180 | NA | 0.8497 | NA | 0.0549 | NA | NA | NA | NA | 0.5782 | NA | 1.7404 | NA |
| N1-METHYL-2-PYRIDONE-5-CARBOXAMIDE (*) | 0.7802 | 0.7721 | 1.1024 | 1.0537 | 0.7659 | 0.9336 | 0.9844 | 0.9131 | 1.3397 | 1.1451 | 1.2745 | 1.4431 | 0.8318 | 1.0472 | 1.1245 | 1.0026 | 1.1405 | 1.0991 |
| N4-ACETYLCYTIDINE (*) | 0.6619 | 0.8067 | 1.2212 | 1.0960 | 1.0825 | 0.6585 | NA | 0.5858 | 1.1997 | 1.1271 | 0.4483 | 0.8065 | 0.7489 | 1.0248 | 1.3611 | 0.9829 | 1.3870 | 1.1120 |
| N6-(DELTA2-ISOPENTENYL)-ADENINE | 0.9736 | 1.0163 | 1.2169 | 1.1388 | 0.8891 | 1.0404 | 1.5329 | 0.7915 | 0.8350 | 0.9815 | 0.5574 | 1.6183 | 1.1522 | 0.5811 | 0.9349 | 0.8287 | 0.8817 | 0.8347 |
| N-ACETYL-D-GALACTOSAMINE | NA | 0.7523 | NA | 1.0545 | NA | 0.7228 | NA | NA | NA | NA | NA | NA | NA | NA | 0.6290 | 0.9370 | 1.2033 | 1.2798 |
| N-ACETYL-D-HEXOSAMINE | 1.0209 | 0.8299 | 1.0344 | 1.0070 | 0.9902 | 1.0058 | 1.5351 | 1.2564 | 1.0954 | 1.1347 | 0.7678 | 1.0341 | 0.9182 | 1.0158 | 0.9477 | 0.9444 | 0.9499 | 1.0418 |
| N-ACETYL-DL-GLUTAMIC ACID | 0.7761 | 0.9136 | 1.2437 | 2.0717 | 0.6725 | 0.8410 | 1.2214 | 0.7891 | 0.4579 | 0.9605 | 1.1822 | 1.0980 | 0.7744 | 1.2674 | 1.6365 | 1.1853 | 0.8940 | 1.1256 |
| N-ACETYL-DL-METHIONINE | 1.3674 | 1.0547 | 1.4416 | 0.7292 | 0.8569 | 1.2745 | 0.9440 | 1.0176 | 0.9425 | 0.9369 | 0.6755 | 0.5544 | 1.1593 | 0.5383 | 1.4960 | 1.1190 | 0.7440 | 0.7989 |
| N-ACETYL-D-TRYPTOPHAN | NA | 0.1729 | NA | NA | NA | NA | NA | 0.9670 | 1.8600 | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| N-ACETYLGLYCINE | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| N-ACETYL-L-ALANINE | 0.9822 | 0.8218 | 1.3284 | 0.8740 | 1.0805 | 1.1792 | 0.8096 | 1.1398 | 1.8140 | 1.2130 | 0.7900 | 0.5940 | 0.7498 | 0.8011 | 1.0594 | 1.2010 | 0.8420 | 0.8688 |
| N-ACETYL-L-ASPARTIC ACID | 1.0538 | 0.8973 | 1.1845 | 1.0570 | 1.2050 | 0.8191 | 0.7447 | 0.8445 | 1.0761 | 0.9875 | 0.8620 | 0.9640 | 0.8273 | 1.0425 | 0.9864 | 1.0111 | 1.0079 | 1.0008 |
| N-ACETYL-L-CYSTEINE | 0.6570 | 0.6653 | 1.3583 | 1.3113 | 0.6092 | 0.6202 | 0.4758 | 0.8732 | 1.1972 | 1.5759 | 0.7996 | 1.2714 | 0.5544 | 1.4702 | 0.4470 | 0.9370 | 0.9118 | 1.4961 |
| N-ACETYL-L-LEUCINE | 0.8788 | 0.8642 | 1.0679 | 1.5060 | 1.0980 | 0.7722 | NA | 0.9960 | 1.0367 | 0.9848 | NA | 1.8720 | 1.1151 | 0.4773 | 1.1871 | 1.0134 | 0.7052 | 0.6437 |
| N-ACETYL-L-PHENYLALANINE | 0.9930 | 0.8926 | 0.9816 | 0.8551 | 1.0542 | 1.0612 | 0.7070 | 1.3539 | 1.0073 | 0.9024 | 0.8273 | 1.9432 | 1.0032 | 0.9643 | 0.9291 | 0.9294 | 0.7889 | 1.0393 |
| N-ACETYLNEURAMINATE | 0.6268 | 0.8158 | 0.4395 | NA | 0.6660 | 0.4943 | 1.1120 | 0.7768 | NA | NA | NA | 0.8011 | 0.4719 | NA | 2.2555 | 1.4881 | 1.4202 | NA |
| N-ACETYLPUTRESCINE | 1.0950 | 0.7540 | 1.4715 | 1.0679 | 1.0679 | 1.0421 | NA | 0.7432 | 1.1560 | 1.2203 | 0.7825 | 1.0605 | 0.9262 | 1.2320 | 0.8613 | 0.7242 | 0.9131 | 0.9597 |
| N-ACETYLSEROTONIN | 0.5089 | 0.4357 | 1.4590 | 1.3854 | 0.3499 | NA | NA | 0.7064 | 0.6944 | 0.3789 | 0.5281 | 1.0204 | 0.5030 | 0.3409 | 0.7852 | 0.5015 | 0.6847 | 1.6465 |
| N-ALPHA-ACETYL-L-ASPARAGINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9821 | NA | NA | NA | NA | 1.0179 | NA |
| N-ALPHA-ACETYL-L-LYSINE | NA | NA | NA | 0.8327 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.1673 | NA |
| N-BENZYLOXYCARBONYLGLYCINE | NA | 0.8876 | NA | 1.4019 | NA | NA | NA | NA | 0.6629 | 0.5207 | NA | 0.5904 | NA | 0.6782 | NA | NA | 0.7632 | NA |
| N-BOC-D-GLUCOSAMINE | 1.0315 | 1.0783 | NA | 0.7982 | 1.2465 | NA | NA | NA | NA | NA | NA | 0.9498 | NA | NA | NA | 0.9879 | NA | NA |
| N-CYCLOHEXYLFORMAMIDE | 1.0117 | 0.9500 | 0.9336 | 0.9577 | 0.9845 | 1.0634 | 0.8725 | 0.9348 | 0.9118 | 1.1394 | 0.8682 | 1.0463 | 1.1562 | 0.9324 | 1.2422 | 1.2194 | 0.9601 | 0.9032 |
| N-CYCLOHEXYLSULFAMIC ACID | 0.7853 | 1.1367 | 1.5208 | 1.4196 | 0.3498 | 1.7746 | 0.3058 | 0.2204 | 0.8893 | 1.3419 | 0.7274 | 0.6028 | 0.5709 | 0.0040 | 1.8516 | 0.4599 | 0.3177 | 0.7300 |
| N-ETHYLMALEIMIDE | 0.8503 | 0.8397 | 1.2212 | 0.9450 | 0.8125 | 0.8120 | 0.7196 | 0.7336 | 0.9334 | 0.7661 | NA | 0.8146 | 0.7575 | 1.1231 | 1.3220 | 1.1665 | 1.3254 | 1.2414 |
| NICOTINAMIDE | 0.9291 | 0.7832 | 1.4008 | 1.3695 | 0.5483 | 0.7083 | 1.3469 | 0.9104 | 1.1485 | 1.0063 | 1.6394 | 1.4109 | 0.8176 | 0.9080 | 0.8085 | 0.8794 | 1.1890 | 0.8055 |
| N-NITROSODIETHANOLAMINE | 0.8190 | 1.0047 | 0.4875 | NA | NA | 2.2080 | NA | 0.4480 | NA | NA | NA | NA | NA | 1.0720 | 0.4323 | NA | NA | NA |
| N,N,N-TRIMETHYLLYSINE | 0.9778 | 0.8269 | 1.0088 | 0.9881 | 1.1183 | 0.9049 | 1.0296 | 1.0035 | 0.8509 | 0.6950 | 1.2037 | 0.7515 | 1.0008 | 0.9954 | 1.2409 | 1.3902 | 1.1197 | 1.0165 |
| NORMETANEPHRINE | 1.0251 | 1.6249 | 0.8391 | 0.8647 | 1.0433 | 0.9079 | 0.8630 | 0.7862 | 0.8859 | 0.7040 | 0.3093 | 0.1974 | 0.7018 | 0.4073 | 1.3705 | 1.4731 | 1.4999 | 0.5430 |
| N(PAI)-METHYL-L-HISTIDINE | 1.0941 | 0.8884 | 0.8977 | 0.7628 | 1.4483 | 1.5350 | 0.5224 | 1.1611 | 0.9246 | 0.7381 | 0.8558 | 1.0432 | 0.8156 | 0.7719 | 1.6534 | 1.5860 | 0.9076 | 0.7363 |
| O-ACETYL-L-CARNITINE | 0.8940 | 0.7093 | 1.2926 | 1.2330 | 0.8569 | 0.7567 | 0.5471 | 0.7361 | 1.4554 | 1.4909 | 0.9412 | 1.3128 | 0.6055 | 1.0649 | 0.9180 | 0.7415 | 0.9126 | 1.1616 |
| OCTANOYLCARNITINE (*) | 0.5604 | 0.5553 | 1.3019 | 1.2997 | 0.8269 | 0.8555 | 0.3638 | 0.4931 | 2.1652 | 2.0322 | 1.0944 | 1.2178 | 0.6554 | 0.8817 | 0.6025 | 0.6522 | 1.2107 | 1.1203 |
| OLEAMIDE | 0.5390 | 1.4807 | 0.6516 | 1.4357 | NA | NA | NA | 0.5783 | NA | 1.2530 | NA | 0.6460 | NA | NA | 2.6571 | 1.2383 | 0.4445 | 1.3174 |
| OLEOYLCARNITINE (*) | 1.3970 | 1.0041 | 0.7651 | 0.8013 | 1.1069 | 1.4949 | 0.7333 | 1.0829 | 1.1716 | 0.8465 | 0.5049 | 1.0036 | 0.8210 | 0.6322 | 0.8399 | 0.6052 | 1.7257 | 0.9945 |
| OLEOYLGLYCEROPHOSPHOCHOLINE (*) | 1.3226 | 0.9873 | 0.8269 | 0.8366 | 0.8110 | 0.8787 | 1.0856 | 1.0093 | 0.6283 | 0.5816 | 0.7001 | 0.8826 | 0.8011 | 0.9130 | 1.2254 | 0.9705 | 1.8163 | 0.9679 |
| O-PHOSPHO-DL-SERINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| O-PHOSPHONOHEXOPYRANOSE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| OPHTHALMIC ACID | 0.7311 | NA | 0.9814 | 1.3148 | NA | NA | NA | NA | NA | NA | NA | 0.6578 | NA | NA | NA | NA | NA | NA |
| ORNITHINE | 0.9097 | 0.9574 | 0.9125 | 1.0322 | 0.9507 | 1.0350 | 0.9029 | 1.3073 | 1.0241 | 0.9554 | 0.9240 | 1.0657 | 0.9368 | 0.9958 | 1.2664 | 1.0830 | 0.9536 | 0.9744 |
| OROTIDINE 5`-MONOPHOSPHATE | NA | 0.7949 | 1.1400 | 1.1812 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9420 |
| O-SUCCINYL-L-HOMOSERINE | 0.3406 | 1.4944 | NA | NA | NA | 0.9987 | NA | NA | NA | NA | NA | NA | 0.6594 | NA | NA | 0.7591 | NA | NA |
| OXOMALONATE | 0.8745 | 1.2091 | 0.5913 | 1.6582 | 0.4087 | 0.4074 | NA | 1.6623 | 0.4092 | 0.7796 | NA | 1.2297 | 0.4165 | NA | 0.5674 | 0.9048 | 1.1385 | 1.9727 |
| PALMITOLEOYLGLYCEROPHOSPHOCHOLINE (*) | 1.4224 | 1.1899 | 0.7552 | 0.6694 | 0.8546 | 1.4737 | 0.5832 | 0.7845 | NA | 0.3346 | NA | 0.6111 | 0.9553 | NA | 0.8361 | 0.7127 | 1.5289 | 0.7869 |
| PALMITOYLCARNITINE (*) | 1.3501 | 0.9501 | 0.7595 | 0.8752 | 1.0778 | 1.3436 | 0.7843 | 0.9757 | 1.0920 | 0.7988 | 0.4858 | 0.8752 | 0.7879 | 0.7048 | 0.7930 | 0.7521 | 1.8806 | 1.0255 |
| PALMITOYLGLYCEROPHOSPHOCHOLINE (*) | 0.8533 | 0.7196 | NA | 1.7233 | 1.2827 | 0.7834 | NA | 1.7028 | 0.4664 | NA | NA | NA | 0.9663 | 0.4489 | NA | 2.1751 | 1.4323 | 1.5633 |
| PALMITOYL SPHINGOMYELIN (*) | 1.6454 | 0.9374 | 0.9738 | 0.8243 | 1.1563 | 1.2315 | 0.7147 | 0.7974 | 1.1735 | 0.8597 | 0.8548 | 1.0838 | 0.7911 | 0.6576 | 0.8442 | 0.5231 | 1.8633 | 0.7650 |
| PANTOLACTONE | 0.7985 | 0.8099 | 0.8799 | 1.1274 | 0.5972 | 0.7756 | 0.9722 | 0.9680 | 0.8542 | 1.2321 | 1.2210 | 1.0924 | 0.9125 | 1.2316 | 0.8744 | 1.1411 | 1.5180 | 1.0287 |
| PANTOTHENIC ACID | 0.7222 | 0.9962 | 1.0395 | 1.2035 | 0.8117 | 0.6915 | 0.4094 | 0.8724 | 1.0069 | 1.0400 | 0.9706 | 1.3223 | 0.8821 | 0.9441 | 1.0152 | 1.0931 | 1.0143 | 1.1190 |
| PARAOXON-METHYL | 0.9356 | 0.9473 | 1.1149 | 1.0080 | 0.8560 | 0.7697 | 0.5382 | 0.9437 | 0.8323 | 0.9118 | 1.2634 | 1.1396 | 1.1985 | 1.3079 | 0.6104 | 0.8731 | 0.8944 | 1.2866 |
| P-BENZOQUINONE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 |
| P-BROMO-DL-PHENYLALANINE | 0.7883 | 1.2368 | 0.9176 | 1.0721 | 0.7254 | 0.9038 | 0.5969 | 0.7375 | 0.8749 | NA | 1.0053 | 1.0666 | 1.1319 | 1.0379 | 1.1923 | 0.9273 | 0.9433 | 1.0891 |
| PENICILLAMINE | 1.0581 | 1.3872 | NA | 0.5318 | NA | 1.3985 | NA | NA | NA | 0.7827 | NA | NA | 0.6237 | 0.6523 | NA | 1.8678 | 1.1671 | NA |
| PENTADECANOYLGLYCEROPHOSPHOCHOLINE/STEAROYLGLYCEROPHOSPHOETHANOLAMINE (*) | NA | 1.1401 | NA | NA | NA | 0.9299 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| PENTITOL | 0.9908 | 1.1213 | 0.9514 | 0.9464 | 1.0417 | 0.9826 | 0.9291 | 1.0502 | 0.9238 | 0.8674 | 0.8365 | 0.8930 | 1.0315 | 0.8879 | 1.1363 | 1.1328 | 1.0230 | 0.9253 |
| PENTOPYRANOSE | NA | 1.0915 | NA | NA | NA | NA | NA | 0.9085 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| PHENETHYLAMINE | NA | 0.8424 | NA | NA | NA | NA | NA | 0.8590 | NA | 1.2986 | NA | NA | NA | NA | NA | NA | NA | NA |
| PHENYLACETIC ACID | 0.9906 | 1.2102 | 1.1334 | 1.0340 | 0.9712 | 0.7639 | NA | 0.9332 | 1.1562 | 1.0024 | NA | 0.8245 | 1.1459 | 0.7737 | 0.8793 | 1.0243 | 0.8854 | 0.8562 |
| PHENYLACETYLGLUTAMINE (*) | 0.9612 | 0.9164 | 1.2948 | 0.9792 | 0.7590 | 0.8578 | 0.4054 | 0.8865 | 0.9626 | 0.9751 | 0.5648 | 0.9650 | 1.0647 | 1.3830 | 0.9645 | 0.9845 | 0.9544 | 1.1146 |
| PHENYLALANINE | 0.9859 | 1.0413 | 0.9527 | 0.9436 | 1.0403 | 1.0535 | 0.9812 | 1.0938 | 0.9388 | 0.9919 | 0.8816 | 0.9464 | 1.0239 | 0.9217 | 1.1642 | 1.0994 | 0.9235 | 0.9949 |
| PHENYLETHANOLAMINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| PHOSPHATE | NA | NA | NA | 0.9089 | NA | NA | NA | NA | 1.3544 | NA | 0.8248 | NA | NA | 1.0249 | NA | 0.9708 | NA | 1.0072 |
| PHOSPHOCHOLINE | NA | NA | 0.8593 | NA | NA | NA | NA | 1.1407 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| PHOSPHONOACETATE | 1.3178 | 1.1109 | 0.7667 | 0.9418 | 0.8736 | NA | NA | 1.0288 | 1.1286 | NA | 0.7204 | 1.8068 | 0.7290 | NA | NA | 1.2503 | 1.0680 | 0.7653 |
| PHTHALATE | 1.1741 | 1.1860 | 0.5802 | 0.7047 | 0.9063 | 1.6050 | NA | 0.7087 | NA | 0.5735 | NA | 0.3276 | NA | NA | NA | 0.7727 | 2.9567 | 0.5973 |
| PIMELIC ACID | 0.7246 | 0.8534 | 0.8974 | 1.2150 | 0.9410 | 0.9906 | 2.1685 | 1.0115 | 0.8048 | 0.6188 | 0.8293 | 0.9699 | 1.1368 | 1.0730 | 1.0893 | 0.9326 | 1.0708 | 1.2620 |
| PIPECOLIC ACID | 0.9677 | 0.8677 | 1.2152 | 1.0463 | 0.8739 | 0.8516 | 0.7093 | 0.9294 | 0.9226 | 0.9107 | 0.6561 | 1.1032 | 0.8884 | 1.0309 | 0.8661 | 0.9639 | 1.0875 | 1.2279 |
| PIPERINE (*) | 1.2292 | 0.9839 | 0.6861 | 0.7809 | 1.3072 | 1.7207 | 0.5017 | 0.7002 | 1.1653 | 1.1297 | 0.7932 | 0.6346 | 1.3261 | 1.2727 | 0.6707 | 0.8289 | 1.2767 | 1.0813 |
| POSSIBLE L-LEUCYL-L-LEUCINE | 0.7878 | 1.0257 | 0.9314 | 0.7820 | 0.9936 | 1.0739 | 0.4080 | 1.5886 | 0.8508 | 0.7877 | 0.5977 | 1.1899 | 1.3444 | 0.9991 | 1.2241 | 1.1537 | 1.1390 | 0.9846 |
| PREGNENOLONE | NA | 0.7679 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9638 | NA | NA | 0.5088 | 1.9916 | NA |
| PRENOL | 1.0554 | 0.8071 | NA | 1.1912 | 1.1223 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.7964 | 1.1000 |
| PROGESTERONE | 1.1917 | 0.9826 | 0.9846 | 1.0041 | 1.0538 | 0.8615 | NA | 0.1114 | NA | 0.9085 | 1.0558 | NA | 1.3027 | 1.1273 | 1.1419 | 1.0858 | 0.9368 | 0.9909 |
| PRO-HYDROXY-PRO (*) | 1.0089 | 0.9799 | 0.8990 | 0.7471 | 1.4155 | 1.2198 | 0.6631 | 0.9830 | 1.0341 | 0.7854 | 0.5334 | 0.8747 | 1.5000 | 1.1608 | 1.4327 | 1.3836 | 0.8612 | 0.8250 |
| PROLINE | 0.9633 | 1.0697 | 0.8545 | 0.9178 | 1.0585 | 1.0706 | 1.0632 | 1.1748 | 0.8870 | 0.7958 | 0.8232 | 0.9575 | 1.0698 | 0.9798 | 1.2735 | 1.1141 | 1.0052 | 0.9986 |
| PROMETRYN | 1.1575 | 1.1717 | 0.8828 | 0.9429 | 0.9361 | 1.3634 | NA | 1.2708 | 1.3592 | 0.7756 | 0.7344 | 1.2482 | 0.9474 | 0.6185 | 0.8347 | 1.0025 | 0.8713 | 0.8794 |
| PROPIONYLCARNITINE (*) | 0.8045 | 0.7641 | 1.0026 | 0.9229 | 1.0720 | 1.1363 | 0.5540 | 0.8683 | 1.0790 | 1.1965 | 0.8190 | 1.0284 | 0.8180 | 0.9521 | 1.4959 | 1.1092 | 1.1645 | 1.2556 |
| PROTOPORPHYRIN | NA | NA | 1.0862 | 0.5534 | NA | NA | NA | NA | NA | NA | NA | NA | 1.5487 | NA | 1.2419 | 0.9471 | NA | 0.5894 |
| PTERIN | 0.8109 | 0.7923 | 1.2840 | 1.2348 | 0.8180 | 0.7223 | 0.4424 | 0.7057 | 1.0841 | 1.4249 | 1.1685 | 1.1192 | 0.7952 | 1.2529 | 0.8269 | 0.8726 | 0.8979 | 1.1773 |
| PYRIDINE-2,3-DICARBOXYLATE | NA | NA | 0.8403 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.8025 | 0.3572 |
| PYRIDINE CARBOXYLIC ACID | 1.2901 | 0.7802 | 1.0009 | 1.1297 | 0.7613 | 0.5318 | 1.4064 | 1.0916 | 0.5047 | 0.9516 | 1.4988 | 1.9889 | 0.8774 | 1.1612 | 0.9807 | 0.8669 | 0.9304 | 1.1363 |
| PYRIDOXAL | 1.4429 | 0.8781 | 1.7666 | 1.0997 | 1.0168 | 0.8416 | NA | 0.6599 | NA | 0.8320 | NA | 0.6990 | 0.8570 | NA | NA | 1.0490 | 0.8254 | 0.8348 |
| PYRIDOXAMINE | 0.8296 | 0.8456 | 0.9784 | 1.0223 | 0.9234 | 0.9291 | 0.9922 | 1.3086 | 1.0524 | 1.2058 | NA | 1.2620 | 0.8569 | 1.0843 | 1.0966 | 1.0052 | 0.9916 | 1.0982 |
| PYRIDOXINE | 0.9395 | 0.9686 | 0.7319 | 0.8788 | NA | NA | 0.8101 | 2.3818 | 1.8176 | 0.6298 | NA | 1.1681 | 0.6635 | 0.7627 | NA | NA | 1.1535 | 0.8842 |
| PYROGLUTAMINE (*) | 0.7120 | 0.6226 | 0.8382 | 0.6250 | 1.3580 | 0.8071 | NA | 0.4281 | 1.2725 | 0.8365 | NA | 0.4731 | 1.7451 | 1.9737 | 1.6364 | 1.3084 | 1.2975 | 1.2195 |
| QUINATE | NA | NA | NA | NA | 1.1913 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8087 | NA | NA |
| QUINOLIN-2-OL | 0.3253 | 0.2140 | 0.3898 | 0.3656 | 0.9966 | 1.1457 | NA | 0.3915 | 0.6469 | 0.5370 | NA | 0.4594 | 0.4643 | 0.5544 | 2.3095 | 1.9873 | 1.9159 | 1.9607 |
| RAFFINOSE | NA | 0.9459 | 0.6664 | 0.8717 | 1.2498 | 0.9390 | NA | 1.6828 | 0.6679 | 0.8017 | NA | 0.7366 | 1.7138 | 1.5246 | 0.8766 | 0.9938 | 0.8309 | 1.0330 |
| RETINAL | 0.9617 | NA | 0.9371 | 1.3605 | NA | NA | NA | 0.5084 | 0.9468 | NA | NA | NA | NA | 0.8670 | NA | 0.8672 | NA | 0.9924 |
| RETINOATE | 1.2568 | 0.9160 | 0.8132 | 0.8871 | 1.0073 | 0.7656 | 1.7653 | 1.6998 | 1.6059 | 1.2954 | 0.6356 | 0.9761 | 0.5858 | 0.5227 | 1.9625 | 1.4759 | 0.6238 | 0.5428 |
| RETINOL | 0.8367 | 0.7543 | 2.0218 | 1.0302 | 1.0740 | 1.0208 | 0.7974 | 1.1731 | 0.6631 | 1.5390 | NA | NA | 0.9640 | 0.6688 | 1.7638 | 0.9638 | 0.7987 | 0.6180 |
| RIBOFLAVIN | 0.5841 | 0.9645 | 0.8422 | 1.3476 | 0.7112 | 0.6376 | 0.6713 | 0.5443 | 0.4768 | 0.9712 | 0.5332 | 1.0063 | 1.0932 | 1.2826 | 0.4126 | 2.1799 | 1.0061 | 0.8740 |
| RIBOSE 5-PHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| ROSMARINIC ACID | NA | 0.9897 | 1.0655 | 0.9218 | NA | NA | NA | NA | 0.6409 | 1.0065 | NA | 1.0060 | 0.8336 | 1.1193 | 1.0487 | NA | 1.1441 | 1.0701 |
| S-ADENOSYL-L-HOMOCYSTEINE | 1.3063 | 1.2582 | 0.4111 | 0.9032 | 1.2937 | 1.5935 | 0.9089 | 1.1586 | 0.4825 | 0.5802 | NA | 0.5149 | 2.1370 | 0.6149 | 1.2988 | 0.9967 | 0.7440 | 0.5312 |
| S-ADENOSYL METHIONINE | 1.1416 | 0.8257 | 1.3920 | 0.7907 | 1.0125 | 0.9390 | 0.3850 | 1.4286 | 0.9151 | 0.6850 | 0.7182 | 1.0568 | 0.4802 | 0.9551 | 1.0883 | 1.0409 | 1.4802 | 0.9878 |
| SALICYLIC ACID | 0.9991 | 2.2157 | NA | NA | 0.9104 | 0.6410 | NA | 0.4790 | NA | NA | NA | NA | 0.8817 | NA | NA | 0.8422 | NA | 0.6919 |
| SALSOLINOL | 0.7541 | 0.9814 | 0.8608 | 0.8599 | 1.1319 | 1.3044 | 1.0790 | 0.8621 | 0.9718 | 0.8992 | 0.9578 | 0.8811 | 1.3204 | 1.2624 | 1.0347 | 1.0647 | 1.0783 | 1.1231 |
| SELENOCYSTAMINE | 0.8435 | 0.9239 | NA | NA | NA | 1.1037 | NA | 1.4746 | NA | NA | NA | NA | NA | NA | 0.8389 | 1.5125 | 0.6158 | NA |
| SEROTONIN | 0.9828 | 0.9537 | 1.3202 | 1.0079 | 1.0876 | 0.9661 | 0.6991 | 0.5047 | 0.6937 | 1.0898 | 0.8496 | 0.6854 | 1.1210 | 1.1084 | 1.2987 | 0.7646 | 0.9567 | 0.9992 |
| S-HEXYL-GLUTATHIONE | 1.0307 | 0.9757 | 1.0742 | 1.0171 | 0.8658 | 0.8217 | 1.0571 | 0.9149 | 1.6517 | 0.5757 | 0.6855 | 1.0783 | 1.0613 | 0.9241 | 1.1514 | 0.9707 | 1.0694 | 0.9906 |
| SHIKIMATE | 0.9853 | 1.0394 | 1.0084 | 1.0197 | 0.9516 | 1.0102 | 1.0248 | 1.1143 | 0.9607 | 0.8798 | 0.9551 | 0.9183 | 0.9960 | 1.0106 | 1.0498 | 1.0079 | 0.9941 | 0.9694 |
| SN-GLYCERO-3-PHOSPHOCHOLINE | 1.1582 | 0.8809 | 0.8403 | 0.9669 | 1.0422 | 1.4457 | 2.0604 | 1.1581 | 0.7294 | 0.6330 | 0.9120 | 0.9223 | 1.2226 | 0.9649 | 0.5067 | 1.3502 | 0.9991 | 0.9211 |
| SORBIC ACID | 0.8468 | 0.9768 | 0.9636 | 1.0631 | 0.8224 | 1.0291 | 0.7410 | 0.8981 | 0.9505 | 0.7832 | 0.8172 | 0.8210 | 1.0532 | 1.0779 | 0.8607 | 1.1811 | 1.0871 | 1.1968 |
| SPERMIDINE | 0.9883 | 0.5147 | 1.1733 | 1.3185 | 0.6384 | 0.6437 | 0.7478 | 0.5321 | 1.2143 | 1.1703 | 0.6511 | 1.0557 | 0.6491 | 1.0333 | 1.0999 | 0.8593 | 1.2033 | 1.0165 |
| SPERMINE | 0.9500 | 0.9878 | 0.9531 | 1.0020 | 0.9898 | 0.9631 | 0.9547 | 0.9412 | 1.1111 | 1.1279 | 1.2218 | 1.0827 | 0.9740 | 1.0346 | 0.9715 | 0.9970 | 0.9583 | 1.0430 |
| SPHINGANINE | 1.1302 | 0.9503 | 0.7898 | 0.7350 | 1.1205 | 1.2620 | 1.0622 | 0.7657 | 0.8308 | NA | NA | NA | 0.8472 | NA | NA | 1.0252 | 1.0911 | 0.7552 |
| SPHINGOMYELIN | 0.7615 | 0.6728 | 1.2021 | 1.1752 | 0.7504 | 0.4911 | 0.5455 | 0.7333 | 1.1620 | 0.9291 | 1.0458 | 1.3415 | 0.8129 | 1.1112 | 1.7202 | 0.7344 | 1.7261 | 1.1510 |
| SPHINGOMYELIN (CATION) | 1.4525 | 1.5508 | 0.5369 | 1.1951 | 1.0416 | 1.2205 | 1.2264 | NA | NA | 0.9107 | NA | NA | 1.1566 | NA | 1.2624 | 0.1490 | NA | 0.1708 |
| SQUALENE | 1.4061 | 0.4190 | 1.1781 | 0.5922 | 0.4611 | NA | 0.5168 | 1.0469 | 1.1232 | 1.3772 | 0.5580 | 0.9906 | 0.3230 | 0.6087 | 1.7187 | 1.4575 | 1.1913 | 0.5971 |
| STACHYOSE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| STEARAMIDE (*) | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA |
| STEAROYLCARNITINE (*) | 1.3434 | 1.1788 | 0.6268 | 0.8671 | 1.1048 | 1.3790 | 0.8584 | 0.5968 | 0.8663 | 0.8427 | 0.3542 | 0.6644 | 0.8441 | 0.6644 | 0.8275 | 0.7152 | 1.8375 | 1.0421 |
| STEAROYLGLYCEROPHOSPHOCHOLINE (*) | 1.3530 | 1.0023 | 0.9258 | 0.8282 | 0.8891 | 1.1805 | 1.4867 | 1.3931 | 0.8265 | 0.8551 | 0.5758 | 0.7072 | 0.8380 | 0.6641 | 1.2255 | 0.9703 | 1.3693 | 0.9036 |
| STEAROYL SPHINGOMYELIN (*) | 0.9390 | 0.7350 | 1.0681 | 1.0350 | 0.8139 | 0.6452 | 0.5789 | 0.7706 | 0.9766 | 0.9762 | 1.1881 | 1.4802 | 0.7884 | 0.9501 | 1.3788 | 0.7374 | 1.7228 | 1.1183 |
| SUBERIC ACID | 0.8843 | 0.8328 | 1.1110 | 1.0913 | 1.0487 | 0.7332 | 1.8638 | 0.8889 | 0.9688 | 0.9271 | 1.0435 | 1.0495 | 0.9266 | 0.9778 | 1.3472 | 1.0007 | 1.1319 | 1.0911 |
| SUCCINATE (*) | 1.0574 | 0.7067 | 1.0648 | 0.8073 | 0.8885 | 0.8777 | NA | 0.8073 | 1.2041 | 0.6501 | NA | 1.1957 | 1.1175 | 0.9643 | 1.2683 | 1.1458 | 1.3794 | 1.2362 |
| TAURINE | 0.9222 | 1.0365 | 0.8616 | 0.9939 | 1.0867 | 1.1161 | 0.7926 | 0.9864 | 1.0002 | 0.8081 | 0.5688 | 0.9704 | 1.2669 | 1.1348 | 1.2983 | 1.0409 | 0.9950 | 0.9025 |
| TESTOSTERONE | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| THEOPHYLLINE | NA | 0.3843 | 1.6157 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| THIOPURINE S-METHYLETHER | 0.8291 | 0.8752 | 1.0167 | 1.0122 | 1.4302 | NA | NA | 0.8628 | 1.1795 | 1.8931 | NA | 0.3389 | 0.8791 | 1.2680 | 1.0600 | 0.5777 | 1.2832 | 1.3606 |
| THREONINE (*) | 1.1098 | 0.8650 | 1.2839 | 1.0082 | 0.8971 | 1.0987 | 1.0713 | 1.0095 | 1.2648 | 1.1308 | 1.2227 | 1.0599 | 0.9494 | 0.7055 | 1.0489 | 0.7762 | 1.0428 | 0.8478 |
| THYMIDINE | 1.1193 | 1.4156 | 0.4371 | 0.5379 | 1.8763 | 0.3709 | NA | 0.3804 | 0.4800 | 0.5920 | NA | 4.6550 | 0.3575 | 0.5799 | NA | 0.3731 | 0.4717 | 0.4175 |
| THYROXINE | 1.0384 | 1.1839 | 0.7525 | 0.8821 | 1.2931 | 1.2735 | 0.8662 | 0.9198 | 0.8199 | 0.8481 | 0.8677 | 1.0871 | 1.2002 | 1.0720 | 0.8051 | 1.0194 | 1.0634 | 0.9564 |
| TIGLYL CARNITINE (*) | 0.7501 | 0.9143 | 1.0346 | 1.1211 | 0.8136 | 0.8369 | 0.8178 | 0.9473 | 0.9656 | 1.0360 | 1.0348 | 1.1723 | 0.6825 | 1.0684 | 1.1253 | 0.9286 | 1.0712 | 1.2198 |
| TRANS-CYCLOHEXANE-1,2-DIOL | 0.4056 | 0.3606 | 1.9792 | 1.3011 | 0.3848 | 0.2480 | 0.1690 | 0.5851 | 1.8559 | 1.2102 | 1.6531 | 1.5376 | 0.3171 | 1.3375 | 0.5739 | 0.2990 | 1.6652 | 1.5861 |
| TRIGONELLINE | 0.9735 | 1.1298 | 0.8371 | 0.9326 | 1.0773 | 1.0594 | 1.0988 | 1.2369 | 0.8613 | 0.8156 | NA | 0.9376 | 1.1162 | 0.9258 | 1.2379 | 0.9703 | 1.0035 | 0.9999 |
| TRIMETHYLAMINE | 0.9350 | 0.8973 | 1.0514 | 1.0353 | 1.0564 | 0.9395 | NA | 1.0265 | 0.9007 | 1.1595 | 0.4810 | 1.5103 | 1.1505 | 0.9503 | 1.2263 | 1.0726 | 0.9570 | 0.8980 |
| TRYPTAMINE | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| TRYPTOPHAN | 0.8328 | 0.9445 | 1.0527 | 1.0095 | 0.9245 | 0.9334 | 0.8647 | 1.0425 | 0.9144 | 0.9563 | 1.0255 | 1.0322 | 0.9749 | 1.0567 | 1.1708 | 1.1068 | 0.9857 | 1.1091 |
| TRYPTOPHANAMIDE | 0.3757 | 0.6196 | 1.6322 | 1.0426 | 0.6129 | NA | NA | 0.4953 | 1.7962 | 0.8499 | 0.6944 | 1.1539 | NA | 1.3319 | 0.9021 | 1.0570 | 0.6350 | 0.9223 |
| TRYPTOPHAN BETAINE (*) | 1.4151 | 1.3395 | 1.6335 | 1.1622 | 0.6028 | 0.4815 | 0.3733 | 1.0677 | 0.7957 | 0.6566 | 0.3707 | 1.0834 | 0.4624 | 0.4901 | 0.7639 | 0.7992 | 0.5512 | 0.7370 |
| TYROSINE | 1.0066 | 1.0122 | 0.9317 | 1.0324 | 0.9959 | 1.0000 | 1.1454 | 1.2564 | 0.9639 | 0.9842 | 1.3408 | 1.2476 | 0.9522 | 0.9077 | 0.9016 | 0.9573 | 0.9528 | 0.9336 |
| TYROSINE (*) | 0.9919 | 1.0031 | 0.9374 | 1.0529 | 0.9669 | 0.9650 | 1.1603 | 1.2769 | 0.9460 | 0.9785 | 1.3470 | 1.2352 | 0.9213 | 0.9176 | 0.9143 | 0.9761 | 0.9518 | 0.9498 |
| URATE | 0.8875 | 0.8680 | 0.8001 | 1.0209 | 0.9942 | 0.9111 | 0.7586 | 0.9551 | 1.0557 | 0.9876 | 1.0282 | 0.9679 | 1.1163 | 1.1086 | 1.1059 | 1.0379 | 1.3154 | 1.0885 |
| URATE (*) | 0.8567 | 0.8742 | 0.8452 | 0.9609 | 1.0320 | 0.9417 | 0.8025 | 0.8882 | 1.1414 | 1.0279 | 1.0426 | 0.9812 | 1.0716 | 1.1079 | 1.2137 | 1.1358 | 1.2162 | 1.1051 |
| URDINE 5`-DIPHOSPHO-N-ACETYLGALACTOSAMINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| UREA | 0.8716 | 0.8891 | 1.0506 | 0.9702 | 0.9960 | 0.9600 | 0.4928 | 0.7395 | 1.2018 | 0.8265 | 0.7717 | 0.5487 | 0.9961 | 1.3300 | 1.5845 | 1.3372 | 1.3922 | 0.9225 |
| URIDINE | 0.8012 | 0.7580 | 1.1287 | 1.2179 | 0.8706 | 0.7710 | 0.6560 | 0.8029 | 0.9898 | 1.1622 | 1.0323 | 1.2436 | 0.8566 | 1.0820 | 0.8603 | 0.9007 | 1.2039 | 1.1847 |
| URIDINE-5-MONOPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 |
| UROCANATE | 0.7875 | 0.7654 | 1.0260 | 1.1231 | 0.7058 | 1.0268 | 0.8395 | 0.8574 | 1.1554 | 1.0723 | 1.2930 | 1.5002 | 0.7198 | 3.3708 | 0.6839 | 0.7303 | 0.9273 | 0.7735 |
| URSODIOL | NA | 0.9720 | 1.2578 | 0.9596 | 1.3654 | 0.5907 | NA | NA | 0.3878 | NA | NA | NA | 0.9573 | NA | NA | 0.9471 | 1.4710 | 1.3311 |
| VALINE | 0.8997 | 1.0122 | 0.9523 | 1.0236 | 0.9768 | 1.0018 | 0.9570 | 0.9965 | 1.0385 | 1.0036 | 1.0070 | 1.0301 | 0.9101 | 0.9819 | 1.0508 | 1.0123 | 1.0158 | 1.0733 |
| VALINE (*) | 0.9148 | 1.0140 | 0.9243 | 0.9900 | 0.9660 | 0.9806 | 0.9851 | 1.0613 | 0.9366 | 0.9628 | 1.0702 | 1.0208 | 0.9844 | 0.9791 | 1.0745 | 1.0644 | 1.0305 | 1.0805 |
| VITAMIN D2 | 1.2469 | 0.8169 | 0.9374 | 1.3598 | 0.5895 | NA | 1.0253 | NA | NA | NA | NA | NA | 1.1398 | NA | 0.9348 | 0.8895 | 1.3719 | 0.7053 |
| VITAMIN D3 | 0.6569 | 0.9639 | 1.2602 | 1.1600 | NA | 0.8765 | NA | 0.6227 | 0.7656 | 1.1939 | NA | 0.7498 | 1.0847 | 1.8167 | 1.2258 | 0.9887 | 0.6570 | 0.6720 |
| XANTHINE | 0.9366 | 0.9736 | 0.8520 | 1.1852 | 0.9325 | 1.1887 | 1.0869 | 1.0206 | 1.0689 | 1.1635 | 0.6465 | 1.1852 | 1.4321 | 1.0122 | 1.0428 | 0.8159 | 0.9874 | 0.8097 |
| XANTHOSINE | NA | 0.7073 | NA | 0.9223 | NA | NA | 1.0219 | 0.9907 | 0.8565 | NA | NA | NA | 0.8452 | NA | NA | 0.9305 | NA | 2.6222 |
| XANTHURENIC ACID | 1.9930 | 0.4794 | 2.4281 | 1.0610 | 0.6481 | 0.4729 | NA | 2.1697 | NA | 0.9261 | NA | 0.8521 | 0.7469 | 1.0241 | 1.1008 | 0.7629 | 1.2755 | 0.1874 |
Factors:
| F1 | Gender:Female | OSA:Negative | Sampling:After SWS onset | PCOS:No PCOS | CPAP:No CPAP |
| F2 | Gender:Female | OSA:Negative | Sampling:After SWS onset | PCOS:PCOS | CPAP:No CPAP |
| F3 | Gender:Female | OSA:Negative | Sampling:Morning fasting | PCOS:No PCOS | CPAP:No CPAP |
| F4 | Gender:Female | OSA:Negative | Sampling:Morning fasting | PCOS:PCOS | CPAP:No CPAP |
| F5 | Gender:Female | OSA:Positive | Sampling:After SWS onset | PCOS:No PCOS | CPAP:After CPAP |
| F6 | Gender:Female | OSA:Positive | Sampling:After SWS onset | PCOS:No PCOS | CPAP:No CPAP |
| F7 | Gender:Female | OSA:Positive | Sampling:After SWS onset | PCOS:PCOS | CPAP:After CPAP |
| F8 | Gender:Female | OSA:Positive | Sampling:After SWS onset | PCOS:PCOS | CPAP:No CPAP |
| F9 | Gender:Female | OSA:Positive | Sampling:Morning fasting | PCOS:No PCOS | CPAP:After CPAP |
| F10 | Gender:Female | OSA:Positive | Sampling:Morning fasting | PCOS:No PCOS | CPAP:No CPAP |
| F11 | Gender:Female | OSA:Positive | Sampling:Morning fasting | PCOS:PCOS | CPAP:After CPAP |
| F12 | Gender:Female | OSA:Positive | Sampling:Morning fasting | PCOS:PCOS | CPAP:No CPAP |
| F13 | Gender:Male | OSA:Negative | Sampling:After SWS onset | PCOS:No PCOS | CPAP:No CPAP |
| F14 | Gender:Male | OSA:Negative | Sampling:Morning fasting | PCOS:No PCOS | CPAP:No CPAP |
| F15 | Gender:Male | OSA:Positive | Sampling:After SWS onset | PCOS:No PCOS | CPAP:After CPAP |
| F16 | Gender:Male | OSA:Positive | Sampling:After SWS onset | PCOS:No PCOS | CPAP:No CPAP |
| F17 | Gender:Male | OSA:Positive | Sampling:Morning fasting | PCOS:No PCOS | CPAP:After CPAP |
| F18 | Gender:Male | OSA:Positive | Sampling:Morning fasting | PCOS:No PCOS | CPAP:No CPAP |
