Data for (Study ST000009)
(Analysis AN000023)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 | F19 | F20 | F21 | F22 | F23 | F24 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 10-HYDROXYDECANOATE | 0.5689 | 1.3825 | 1.3470 | 1.4041 | 0.5911 | 1.0305 | 0.8831 | 0.9896 | 1.2983 | 0.4410 | 1.9718 | 1.1245 | 0.9604 | 1.4113 | 1.0124 | 0.9855 | 0.9081 | 1.1815 | 0.8147 | 0.9769 | 0.5358 | 0.3583 | 1.7170 | 0.8661 |
| 11-BETA-HYDROXYANDROST-4-ENE-3,17-DIONE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9680 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.1703 | 0.9125 | NA | 1.1561 |
| 12-HYDROXY-DODECANOIC ACID | 1.1162 | 1.0302 | 1.1705 | 1.0965 | 0.7736 | 1.0307 | 1.1350 | 1.0692 | 1.1616 | 0.6853 | 1.0310 | 1.2150 | 1.0359 | 0.9865 | 0.8245 | 1.0792 | 0.7653 | 1.0190 | 1.0452 | 0.8186 | 0.9789 | 0.6473 | 1.0793 | 1.0609 |
| [13C]-ISOLEUCINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.3648 | NA | NA | 0.6352 | NA |
| [13C]-LEUCINE | 1.0558 | 0.7310 | 0.9178 | 0.8999 | 0.9062 | 0.8420 | 0.9526 | 0.8073 | 0.7932 | 1.0269 | 0.7842 | 0.8424 | 1.1511 | 1.0580 | 1.0713 | 1.1731 | 1.0375 | 1.0873 | 1.0573 | 1.0059 | 1.1805 | 1.1443 | 1.0056 | 1.0307 |
| 17ALPHA-HYDROXYPROGESTERONE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.1019 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8981 | NA | NA |
| 1-METHYLADENOSINE | 1.1327 | NA | 0.9425 | 0.9137 | 1.2713 | 1.3222 | 0.8847 | 1.0910 | NA | 1.4081 | 0.5870 | 1.3072 | 0.4228 | 1.6444 | 1.0910 | 0.8081 | 1.2206 | 0.9897 | 0.8194 | 0.9330 | 1.2264 | 1.1214 | 0.6845 | 1.1064 |
| 2,3-DIAMINOPROPIONIC ACID | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 2^,4^-DIHYDROXYACETOPHENONE | 0.9678 | 0.7339 | 1.1668 | 0.8746 | 1.1654 | 1.2574 | 1.1877 | 1.5674 | 1.5527 | NA | 0.9350 | 1.3999 | 0.5090 | NA | 1.0637 | 0.7686 | 0.9918 | 0.7130 | 0.9571 | 0.8700 | 0.9049 | 0.9680 | 0.7208 | 0.7299 |
| 25-HYDROXYCHOLESTEROL | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 2,6-DIHYDROXYPYRIDINE | 0.6695 | 1.8070 | 0.9728 | 1.2448 | 1.6184 | 1.1318 | 1.0334 | 1.0260 | 1.4891 | 0.5600 | 0.4796 | 1.2433 | 0.5285 | NA | 0.7902 | 0.6096 | 1.1518 | 0.9430 | 1.0934 | 0.6720 | 0.8524 | 0.8572 | 0.6221 | 0.6983 |
| 2^-DEOXYADENOSINE | NA | NA | NA | NA | 1.1227 | NA | NA | NA | 1.7710 | NA | NA | 1.2099 | NA | NA | NA | NA | NA | NA | NA | 0.7603 | 0.5855 | NA | NA | 0.7111 |
| 2^-DEOXYADENOSINE 5^-MONOPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA |
| 2^-DEOXYCYTIDINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8517 | NA | NA | 1.1483 | NA |
| 2^-DEOXYCYTIDINE 5^-MONOPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 |
| 2-DEOXY-D-GLUCOSE | 0.7431 | 0.7663 | 0.5726 | 0.8032 | 1.2728 | 0.7580 | 0.9237 | 1.1085 | 0.8757 | 2.7083 | 1.0908 | 0.6668 | 0.6905 | 0.8938 | 0.4897 | 0.8695 | 1.3986 | 0.7532 | 1.0544 | 1.0389 | 0.8640 | 2.8779 | 1.2507 | 0.4636 |
| 2^-DEOXYGUANOSINE 5^-DIPHOSPHATE | NA | 0.9876 | NA | 1.0636 | NA | NA | 0.9703 | 0.7604 | 0.7662 | NA | 0.5527 | 0.4475 | NA | 0.8496 | NA | 1.2901 | NA | NA | 1.0754 | NA | 0.6507 | NA | 0.8662 | 1.1517 |
| 2-HYDROXYBUTYRIC ACID | 0.5988 | 1.4012 | 0.7776 | 1.0961 | 1.2443 | 1.1125 | 1.2824 | 0.6232 | 0.9830 | 0.9861 | 0.7868 | 1.6314 | 0.6462 | 0.6669 | 0.7956 | 1.0140 | 1.1981 | 0.9169 | 0.8213 | 0.5279 | 0.6355 | 0.8371 | 0.9805 | 1.2096 |
| 2-HYDROXYPHENYLACETIC ACID | 0.9350 | 0.7105 | 1.3763 | 0.9902 | 1.1978 | 1.2290 | 1.1034 | 1.5437 | 1.5249 | 1.3566 | 0.9204 | 1.4219 | 0.4994 | 0.6075 | 1.1176 | 0.8261 | 1.0229 | 0.6945 | 0.9279 | 0.4985 | 0.9203 | 0.9358 | 0.7112 | 0.7085 |
| 2-HYDROXYQUINOLINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.1661 | NA | NA | 1.8339 | NA |
| 2-QUINOLINECARBOXYLIC ACID | 0.4670 | NA | 1.2148 | NA | 0.8707 | 1.0596 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.1962 |
| 3-(2-HYDROXYPHENYL)PROPANOATE | NA | NA | NA | NA | 1.0199 | NA | NA | 1.2190 | NA | NA | 1.2674 | NA | NA | NA | NA | NA | 0.9262 | NA | NA | 1.1572 | NA | 0.4661 | 1.3936 | NA |
| 3,4-DIHYDROXYBENZOATE | 0.8054 | 0.5015 | 0.9142 | 0.9293 | 1.2033 | 0.9256 | 1.0013 | 0.7776 | 0.6494 | 0.7090 | 0.8021 | 1.0401 | 1.1488 | 0.8702 | 1.0181 | 1.0245 | 1.3077 | 0.9945 | 1.0901 | 0.7063 | 0.9063 | 0.9512 | 0.7498 | 1.0421 |
| 3-(4-HYDROXYPHENYL)PYRUVATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9826 | 1.0174 | NA |
| 3ALPHA-HYDROXY-5BETA-CHOLANATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 3^-CMP | NA | NA | NA | NA | NA | NA | NA | 1.4717 | NA | NA | NA | NA | 0.5780 | NA | 2.5398 | NA | NA | 0.7240 | NA | 1.0206 | NA | NA | 0.4443 | NA |
| 3-(CYSTEIN-S-YL)ACETAMINOPHEN | 0.7272 | 1.3235 | 1.0558 | 1.0834 | 0.7358 | 1.0430 | 1.2930 | 1.1149 | 1.1262 | 0.3427 | 1.2073 | 1.1937 | 0.9033 | 2.2161 | 0.9533 | 1.2023 | 0.7827 | 1.0264 | 1.0942 | 1.2483 | 1.1590 | 0.3688 | 1.1521 | 1.0878 |
| 3-DEHYDROSHIKIMATE | 1.0485 | 0.1676 | 1.2716 | 1.1755 | 1.3699 | 1.7654 | 1.2062 | 0.8102 | 2.5308 | NA | 0.7536 | 1.2342 | 1.0335 | 0.4733 | 0.3695 | 0.9285 | 1.0445 | 0.5873 | 0.6656 | 0.5695 | 0.3649 | NA | 0.6311 | 0.5737 |
| 3^-DEPHOSPHO COA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.1110 | 1.1328 | 1.2925 | 0.8381 | NA | 0.8493 | 1.0307 | NA | 0.9415 | NA | NA | 1.0881 |
| 3-HYDROXY-3-METHYLGLUTARATE | 0.8839 | 1.7349 | 0.8888 | 1.1983 | 1.1899 | 1.0164 | 1.0220 | 0.9083 | 0.8313 | NA | 0.4414 | 1.2678 | 0.6747 | 0.7798 | 0.7068 | 0.9757 | 0.9001 | 0.9903 | 1.0468 | 0.5501 | 0.6471 | 1.5406 | 0.7977 | 1.0128 |
| 3-HYDROXYANTHRANILATE | 1.0494 | NA | 0.9238 | 0.9997 | 0.8433 | 0.8712 | 1.1788 | 0.7677 | NA | 1.1922 | 0.8367 | NA | 0.8436 | NA | 0.8735 | 1.0699 | 1.1147 | 1.0280 | 1.0204 | 0.7791 | 1.0027 | 1.0428 | 0.8883 | 1.1099 |
| 3-HYDROXY-DL-KYNURENINE | 1.6103 | 0.6646 | 1.1253 | 1.2084 | NA | 1.2724 | 0.8275 | 0.6739 | 1.2299 | 1.2776 | 1.2270 | 1.2699 | 0.4829 | NA | 0.8598 | NA | 1.0205 | 0.9441 | NA | 0.7122 | NA | 0.4930 | 1.1382 | NA |
| 4-AMINOBENZOATE | 0.3612 | 1.5861 | 1.3226 | 1.1188 | 0.8085 | 1.0909 | 1.1028 | 1.6968 | 0.4186 | NA | 0.8360 | 0.3631 | 0.8316 | 1.3939 | 0.3176 | 1.2739 | 0.8768 | 1.1693 | 0.8718 | 1.5415 | 0.3778 | 1.2484 | 0.7920 | 0.9200 |
| 4-COUMARATE | NA | NA | NA | NA | 1.7987 | NA | NA | NA | NA | 1.6213 | NA | NA | 1.2231 | 0.7508 | 0.4957 | 0.4096 | NA | 1.6568 | 0.7422 | 1.0224 | 0.5343 | NA | 0.5578 | 2.0874 |
| 4-GUANIDINOBUTANOIC ACID | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA |
| 4-NITROCATECHOL | NA | NA | NA | NA | NA | NA | NA | NA | 0.2143 | NA | NA | 1.7857 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 4-NITROPHENYL PHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8402 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.1598 | NA | NA |
| 4-PYRIDOXATE | 0.2523 | 0.7939 | 0.3376 | 0.7617 | 0.1965 | 0.2009 | 3.9872 | 0.3272 | 0.8684 | 0.6227 | 0.2034 | 0.7535 | 0.2810 | 0.6934 | 0.2827 | 0.6404 | 0.1784 | 0.2250 | 2.3933 | 0.2863 | 0.6866 | 0.4621 | 0.2923 | 0.8271 |
| 5-Aminoimidazole ribotide | 0.8903 | 1.7474 | 1.3632 | 1.1193 | 1.0151 | 1.1206 | 0.9468 | 0.8219 | 0.8011 | 0.4243 | 0.6014 | 1.1949 | 1.6371 | 1.2195 | 0.8573 | 0.9447 | 0.8648 | 1.0927 | 1.1601 | 0.8757 | 0.8492 | 0.5241 | 0.8461 | 0.9298 |
| 5BETA-DIHYDROTESTOSTERONE | 0.4952 | 1.0479 | 1.3309 | 0.9573 | NA | 0.7760 | 0.9415 | 0.9031 | 1.6217 | 0.7273 | 0.7864 | 1.2036 | 1.0614 | 0.9928 | 1.1326 | 1.0817 | 0.9584 | 1.4214 | 0.8461 | 0.6776 | 1.0536 | 0.9455 | 1.2997 | 0.7787 |
| 5^-DEOXYADENOSINE | NA | NA | 1.0276 | NA | 1.3556 | 1.2850 | NA | NA | 1.9336 | NA | NA | 0.8574 | NA | NA | NA | 0.9472 | 0.8938 | NA | 0.9714 | 0.9821 | 0.4405 | NA | 0.4615 | 0.7853 |
| 5-HYDROXYMETHYLURACIL | NA | NA | NA | NA | 1.4451 | NA | NA | 0.7408 | 1.4708 | NA | 0.3018 | 0.6830 | 0.4506 | NA | 0.7294 | NA | 1.5089 | 0.4933 | NA | NA | NA | 0.8408 | NA | NA |
| 5-HYDROXYPENTANOIC ACID | 0.6034 | 0.8803 | 0.9958 | 0.8238 | 1.0894 | 0.9115 | 0.8047 | 0.8135 | 0.6687 | 1.5834 | 0.9956 | 1.2656 | 0.8662 | 0.9858 | 1.0325 | 1.0155 | 1.1804 | 0.9517 | 1.0060 | 0.9867 | 1.0870 | 1.5388 | 1.1399 | 1.2509 |
| 5-METHYLCYTOSINE | NA | NA | NA | NA | NA | NA | NA | 1.2354 | 0.8738 | NA | 1.1348 | 0.7560 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 5-OXO-PROLINE | 0.7961 | 5.0065 | 0.9275 | 1.1601 | 1.1866 | 0.8769 | 0.7736 | 0.8600 | 0.9416 | 1.4581 | 0.6213 | 0.8036 | 0.5944 | 0.9284 | 1.2386 | 0.9524 | 0.9673 | 0.7731 | 1.0753 | 0.6704 | 0.7902 | 1.2230 | 0.5630 | 0.5458 |
| 5-VALEROLACTONE | 1.0445 | 0.5623 | 0.9145 | 1.4837 | 1.1268 | 1.3225 | 0.9926 | 1.0447 | 2.2891 | 1.4941 | 0.8372 | 1.2026 | 0.5745 | 0.6134 | 0.6848 | 0.7177 | 1.0027 | 0.8689 | 0.7746 | 0.4707 | 0.9411 | 1.1120 | 0.5885 | 0.7200 |
| 6,7-DIHYDROBIOPTERIN | NA | NA | NA | NA | NA | NA | NA | 0.5972 | NA | NA | 1.4028 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 7-AMINOCEPHALOSPORANIC ACID | NA | NA | NA | NA | NA | NA | NA | NA | 1.4409 | NA | NA | 0.4439 | NA | NA | NA | NA | NA | NA | NA | NA | 1.0576 | NA | NA | NA |
| ACETOACETATE | 2.2681 | NA | 0.8486 | NA | NA | 1.1561 | NA | NA | 0.6701 | NA | NA | 0.4234 | 0.9708 | NA | 0.5001 | NA | NA | 0.7386 | NA | NA | 1.0363 | NA | 0.9653 | 1.0222 |
| ADENOSINE | 0.3573 | 2.0720 | 1.0333 | 1.4312 | 0.5159 | 0.8496 | 1.0479 | 0.8255 | 0.5607 | 0.1654 | 0.8828 | 1.0036 | 0.4632 | 0.9310 | 5.3923 | 0.8315 | 0.3621 | 0.7972 | 0.8964 | 1.0764 | 0.6563 | 0.2081 | 0.6006 | 0.6675 |
| ADENOSINE 3^,5^-CYCLIC MONOPHOSPHATE | 0.9047 | NA | 1.1578 | 0.9240 | 0.9028 | 1.2443 | 0.9732 | 0.7014 | 0.9008 | 1.3507 | 0.9829 | 1.1199 | 1.0529 | NA | 1.1000 | 0.9515 | 1.0173 | 0.9397 | 1.0567 | 0.8461 | 0.7873 | 0.7997 | 1.2568 | 0.8564 |
| ADENOSINE 5^-MONOPHOSPHATE | 0.2764 | 2.1384 | 0.7785 | 1.7255 | NA | 0.6473 | 1.0203 | 0.6285 | 0.4631 | NA | 0.6226 | 0.9909 | 0.3442 | 1.1582 | 3.8430 | 0.7603 | NA | 0.5967 | 0.8178 | 0.8946 | 0.5190 | NA | 0.5014 | 0.5963 |
| ADP-RIBOSE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA |
| ALANINE | 0.8547 | 1.2903 | 1.1673 | 1.2731 | 1.0460 | 1.2898 | 1.2052 | 0.6159 | 1.6769 | 0.4805 | 0.8696 | 1.5915 | 0.5501 | 0.4564 | 1.0433 | 0.9407 | 0.8189 | 0.9420 | 0.9994 | 0.4225 | 0.9045 | 0.3937 | 0.5877 | 0.7230 |
| ALLANTOATE | 0.8965 | 1.0483 | 1.1318 | 1.0531 | 1.2839 | 1.0003 | 0.8536 | 1.0412 | 1.3007 | 1.1273 | 0.7814 | 1.1706 | 0.7362 | 0.6794 | 1.0683 | 0.9307 | 1.1894 | 0.8024 | 1.0041 | 0.8701 | 0.9208 | 1.2076 | 0.6115 | 0.8882 |
| ALLANTOIN | NA | NA | NA | NA | NA | NA | NA | NA | 0.2032 | 1.2921 | NA | 1.2125 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| ALPHA-KETO-GLUTARATE | 1.1313 | 1.3861 | 0.9134 | 1.5389 | 0.5770 | 0.8904 | 1.1267 | 0.6752 | 0.6374 | 0.3287 | 0.5712 | 1.4773 | 0.8153 | 0.4681 | 0.9582 | 1.3765 | 0.6385 | 0.9382 | 1.1970 | 0.7488 | 0.8302 | 0.1415 | 0.9792 | 1.3381 |
| ALPHA-LIPOAMIDE | 1.1939 | NA | 1.2784 | NA | 0.7542 | 0.9997 | NA | 1.1917 | 1.0458 | NA | 0.8751 | 1.2832 | 1.1006 | NA | 1.0913 | 1.2133 | 0.6745 | 1.0073 | 0.9851 | 1.0569 | NA | 0.6633 | 1.0700 | 1.2722 |
| ALPHA-TOCOPHEROL | 0.8663 | 1.2352 | 1.0671 | 0.8652 | 0.7737 | 0.9387 | 1.1984 | 0.8160 | 1.2139 | 1.0600 | 0.8797 | 1.5301 | 1.0232 | 1.2641 | 0.8024 | 0.9829 | 0.9193 | 0.8908 | 1.1141 | 0.7676 | 1.3085 | 0.9846 | 1.0041 | 1.2653 |
| ANTHRANILATE | 0.7421 | 0.7749 | 0.9485 | 0.8826 | 1.3971 | 1.1273 | 0.9644 | 0.8230 | 1.9614 | 0.7573 | 0.7985 | 0.7915 | 0.6606 | NA | 0.6124 | 0.7278 | 1.1914 | 1.1462 | 1.0561 | 1.1239 | 0.9030 | 1.2599 | 0.6651 | 0.8164 |
| ARACHIDONOYLGLYCEROPHOSPHOCHOLINE | 0.7300 | 1.1060 | 1.0673 | 1.2653 | 0.7534 | 0.9497 | 0.8722 | 0.8924 | 1.1282 | NA | 0.7227 | 1.0657 | 1.5349 | 1.3342 | 0.9328 | 1.1314 | 0.8470 | 0.8748 | 1.2422 | 0.9450 | 1.2629 | 0.0086 | 0.7409 | 0.7350 |
| ASCORBATE | NA | NA | NA | NA | NA | NA | NA | 0.2355 | 2.2644 | 0.5801 | 0.0885 | 1.8661 | NA | NA | NA | NA | 0.9241 | NA | NA | NA | NA | 0.7123 | NA | NA |
| ASPARAGINE | NA | 1.2002 | NA | 1.1897 | 1.2984 | NA | 0.9253 | 0.9010 | NA | NA | 0.6776 | NA | NA | NA | NA | NA | NA | NA | NA | 0.5459 | 0.5850 | 1.6380 | 0.5095 | 0.6777 |
| BENZOIN | 0.9907 | 0.8284 | 1.0898 | 1.0813 | NA | 1.0085 | 1.0629 | 1.0217 | 1.0577 | NA | 0.8316 | 1.0793 | 0.8837 | 0.7272 | 1.0055 | 1.0592 | 0.6476 | 1.0362 | 1.0120 | 0.9375 | 1.0427 | NA | 0.8216 | 1.1011 |
| BETAINE | NA | 1.6220 | NA | 1.3455 | 1.2527 | NA | 1.1450 | 1.1750 | 0.6861 | 0.4189 | 0.5881 | 0.7132 | 0.7675 | 1.0196 | 0.8181 | 1.0760 | NA | 0.6698 | 0.9608 | 1.0662 | 0.7201 | 0.8177 | 0.7239 | 0.8745 |
| BILIVERDIN | 0.2363 | 0.2718 | 0.3276 | 0.3455 | 2.9161 | 0.5290 | 0.3476 | 0.3464 | 0.5046 | 7.2685 | 0.3969 | 0.4455 | 0.2671 | 0.3886 | 0.4383 | 0.3773 | 2.1154 | 0.3875 | 0.4619 | 0.4273 | 0.5350 | 5.7109 | 0.3094 | 0.5370 |
| BIS(2-ETHYLHEXYL)PHTHALATE | 0.5476 | 0.5403 | 0.7552 | 0.8523 | 0.7053 | 1.0138 | 1.0566 | 0.8553 | 1.0695 | 0.3904 | 1.1852 | 0.3465 | 2.8213 | 0.5982 | 2.1391 | 0.8866 | 0.6755 | 0.7394 | 1.6914 | 0.7664 | 0.8278 | 0.3059 | 0.5903 | 0.8429 |
| BISPHOSPHOGLYCERATE | NA | 0.4484 | NA | 1.3101 | 0.7941 | NA | 0.9654 | NA | NA | 0.8303 | NA | NA | 0.9664 | 0.3694 | 1.1523 | 1.1523 | NA | 0.9497 | 0.9433 | 1.1922 | 1.3347 | 1.0504 | 0.9043 | 0.9747 |
| BOC-ASN | 0.9854 | 0.9494 | 1.0515 | 1.0453 | 0.9807 | 1.0029 | 1.0535 | 0.9809 | 0.9615 | 0.9313 | 0.9278 | 1.0462 | 0.9506 | 0.8879 | 1.0287 | 1.0194 | 0.9851 | 0.9660 | 1.0114 | 0.9464 | 1.0149 | 0.9288 | 0.9420 | 0.9821 |
| CADAVERINE | NA | 1.2151 | NA | 1.0499 | NA | NA | 1.0243 | 0.7436 | 1.0454 | NA | 0.8859 | 1.0631 | 1.0556 | NA | 0.8463 | NA | 0.9893 | 0.8875 | NA | 1.2343 | 1.1281 | NA | 0.9413 | 0.9613 |
| CAPECITABINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.2342 | NA | NA | 2.5317 |
| CITRATE | 0.7309 | 0.9175 | 1.0907 | 1.3626 | 0.9496 | 1.0067 | 0.9785 | 0.5780 | 0.9368 | NA | 0.7762 | 0.8979 | 0.6911 | 0.5248 | 0.9182 | 1.2058 | 0.8181 | 1.0112 | 1.1443 | 0.5527 | 0.6390 | NA | 0.7114 | 0.8568 |
| CORTICOSTERONE | NA | NA | NA | NA | 0.9636 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0432 | NA | NA | NA | 1.3411 | NA | NA | 0.6316 |
| CORTISOL | 0.6444 | 1.3644 | 1.3194 | 1.2922 | 1.2136 | 1.1033 | 0.8702 | 0.7609 | 1.5910 | 0.4187 | 1.2411 | 1.0899 | 0.4614 | 1.3202 | 1.0370 | 0.7187 | 1.3046 | 1.2925 | 0.8494 | 0.5711 | 1.4226 | 0.3619 | 0.8103 | 0.8798 |
| CORTISOL 21-ACETATE | 0.4654 | NA | 1.1187 | 0.9993 | NA | 0.6900 | 1.1196 | 1.0143 | 1.4176 | NA | 0.9182 | 0.8809 | 1.1248 | 0.9073 | 1.0370 | 0.9991 | 0.8189 | 0.9708 | 1.0421 | 0.5469 | 1.2216 | 2.7980 | 0.6632 | 0.9102 |
| CREATINE | 1.3349 | 1.1399 | 1.2367 | 1.3217 | 1.0184 | 1.3351 | 1.2305 | 0.6588 | 1.8129 | 0.4287 | 0.8092 | 1.6121 | 0.5377 | 0.4409 | 1.0717 | 0.8695 | 0.7743 | 0.9195 | 1.0162 | 0.3885 | 0.8805 | 0.2751 | 0.5376 | 0.7440 |
| CREATININE FROM COMPLEX | 0.8779 | 0.6366 | 1.0954 | 0.7264 | 1.3850 | 0.9755 | 0.6005 | 0.7964 | 0.3847 | 2.3081 | 0.7520 | 0.5887 | 1.1322 | 0.8840 | 1.0087 | 0.8475 | 1.6515 | 1.2874 | 0.7984 | 0.8570 | 0.6365 | 1.8942 | 1.0231 | 0.7091 |
| CYCLOHEXANE-1,3-DIONE | NA | NA | NA | NA | 0.8365 | NA | NA | NA | NA | 0.6523 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.6748 | NA | NA |
| CYSTINE | 1.3312 | NA | 1.3578 | 1.3627 | 0.0720 | 1.7344 | 1.3387 | 0.1071 | 0.1008 | 2.2128 | 0.0747 | 0.2693 | NA | NA | 0.1017 | NA | 1.8199 | 0.1022 | NA | NA | 0.1256 | 0.0995 | NA | 0.1122 |
| CYTIDINE | 0.6005 | 0.2852 | 0.4577 | 1.3510 | NA | 1.1055 | 1.1507 | 0.7737 | 0.8610 | 1.1970 | 0.5955 | 0.7899 | 0.8240 | 0.6245 | 0.5979 | 1.3963 | NA | 0.8449 | 1.1672 | NA | 0.5654 | 0.6496 | NA | 0.5909 |
| CYTIDINE 5^-DIPHOSPHOCHOLINE | NA | NA | NA | NA | NA | NA | NA | NA | 0.9188 | NA | NA | 1.0812 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| DEOXYCHOLATE | NA | NA | NA | NA | NA | NA | NA | NA | 0.6855 | NA | NA | 0.6972 | NA | NA | NA | NA | NA | NA | NA | NA | 1.6172 | NA | NA | NA |
| DEOXYURIDINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.5632 | NA | NA | NA | NA | NA | NA | 1.1916 | NA | NA | 0.1937 | NA | 1.1078 | 0.2048 | NA |
| DETHIOBIOTIN | 0.9711 | 1.0070 | 0.9474 | 0.9811 | NA | 1.0400 | 0.9884 | 0.8585 | 1.1609 | NA | 0.9938 | 0.9753 | 1.0869 | NA | 1.0592 | NA | NA | 0.9820 | NA | NA | 1.0240 | NA | NA | NA |
| DIETHANOLAMINE | 1.3529 | NA | 0.4987 | NA | 0.7362 | 2.0546 | NA | 1.6995 | NA | NA | 1.3384 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.4787 | NA | NA | 0.6744 |
| DIHYDROFOLATE | NA | NA | NA | NA | NA | NA | NA | 0.5190 | 2.8265 | NA | 2.6269 | 0.8031 | NA | NA | NA | NA | 0.4770 | NA | NA | NA | 0.4184 | 1.3931 | 0.4526 | 0.7695 |
| DIHYDROOROTATE | 4.0420 | 1.1158 | 0.8132 | 1.5565 | 0.5956 | 0.5984 | 1.2721 | NA | 1.0022 | 0.4537 | NA | 0.7115 | 0.5378 | 0.4996 | 0.7119 | 0.9923 | 0.7452 | 0.5752 | 0.8920 | 0.7957 | NA | 1.9513 | 1.5917 | 0.8722 |
| DIHYDROTHYMINE | 0.4410 | 2.0542 | 0.8107 | 1.5284 | 0.7296 | 0.5973 | 0.7466 | 1.2127 | 0.9439 | 2.4318 | 0.7448 | 0.4724 | 1.1564 | 1.5615 | 0.7554 | 1.1836 | 0.7485 | 0.9335 | 0.9456 | 1.0930 | 0.9279 | 2.0628 | 0.7798 | 0.9298 |
| DIMETHYLARGININE | 1.0905 | 0.8866 | 1.0438 | 1.0375 | 1.1538 | 1.1255 | 0.8824 | 0.8288 | 1.0901 | 1.2033 | 0.8525 | 1.1698 | 0.9909 | 0.8634 | 0.9423 | 0.8871 | 1.1510 | 1.1529 | 0.9195 | 0.7531 | 0.9447 | 1.0063 | 0.8091 | 0.8975 |
| DIMETHYLBENZIMIDAZOLE | 0.5715 | NA | 0.7414 | 0.9630 | 1.1073 | 1.2890 | 1.0605 | 0.2905 | 1.1539 | 0.9960 | 1.0193 | 1.3101 | 1.4871 | 0.8920 | 0.7693 | 0.7111 | 1.0167 | 0.8150 | 1.2131 | 0.7340 | 1.2882 | 1.0431 | 0.9892 | 1.2008 |
| DIPALMITOYLGLYCEROL | 4.7930 | 0.5713 | 0.0996 | 0.2223 | 0.2266 | 0.1223 | 3.3017 | 0.1649 | 0.1575 | 2.7957 | 0.1491 | 0.1133 | 0.0946 | 0.0937 | 0.3953 | 2.6777 | 0.0960 | 0.1364 | 0.1639 | 0.1501 | 0.1390 | 1.0595 | 0.1367 | 0.1862 |
| DOCOSAHEXAENOYLGLYCEROPHOSPHOCHOLINE | 1.1916 | 0.6162 | 0.7997 | 1.0668 | 1.0888 | 1.0108 | 0.9218 | 1.3385 | 0.6993 | NA | 1.2303 | 0.9716 | 1.1161 | 1.3585 | 1.1382 | 1.0343 | 0.3933 | 0.7763 | 1.0682 | 1.0744 | 0.7429 | NA | 1.2421 | 1.0497 |
| EPINEPHRINE | 0.7505 | 0.5847 | 0.9199 | 0.9241 | 0.9650 | 0.9012 | 1.0018 | 1.0835 | 1.3429 | 1.4281 | 1.2784 | 1.4109 | 0.7046 | 0.7483 | 0.6802 | 0.9921 | 1.1072 | 0.9107 | 1.0273 | 0.9206 | 1.2638 | 1.2804 | 1.1692 | 1.1730 |
| ERYTHRITOL | 0.4479 | 0.6485 | 0.5480 | 2.5729 | 0.4874 | 0.6355 | 0.5747 | 0.4451 | 0.6196 | NA | 0.4978 | 0.6640 | 0.2229 | 0.4160 | 0.5360 | 2.4523 | NA | 0.5543 | 0.5812 | 0.3870 | 0.5023 | NA | 0.4280 | 0.6118 |
| ESTRADIOL 17 ALPHA | NA | NA | NA | NA | NA | NA | NA | 0.6903 | NA | NA | 1.3097 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| ESTRIOL | 1.9216 | 1.2102 | 1.4031 | 0.8035 | 0.8405 | 0.8138 | 1.0757 | 0.6987 | 0.9049 | 1.3699 | 0.4458 | 1.0923 | 1.0961 | 0.5626 | 1.0432 | 1.0381 | 0.6179 | 1.1167 | 0.9603 | 0.6337 | 1.4088 | 1.7680 | 0.6248 | 1.0477 |
| FERULATE | 0.7676 | 0.8260 | 0.7397 | 1.0291 | 0.5618 | 2.0387 | 0.9923 | 0.5088 | 1.0131 | NA | 0.6504 | 0.8677 | 0.8203 | 0.8329 | 1.4680 | 1.2912 | NA | 0.4145 | 0.7838 | NA | 0.9689 | NA | 0.6454 | 0.6547 |
| FLAVIN ADENINE DINUCLEOTIDE | 0.7207 | NA | 1.1806 | 0.9594 | 1.1103 | 1.2014 | 1.2772 | 0.6931 | 0.4465 | 0.7141 | 1.5945 | 1.6861 | 0.4115 | NA | 1.0483 | 1.0487 | 0.9169 | 1.2142 | 0.9110 | NA | 0.7844 | 0.5323 | 1.0544 | 1.0569 |
| FOLIC ACID | NA | 0.2215 | NA | 0.2982 | NA | NA | 2.0684 | NA | 0.3839 | NA | NA | 0.2665 | NA | NA | NA | NA | NA | NA | NA | 0.3632 | 2.1145 | NA | NA | 2.1557 |
| FORMYL-L-METHIONINE | NA | NA | NA | NA | 1.0417 | NA | NA | 1.1669 | 0.9512 | NA | 0.2957 | 0.8534 | 1.1645 | NA | 1.3193 | NA | 1.1322 | 0.6532 | NA | 0.4027 | NA | NA | 1.3265 | NA |
| FRUCTOSE 1,6-BIPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| GLUCOSAMINATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| GLUCOSAMINE 6-PHOSPHATE | 0.6477 | 1.4824 | 1.1113 | 1.0102 | 0.7342 | 1.0132 | 1.0497 | 0.8969 | 1.1727 | NA | 0.8703 | 1.1251 | 0.7547 | 1.3250 | 1.4187 | 1.0908 | 0.8006 | 0.9720 | 0.9996 | 0.8784 | 1.0096 | NA | 0.9673 | 0.9142 |
| GLUCOSE-6-PHOSPHATE | 0.9484 | NA | 1.0551 | NA | NA | 0.9159 | NA | 1.0882 | NA | NA | 1.5058 | NA | 1.1292 | NA | 1.3416 | NA | NA | 0.6653 | NA | 0.6348 | NA | NA | 1.3068 | NA |
| GLUTAMIC ACID | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| GLUTAMINE | 0.6717 | 0.4647 | 1.0028 | 1.1996 | 1.1979 | 1.0755 | 0.8758 | 1.0163 | 1.0637 | 1.0981 | 0.7599 | 0.9538 | 0.8462 | 0.7783 | 1.0691 | 0.9193 | 1.0862 | 0.8730 | 1.0512 | 0.9600 | 1.0036 | 1.2178 | 0.7644 | 0.9454 |
| GLUTARATE | NA | NA | NA | NA | NA | NA | NA | 0.0552 | NA | 2.7794 | 0.1566 | NA | NA | NA | NA | NA | 0.3954 | NA | NA | 0.1110 | 1.2265 | 2.4079 | 0.1613 | 0.1926 |
| GLUTATHIONE REDUCED | NA | NA | NA | 1.2397 | 0.6513 | NA | 1.0307 | 1.4579 | NA | NA | 0.8838 | 0.8563 | 0.7429 | NA | 2.6471 | NA | NA | 0.5799 | NA | 1.1559 | 0.7234 | NA | 0.6660 | 0.1847 |
| GLYCERIC ACID | 0.5093 | NA | 0.6162 | NA | 1.3868 | 1.1510 | NA | NA | NA | 0.9369 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.6960 | 1.0508 | NA |
| GLYCEROPHOSPHOCHOLINE | 1.1098 | 1.7917 | 1.1016 | 0.9381 | 1.3943 | 0.9705 | 0.8383 | 0.6379 | 0.6504 | 2.0613 | 0.4127 | 0.9022 | 1.3147 | 0.9473 | 0.6492 | 0.7563 | 1.3224 | 0.8479 | 1.0750 | 0.6304 | 0.6631 | 2.0103 | 0.6189 | 0.7079 |
| GLYCINE | 0.4493 | 0.6839 | 0.9022 | 1.1158 | 1.2328 | 0.6148 | 0.8114 | 0.4606 | 0.5907 | 1.1136 | 0.5492 | 0.4424 | 0.7813 | 0.7315 | 1.2511 | 1.4411 | 1.7267 | 0.7838 | 1.1741 | 0.5720 | 0.6917 | 1.3911 | 0.7328 | 0.5679 |
| GLYCOCHOLATE | 0.4334 | 0.6255 | 1.5766 | 1.6167 | 0.5171 | 0.9930 | 1.3501 | 0.5185 | 0.8864 | 0.2257 | 0.3613 | 0.6870 | 0.6003 | 0.5534 | 1.7866 | 1.2767 | 0.5262 | 1.1101 | 1.3487 | 0.2965 | 0.8224 | 0.2039 | 0.2929 | 0.3864 |
| GUANINE | 1.2198 | 1.3515 | 1.1587 | 1.2661 | 1.3354 | 1.3805 | 1.0011 | 1.1993 | 1.6211 | NA | 0.9402 | 1.1541 | 0.5122 | 0.4425 | 1.0355 | 0.6213 | 0.9776 | 0.7634 | 0.9087 | 0.6392 | 0.6084 | NA | 0.6066 | 0.6037 |
| GUANOSINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| GUANOSINE 5^ MONOPHOSPHATE | 0.4240 | 2.3700 | 0.8298 | 1.2803 | NA | 1.0438 | 0.8301 | NA | 0.5157 | NA | NA | 2.0757 | NA | NA | NA | NA | NA | NA | NA | 0.5773 | 0.7270 | NA | 0.7458 | 0.9739 |
| HEPTADECANOYLGLYCEROPHOSPHOCHOLINE | 1.2480 | 1.7963 | 1.3179 | 1.0536 | 1.2224 | 0.8120 | 0.8696 | 0.7691 | 0.9939 | NA | 0.5752 | 0.8113 | 1.5557 | 1.6663 | 0.6469 | 0.9658 | 1.2406 | 0.8412 | 1.1009 | 0.8830 | 1.1523 | NA | 0.6265 | 0.6533 |
| HEXOSE | 0.5926 | 1.0274 | 0.8792 | 0.8749 | 1.3169 | 1.0456 | 0.9089 | 0.8395 | 1.2800 | 1.6394 | 0.9675 | 1.3948 | 0.7834 | 0.7914 | 0.8746 | 0.7732 | 1.3656 | 0.8583 | 0.9893 | 0.7206 | 0.9459 | 1.4909 | 0.8528 | 1.0033 |
| HISTIDINE | 0.7218 | 0.8872 | 1.1332 | 0.7388 | NA | 1.6609 | 1.0406 | 1.2612 | 0.7128 | NA | 0.8640 | 1.3537 | NA | NA | NA | NA | 0.8955 | NA | NA | 1.2100 | 0.6384 | NA | 0.6003 | 0.9322 |
| HOMOCYSTEINE | 0.5943 | 0.8865 | 1.0533 | 0.9184 | 1.1174 | 0.9921 | 0.8003 | 1.0120 | 1.1606 | 2.4225 | 1.0432 | 1.1108 | 0.8434 | 0.9383 | 0.8579 | 0.8346 | 1.4320 | 0.9835 | 0.8372 | 0.8912 | 0.9744 | 1.7647 | 1.0191 | 0.9014 |
| HOMOGENTISATE | 0.5577 | NA | 1.1120 | 1.1697 | 0.9990 | 1.2550 | 1.0799 | 0.9958 | 1.9230 | 1.0847 | 0.8175 | 1.7127 | 0.5231 | NA | 0.5275 | NA | 0.8046 | 0.8165 | NA | NA | NA | 0.5248 | NA | NA |
| HOMOSERINE | 0.7427 | 1.2052 | 1.2412 | 0.8583 | 1.6192 | 1.3163 | 0.7983 | 0.9717 | 1.2020 | 1.4615 | 0.7272 | 1.0807 | 0.6679 | 0.6136 | 1.0456 | 0.6475 | 1.3130 | 0.9798 | 0.9687 | 0.6319 | 0.7704 | 1.1899 | 0.6437 | 0.7536 |
| HOMOSTACHYDRINE | 0.5067 | 1.4921 | 0.6719 | 1.2183 | 0.8667 | 1.1107 | 1.4717 | 0.6183 | 0.9707 | 0.7395 | 0.4221 | 0.6515 | 0.6871 | 1.4928 | 0.7110 | 1.1820 | 0.8735 | 0.6914 | 1.4092 | 0.6349 | 1.1495 | 0.8935 | 0.4046 | 0.4579 |
| HOMOVANILLATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9861 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0208 | NA | NA |
| INDOLE-3-ACETALDEHYDE | 0.3979 | NA | 0.6635 | NA | 1.1374 | 1.8277 | NA | NA | NA | 0.7578 | NA | NA | NA | NA | 1.1121 | NA | 0.9420 | 0.5951 | NA | NA | NA | 1.4273 | NA | NA |
| INDOLE-3-ACETAMIDE | NA | NA | NA | NA | 1.0594 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8910 | NA | NA | NA | 1.2138 | 1.0292 | NA | 1.0847 |
| INDOLE-3-ACETIC ACID | 0.5602 | 2.1034 | 0.7208 | 1.5134 | 0.5724 | 0.6189 | 1.5895 | 0.4819 | 1.1642 | 0.3210 | 0.4518 | 1.1931 | 0.4729 | 2.3189 | 0.5748 | 1.4043 | 0.5986 | 0.4825 | 1.3415 | 0.5075 | 1.2682 | 0.3775 | 0.4761 | 1.7000 |
| INDOLE-3-ETHANOL | 0.8091 | NA | 0.5557 | NA | 0.6694 | 0.8059 | NA | 1.5584 | 1.3054 | 0.8160 | 0.7305 | 0.9137 | 0.8986 | NA | 1.3547 | NA | 1.7173 | 1.1049 | NA | 0.6595 | NA | 0.5980 | 0.7413 | NA |
| INDOLEPYRUVATE | 1.1255 | 1.5246 | 1.0834 | 1.0605 | 1.5804 | 1.3332 | 0.9464 | 1.0995 | 1.7660 | 2.3431 | 1.0495 | 1.4358 | 0.5254 | 0.7493 | 0.7150 | 0.5177 | 1.0361 | 0.7260 | 0.8111 | 0.6081 | 0.6922 | 1.3081 | 0.7116 | 0.7626 |
| INOSINE | 0.0131 | NA | 0.1387 | NA | 3.3728 | 0.1179 | NA | 0.0454 | 0.0162 | 4.2337 | 0.1411 | 0.0226 | 0.0116 | 0.1700 | 0.2489 | 0.1114 | 1.9022 | 0.2735 | 1.0867 | 0.1023 | NA | 0.7044 | 0.0689 | NA |
| INOSINE 5^-DIPHOSPHATE | 0.9460 | 1.4632 | 1.0046 | 1.3325 | 0.6990 | 0.9230 | 0.9242 | 0.9006 | 1.0517 | NA | 0.7782 | 1.2150 | 0.8862 | 1.2710 | 0.7759 | 1.1668 | 1.0655 | 0.9310 | 0.9433 | 0.8676 | 0.8958 | NA | 1.0151 | 0.9371 |
| INOSINE 5^-MONOPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | 0.8782 | NA | NA | 0.8087 | NA | NA | NA | NA | NA | NA | NA | NA | 1.1577 | NA | NA | 0.9988 | NA |
| KYNURENIC ACID | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA |
| KYNURENINE | 0.7221 | 1.3489 | 1.2226 | 0.9529 | 0.9622 | 1.2108 | 1.0983 | 0.8396 | 1.1814 | 0.8876 | 0.9438 | 1.2664 | 0.8715 | 1.0896 | 0.9716 | 0.7850 | 0.9324 | 1.0135 | 1.0458 | 0.7303 | 1.0669 | 1.1684 | 0.9990 | 0.9924 |
| LENTICIN | 1.1229 | NA | 1.6104 | 1.1090 | NA | 0.9604 | 0.5565 | 0.4614 | NA | 1.1737 | NA | NA | 1.0179 | 0.5537 | 0.9898 | 0.6856 | 1.0626 | 1.0152 | 0.7945 | 0.8213 | 5.1739 | 2.0185 | 0.6013 | 2.0000 |
| LEUCENOL | 0.9152 | 1.0990 | 1.0373 | 1.0053 | 1.0572 | 0.9788 | 0.9264 | 0.9492 | 1.1158 | NA | 0.9506 | 1.1480 | 0.9970 | 1.1350 | 0.9969 | 0.9682 | 1.0808 | 1.0053 | 0.9735 | 1.0035 | 1.1540 | NA | 0.9573 | 1.0747 |
| LEUCINE | 0.8223 | 1.4711 | 1.2316 | 1.1931 | 1.1793 | 1.3342 | 1.1350 | 1.2680 | 1.6347 | 0.9358 | 1.2274 | 1.4532 | 0.6339 | 0.6856 | 0.9274 | 0.6533 | 0.9045 | 0.8917 | 0.8556 | 0.8066 | 0.8163 | 0.7422 | 0.8783 | 0.8562 |
| LINOLEOYLGLYCEROPHOSPHOCHOLINE | NA | NA | NA | 1.1242 | NA | NA | 0.8349 | 1.1263 | 0.9626 | NA | 0.3697 | 1.0537 | 1.3772 | 1.0878 | 1.1512 | 0.9126 | NA | 0.9470 | 1.0835 | NA | NA | NA | NA | NA |
| LL-2,6-DIAMINOHEPTANEDIOATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.1198 | 1.4498 | NA | 0.4119 | 1.0185 |
| LUMICHROME | NA | NA | NA | NA | NA | NA | NA | NA | 1.1194 | NA | 0.7899 | 1.1814 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| LYSINE | 0.7646 | 1.3287 | 1.0812 | 1.1751 | 1.4340 | 1.2318 | 0.9932 | 1.0454 | 1.5002 | 1.1704 | 0.8603 | 1.1297 | 0.5942 | 0.6402 | 0.9034 | 0.7369 | 1.0526 | 0.9677 | 0.9366 | 0.6828 | 0.8864 | 0.8852 | 0.6283 | 0.8083 |
| MELATONIN | 1.3995 | 0.7553 | 1.2390 | 0.9941 | NA | 1.1915 | 1.1520 | 0.4993 | 0.5267 | NA | 0.4445 | 0.9069 | 1.1326 | 0.8125 | 1.1200 | 0.8945 | 0.6423 | 1.2462 | 1.2048 | 0.4799 | 0.7257 | NA | 0.4080 | 0.6531 |
| MENAQUINONE | NA | NA | NA | NA | 0.9282 | NA | NA | 0.9397 | NA | NA | 1.4522 | NA | NA | NA | NA | NA | NA | NA | NA | 0.9476 | NA | NA | NA | NA |
| METHIONINE | 1.2478 | 1.3544 | 1.2302 | 1.3066 | 1.3323 | 1.4240 | 1.0116 | 1.2882 | 1.8011 | 1.3502 | 1.0554 | 1.2305 | 0.5233 | 0.5710 | 1.0316 | 0.5676 | 0.8715 | 0.7815 | 0.8488 | 0.6973 | 0.6833 | 0.8449 | 0.6505 | 0.6374 |
| METHYLGUANIDINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA | NA | NA | NA | NA | NA |
| METHYL JASMONATE | 1.1326 | NA | 1.2064 | 1.0122 | 0.9776 | 1.1569 | 0.9981 | 1.2627 | 0.7271 | 0.8443 | 0.8978 | 1.2544 | 1.5022 | 1.0147 | 1.0915 | 0.8618 | 0.8817 | 0.9229 | 0.9143 | 0.8289 | 0.6752 | 1.1492 | 1.1143 | 0.8779 |
| METHYLMALONATE | NA | NA | NA | NA | NA | NA | NA | NA | 1.3770 | NA | NA | 0.6230 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| METHYLXANTHINE | 3.1186 | NA | 1.0118 | 1.0149 | 0.8643 | 1.2563 | 0.7142 | 0.4567 | 1.6956 | NA | 1.0581 | 0.9015 | 2.3104 | 0.1732 | 0.8835 | 0.8006 | 0.9189 | 0.8360 | 0.7559 | 0.4114 | 1.1089 | 1.9349 | 1.0211 | 0.4455 |
| MYRISTOYLGLYCEROPHOSPHOCHOLINE | 1.2993 | 1.2699 | 1.5324 | 0.7846 | 1.1421 | 1.1954 | 0.9051 | 0.7165 | 0.8647 | NA | 1.3691 | 0.7778 | 1.2217 | 1.4381 | 0.8109 | 0.7069 | 1.2004 | 0.9870 | 1.3095 | 0.7386 | 0.9440 | NA | 0.5685 | 0.6774 |
| N1-METHYL-2-PYRIDONE-5-CARBOXAMIDE | 0.5490 | 1.4466 | 0.9623 | 1.0999 | 0.9275 | 0.9069 | 1.3754 | 0.7886 | 1.0540 | 1.7514 | 0.8109 | 1.2192 | 0.5871 | 1.3132 | 0.6127 | 0.8896 | 0.6382 | 0.9371 | 1.0800 | 1.3498 | 1.1492 | 0.6144 | 0.6819 | 1.9972 |
| N6-(DELTA2-ISOPENTENYL)-ADENINE | NA | NA | NA | NA | NA | NA | NA | 0.9395 | 1.4371 | 1.1462 | 0.8363 | 1.0024 | NA | NA | NA | NA | 0.7298 | NA | NA | 0.3482 | 1.0907 | 1.4250 | NA | 0.7070 |
| N-ACETYL-BETA-D-GLUCOSAMINYLAMINE | 1.0395 | 1.3643 | 1.5319 | 1.0976 | 0.9568 | 1.0024 | 0.9866 | 0.3012 | 1.4071 | 0.8873 | 0.4262 | 1.3195 | 0.8411 | NA | 1.4817 | 1.0225 | 0.6171 | 1.0117 | 0.8617 | NA | 1.0310 | 0.9139 | NA | 1.0077 |
| N-ACETYL-D-GALACTOSAMINE | NA | NA | NA | NA | NA | NA | NA | NA | 1.0673 | 0.9924 | NA | 1.0941 | NA | NA | NA | NA | 0.9399 | NA | NA | NA | NA | NA | NA | NA |
| N-ACETYL-D-TRYPTOPHAN | 1.0426 | NA | 1.1247 | NA | 1.0492 | 0.9049 | NA | NA | 0.9988 | 0.7077 | NA | 1.5645 | NA | NA | NA | NA | NA | NA | NA | 0.3931 | 1.0960 | 1.3018 | 0.8884 | 0.4570 |
| N-ACETYL-L-ASPARTIC ACID | 1.4262 | 1.0042 | 1.1082 | 0.9772 | 1.1016 | 1.0423 | 0.8850 | 0.5248 | 1.2823 | 1.2108 | 0.6133 | 0.6194 | 1.1817 | 0.5404 | 0.9124 | 1.0217 | 1.0538 | 1.0252 | 1.0322 | 0.7537 | 1.0756 | 1.1664 | 0.8785 | 0.9287 |
| N-ACETYL-L-LEUCINE | 0.7157 | 1.6075 | 2.5609 | 0.8583 | 0.6065 | 1.3373 | 1.3459 | 0.5839 | 0.4437 | NA | 1.1026 | 0.4346 | 0.9112 | NA | 1.0217 | 0.9299 | 0.9625 | 1.0682 | 1.3881 | 0.5747 | 0.6014 | 0.7330 | 0.4617 | 0.3417 |
| N-ACETYL-L-PHENYLALANINE | NA | NA | 1.1900 | NA | 0.9320 | 1.2025 | NA | NA | 0.9527 | 0.5694 | NA | 1.4174 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.4866 | 1.2391 |
| N-ACETYLPUTRESCINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA |
| N-ACETYLSEROTONIN | 1.7041 | NA | 1.4439 | 0.9071 | NA | 1.0874 | 0.9597 | 0.9522 | 1.0637 | NA | 0.6277 | 0.6307 | 1.1765 | NA | 1.6890 | 1.0062 | 0.6804 | 0.8293 | 0.9939 | 0.8736 | 1.3280 | NA | 0.6252 | 0.9194 |
| N-CYCLOHEXYLFORMAMIDE | 0.6520 | 0.7328 | 1.2621 | 1.0343 | 0.8229 | 1.1307 | 1.0901 | 1.3125 | 1.5706 | 0.5070 | 0.9113 | 1.0153 | 0.9964 | 1.0431 | 1.0520 | 0.9510 | 0.9921 | 0.9419 | 1.0803 | 0.7084 | 1.3494 | 0.5328 | 1.2046 | 1.0979 |
| NICOTINAMIDE | 0.5268 | 1.4474 | 1.0182 | 1.0702 | 0.9552 | 0.9009 | 0.9316 | 1.2049 | 0.5232 | NA | 0.7101 | 1.2634 | 0.5263 | 1.4328 | 2.9116 | 0.8213 | NA | 0.8917 | 0.9531 | 0.7723 | 0.5948 | NA | 0.9983 | 0.7153 |
| NICOTINAMIDE MONONUCLEOTIDE | 1.0952 | NA | 1.0690 | NA | NA | 0.8036 | NA | NA | 1.0085 | NA | NA | 0.9904 | 0.8326 | NA | 0.9193 | NA | NA | 1.0510 | NA | 1.4312 | NA | NA | 1.1004 | NA |
| N-METHYLANILINE | 0.6653 | NA | 1.0847 | NA | 1.0502 | 0.6360 | NA | 0.7956 | 1.2675 | NA | 0.9759 | NA | 0.8584 | NA | 0.9483 | NA | 1.1783 | 1.1249 | NA | 1.0823 | 0.7281 | 0.9125 | 1.1231 | 0.9769 |
| N-METHYLTYRAMINE | 1.0266 | 0.4200 | 0.9744 | 1.0044 | 1.0718 | 0.9570 | 0.9303 | 1.1754 | 1.1184 | NA | 0.9847 | 1.0901 | 1.0887 | NA | 0.9365 | 0.8633 | 1.1249 | 1.0850 | 0.9890 | 1.1018 | 1.2400 | 1.1476 | 0.9719 | 0.9829 |
| N,N,N-TRIMETHYLLYSINE | 0.7179 | 0.5437 | 0.7259 | 0.5635 | 1.6051 | 1.8295 | 0.7828 | 0.8024 | 0.4125 | 1.2791 | 0.6300 | 1.2349 | 0.9533 | 0.6604 | 1.9481 | 0.6825 | 2.0216 | 0.5555 | 0.7545 | 1.0068 | 0.4363 | 1.5288 | 0.8190 | 0.4541 |
| O-ACETYL-L-CARNITINE | 0.7557 | 1.1831 | 1.0472 | 1.1612 | 0.8734 | 0.9808 | 0.9536 | 0.9046 | 1.1445 | 0.4844 | 1.0264 | 1.2127 | 0.9741 | 1.1291 | 1.0482 | 1.0241 | 0.9466 | 1.0332 | 1.1287 | 0.8796 | 1.1691 | 0.6277 | 1.2277 | 1.2255 |
| OCTANOYLCARNITINE | 0.7733 | 1.0957 | 0.9046 | 0.6614 | 0.7704 | 0.9431 | 0.8082 | 0.6315 | 0.7902 | 0.6627 | 0.8772 | 1.0408 | 0.8634 | 2.8376 | 1.3790 | 1.0445 | 1.4783 | 1.0968 | 0.9886 | 1.0466 | 1.4300 | 1.3867 | 1.0876 | 1.4485 |
| OLEOYLGLYCEROPHOSPHOCHOLINE | 0.9738 | 1.4305 | 1.0062 | 1.1392 | 1.0265 | 0.8883 | 0.9226 | 0.7622 | 1.0478 | NA | 0.5566 | 0.8961 | 1.3669 | 1.4599 | 0.7701 | 1.2025 | 0.8879 | 0.8697 | 1.1810 | 0.7897 | 1.2055 | NA | 0.5444 | 0.7325 |
| ORNITHINE | 0.7890 | 0.8909 | 1.0180 | 1.1337 | 1.1357 | 1.1288 | 1.0250 | 0.8223 | 1.0666 | 1.7111 | 0.7688 | 1.2880 | 0.6789 | 0.9009 | 1.2921 | 0.8955 | 1.0921 | 0.8698 | 0.9571 | 0.7560 | 0.7798 | 1.1353 | 0.4607 | 0.9501 |
| OROTIDINE 5^-MONOPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0000 | NA | NA |
| PALMITOYLGLYCEROPHOSPHOCHOLINE | 1.0067 | 1.3171 | 1.0410 | 1.0552 | NA | 0.9449 | 1.0039 | 0.8755 | 1.0087 | NA | 0.7106 | 0.9451 | 1.1882 | 1.2124 | 0.8678 | 0.9986 | 1.1520 | 0.9134 | 1.1003 | 0.8316 | 1.1933 | NA | 0.7542 | 0.8851 |
| PANTOTHENIC ACID | 0.8122 | 1.6598 | 0.8028 | 1.3824 | 0.6229 | 0.8375 | 1.4635 | 0.7550 | 1.4598 | 1.2058 | 0.4595 | 1.0343 | 0.6690 | 1.2014 | 0.6857 | 1.1622 | 0.5590 | 0.9941 | 1.2267 | 0.5899 | 1.0600 | 0.5658 | 0.7609 | 1.0305 |
| P-BENZOQUINONE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.7801 | NA | NA | 0.4750 | NA | 1.1843 | 0.8388 | NA | 1.1247 | NA | 1.4410 | 1.0551 | NA | 0.5906 |
| PHENYLACETIC ACID | 0.9006 | 2.1153 | 0.8536 | 1.2387 | NA | 0.6819 | 0.9242 | NA | NA | 0.5227 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.3403 | 1.3066 | NA | 1.1476 | 0.9523 |
| PHENYLACETYLGLUTAMINE | NA | NA | NA | NA | 0.4857 | NA | NA | NA | NA | 0.9522 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 2.3335 | NA | NA |
| PHENYLETHANOLAMINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.4077 | NA | NA | 0.1846 |
| PHENYLHYDRAZINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0202 | NA | NA | 0.7287 | NA | 0.7573 | NA | NA | 0.9418 | NA | 1.0660 | NA | 1.4210 | 1.0996 | NA |
| PHOSPHOCHOLINE | 1.0455 | NA | 1.3530 | NA | NA | 0.8220 | NA | NA | 0.9267 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0535 | NA | NA | 1.0003 | NA |
| PHOSPHONOACETATE | 0.6154 | 0.5783 | 1.6992 | 0.9812 | 0.9889 | 0.6025 | 1.7800 | 0.6987 | 0.7292 | NA | 1.3459 | 0.7819 | 0.5195 | 3.2350 | 1.3319 | 0.9231 | 0.6908 | 0.5916 | 0.8678 | 0.6222 | 0.7343 | NA | 1.1283 | 0.6843 |
| PIPECOLIC ACID | 0.5046 | 0.6270 | 0.9147 | 1.0404 | 1.0787 | 0.9575 | 1.0313 | 0.9610 | 0.6821 | 1.2470 | 0.7594 | 1.0471 | 0.9004 | 0.6914 | 0.8939 | 1.0103 | 1.1679 | 0.9298 | 1.0666 | 1.0206 | 0.7037 | 1.4576 | 0.8465 | 1.0280 |
| PIPERINE | 0.5574 | 0.2741 | 0.8841 | 0.8742 | 1.5161 | 0.9571 | 1.1876 | 1.4819 | 0.6870 | 0.4975 | 1.4701 | 0.7981 | 0.8394 | 0.3706 | 0.7857 | 0.7854 | 1.2900 | 0.9207 | 1.1270 | 1.3524 | 0.6888 | 0.7424 | 1.7849 | 0.8992 |
| PREGNENOLONE | NA | NA | NA | NA | NA | NA | NA | 1.0446 | NA | NA | 0.9554 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| PROLINE | 1.2424 | 1.6874 | 1.1192 | 1.2460 | 1.2531 | 1.2374 | 1.0647 | 1.1938 | 1.8171 | 1.1144 | 1.0248 | 1.2898 | 0.6035 | 0.7002 | 0.8518 | 0.6967 | 0.8757 | 0.8264 | 0.8446 | 0.7331 | 0.8664 | 0.9171 | 0.6784 | 0.7343 |
| PROMETRYN | 0.8395 | 1.4104 | 0.8396 | 1.0321 | 1.0131 | 0.9217 | 1.0234 | 0.6520 | 1.0421 | 1.2522 | 0.8455 | 1.1603 | 1.0898 | NA | 1.0266 | NA | 0.9769 | 1.0598 | NA | 1.0902 | 0.9279 | 0.9722 | 0.9950 | 0.7760 |
| PROPIONYLCARNITINE | 1.0676 | 1.9312 | 0.9430 | 1.0388 | 0.8486 | 1.1174 | 1.2420 | 0.9516 | 1.2519 | 0.7456 | 0.9181 | 1.4298 | 0.7928 | 1.5747 | 1.0011 | 0.6847 | 0.7933 | 0.9221 | 1.1499 | 0.8800 | 1.0885 | 1.0068 | 0.9073 | 1.0460 |
| PTERIN | 1.0486 | 0.5883 | 1.1969 | 0.9128 | 0.6334 | 1.1100 | 0.9545 | 1.0960 | 1.1709 | 0.5590 | 1.1034 | 1.3244 | 1.1482 | 0.8603 | 1.0708 | 0.9840 | 0.9088 | 1.0133 | 1.0023 | 1.1904 | 1.5141 | 0.8522 | 1.2860 | 1.3714 |
| PYRIDOXAL | NA | NA | NA | 0.5080 | 0.4252 | NA | 1.3217 | NA | 0.8419 | NA | 0.5677 | 0.4006 | NA | NA | NA | 0.4775 | 0.4851 | NA | 3.0734 | 0.5049 | 0.2801 | 0.5156 | 0.5280 | 0.3173 |
| PYRIDOXAMINE | 0.9664 | 1.2903 | 0.7950 | 1.1852 | 1.6852 | 1.2188 | 1.0119 | 0.6961 | 1.3462 | 2.2556 | 0.5790 | 1.2435 | 0.5459 | 0.6627 | 0.7142 | 0.6890 | 1.0633 | 0.6684 | 0.9557 | 0.6187 | 0.5556 | 1.4509 | 0.6189 | 0.8328 |
| QUINATE | 1.1929 | 1.8041 | 0.7617 | 1.2070 | 0.8435 | 0.6819 | 0.7962 | 1.0298 | 1.7073 | 0.3152 | 1.6941 | 0.4320 | 1.3510 | 2.0296 | 1.0948 | 0.7460 | 1.5874 | 0.9436 | 1.1110 | 0.9666 | 1.2301 | NA | 0.9853 | 0.3968 |
| RAFFINOSE | 0.4194 | 3.2435 | 1.4321 | 0.6135 | 0.3434 | 1.7919 | 1.2267 | 0.6586 | 0.6704 | 0.2015 | 0.5044 | 2.4391 | 0.6664 | 4.4021 | 0.3624 | 0.9550 | 0.3852 | 1.1922 | 1.3793 | 0.5708 | 0.6031 | 0.3350 | 1.3201 | 1.4075 |
| RETINOATE | 0.4185 | 0.1293 | 0.7347 | 0.5439 | 0.3883 | 0.8349 | 0.7970 | 0.5474 | 0.5036 | NA | 1.1570 | 1.0873 | 0.6554 | 1.0800 | 1.7150 | 1.3415 | 0.4287 | 0.7534 | 2.4857 | 1.1542 | 0.8013 | NA | 0.9739 | 0.4376 |
| RETINOL | NA | NA | NA | NA | NA | NA | NA | NA | 0.8480 | NA | NA | 1.1520 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| RIBOFLAVIN | 0.2266 | NA | 1.8681 | NA | NA | 1.2105 | NA | 0.1841 | NA | NA | NA | NA | 0.0561 | NA | 1.8005 | NA | NA | 1.8080 | NA | NA | NA | 0.1482 | NA | NA |
| RIBOSE 5-PHOSPHATE | 0.8448 | NA | 0.9478 | NA | NA | 0.6839 | NA | 1.1746 | 1.1239 | 1.3561 | 0.9533 | 1.2718 | 0.9034 | NA | 0.7278 | NA | NA | 1.3182 | NA | NA | NA | NA | 0.8913 | NA |
| SACCHAROPINE | NA | NA | NA | NA | NA | NA | NA | 1.0449 | NA | NA | 0.9551 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| S-ADENOSYL-L-HOMOCYSTEINE | 0.7990 | 1.2105 | 1.1349 | 1.0222 | 0.9206 | 1.0138 | 1.1220 | 1.0565 | 1.0077 | 0.7194 | 0.9111 | 1.1240 | 0.8158 | 0.6281 | 1.3584 | 0.8665 | 0.9631 | 1.1306 | 1.0057 | 1.0259 | 0.6740 | 0.8981 | 0.8928 | 0.9248 |
| S-ADENOSYL METHIONINE | 0.9437 | NA | 0.9044 | 1.1693 | NA | 1.4196 | 0.8957 | 1.0891 | 1.1806 | NA | 0.8523 | 0.1491 | 0.6319 | 0.7799 | 0.9280 | 1.1668 | NA | 0.9347 | 0.9607 | 0.9599 | 1.3046 | NA | 0.8664 | 1.0263 |
| SALSOLINOL | NA | NA | NA | NA | NA | NA | NA | NA | 0.5574 | 1.1260 | NA | 3.0258 | NA | NA | NA | NA | NA | NA | NA | 0.3663 | NA | 0.9063 | 0.6196 | NA |
| SEROTONIN | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.1569 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.8954 | NA | NA |
| S-HEXYL-GLUTATHIONE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.6103 | 0.5971 | NA | NA | NA | NA | NA | NA | NA | NA | 0.6022 | NA | 1.1533 | 0.6762 | NA |
| SHIKIMATE | 6.1678 | 0.2868 | 0.3142 | 0.3339 | 0.4848 | 0.3671 | 1.7651 | 0.2621 | 0.2217 | 3.6988 | 0.3389 | 0.4212 | 0.3606 | 0.1948 | 0.3390 | 1.6161 | 0.5643 | 0.3198 | 0.4018 | 0.2385 | NA | 3.8461 | 0.1830 | 0.3561 |
| SPERMIDINE | NA | NA | NA | NA | NA | NA | NA | 1.5466 | 0.5084 | NA | 0.8424 | 1.0182 | NA | 1.2915 | NA | 1.3639 | NA | NA | 0.7905 | 0.7137 | 0.4245 | NA | 0.9473 | 0.6212 |
| SPERMINE | 0.8186 | 0.9735 | 0.8143 | 0.8238 | 1.3148 | 1.0152 | 0.9333 | 0.7781 | 1.3064 | 2.6014 | 0.8989 | 1.4187 | 0.6850 | 0.7289 | 0.7883 | 0.7879 | 1.3508 | 0.8092 | 0.9235 | 0.6195 | 0.8673 | 1.9463 | 0.7553 | 0.9467 |
| SPHINGANINE | 0.4911 | 5.1656 | 1.2967 | 0.9216 | 0.4206 | 1.1283 | 1.0938 | 0.8644 | 0.9625 | 0.3559 | 0.6171 | 2.8566 | 1.3815 | 4.1664 | 0.5065 | 0.8752 | 0.4915 | 0.8112 | 1.2656 | 0.6664 | 0.7796 | 0.4227 | 1.0713 | 1.6071 |
| SPHINGOSINE | 0.8646 | 3.6839 | 1.2594 | 0.5291 | 0.3802 | 1.1063 | 1.2382 | 0.6860 | 0.5632 | 0.2309 | 0.3254 | 2.8852 | 4.7136 | 3.2180 | 0.2996 | 0.7410 | 0.4246 | 0.7454 | 1.0178 | 0.3861 | 0.5991 | 0.3553 | 0.9767 | 1.2235 |
| SQUALENE | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.5119 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.5510 | NA | NA | 1.4251 |
| STACHYOSE | NA | NA | NA | NA | NA | NA | NA | NA | 0.1122 | NA | NA | 1.8878 | 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 | NA | NA | NA | NA | 0.7057 | NA | 0.9695 | 1.3553 |
| STEAROYL SPHINGOMYELIN | 1.0378 | 1.3370 | 1.0306 | 1.0803 | 0.9168 | 0.9471 | 0.9597 | 1.0267 | 0.9211 | 0.8223 | 1.2594 | 0.8339 | 1.0816 | 1.2071 | 0.9787 | 1.0086 | 0.9730 | 0.9969 | 1.0121 | 1.0205 | 1.0101 | 0.8107 | 1.2929 | 0.9381 |
| SUBERIC ACID | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0006 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9996 | NA | NA |
| SUCCINATE | 0.7605 | 2.5657 | 1.1343 | 1.0341 | NA | 1.0016 | 1.0049 | 0.8896 | 0.6384 | NA | 1.0994 | 0.8657 | 0.9485 | 2.0678 | 0.9024 | 1.1679 | 0.0666 | 0.9737 | 1.2924 | 1.1190 | 0.5246 | NA | 1.4089 | 0.9956 |
| TESTOSTERONE | NA | NA | NA | NA | NA | NA | NA | 1.2701 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.5095 | NA | NA | 0.9504 | NA |
| THEOPHYLLINE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.0186 | 0.8619 | NA | 1.1288 | NA |
| THIOPURINE S-METHYLETHER | 0.3082 | 0.2669 | 1.3979 | 1.3625 | NA | 0.5664 | 1.0561 | NA | NA | NA | NA | 0.7647 | NA | NA | NA | NA | NA | NA | NA | NA | 1.5514 | NA | 1.4505 | 0.7358 |
| THYMIDINE | NA | NA | NA | NA | NA | NA | NA | 0.9526 | 0.9751 | NA | 1.3187 | 1.1267 | 0.6870 | NA | 0.9351 | 1.3396 | NA | 0.6102 | 0.9070 | 1.1438 | 1.5906 | NA | 0.3255 | 1.2198 |
| THYROXINE | 0.9490 | 0.6589 | 1.1875 | 0.9402 | 0.7967 | 1.0987 | 1.0930 | 0.8644 | 1.2229 | 0.8720 | 0.9176 | 1.0377 | 0.9749 | 0.9362 | 0.9911 | 0.9715 | 0.9962 | 1.0711 | 1.0784 | 1.0478 | 1.1767 | 0.9619 | 0.9849 | 1.1198 |
| TRIMETHYLAMINE | 0.7452 | 0.6781 | 0.8573 | 0.9292 | 1.5039 | 0.8330 | 0.8522 | 1.2313 | 0.6910 | 1.5263 | 0.9321 | 0.8499 | 1.0079 | NA | 0.9002 | 1.0087 | 0.9853 | 1.0020 | 0.8770 | 0.9315 | 0.8290 | 2.0180 | 0.8368 | 0.9614 |
| TRYPTOPHAN | 1.0638 | 1.1722 | 1.3309 | 1.0394 | 0.9101 | 1.3988 | 1.0174 | 1.1059 | NA | NA | 1.0827 | NA | 0.6833 | 0.8828 | 1.0801 | 0.7379 | 1.0377 | 0.9085 | 0.9805 | 0.8649 | 1.2394 | 1.1791 | 0.8664 | 0.9418 |
| TYROSINE | 0.7783 | 1.4162 | 1.2328 | 1.1470 | 1.1233 | 1.4375 | 1.0538 | 1.1359 | 1.5175 | 0.6918 | 1.1085 | 1.4188 | 0.7306 | 0.8429 | 1.0419 | 0.6647 | 0.9010 | 0.8981 | 1.0256 | 0.7935 | 0.9377 | 0.5953 | 0.8782 | 0.9249 |
| URATE | 0.7279 | 0.8613 | 0.9361 | 0.9900 | 0.8559 | 1.0023 | 1.0456 | 1.0421 | 1.2246 | 0.9838 | 1.1356 | 1.3603 | 0.9267 | 0.9768 | 0.8720 | 0.8867 | 0.8986 | 0.9836 | 1.0688 | 1.0434 | 1.2385 | 1.2541 | 1.2374 | 1.2136 |
| UREA | 0.5814 | 0.7994 | 1.0024 | 0.7997 | 1.2534 | 1.1079 | 1.0428 | 0.5308 | 0.6919 | 1.1680 | 0.8009 | 1.5745 | 1.1248 | 0.7521 | 0.7098 | 0.9722 | 1.2133 | 1.0777 | 1.0739 | 0.5235 | 0.6858 | 1.2604 | 0.7941 | 1.0027 |
| URIDINE | 0.9089 | 0.8856 | 0.9537 | 0.8263 | 1.5093 | 0.9268 | 0.8462 | 0.7898 | 1.0558 | 2.5700 | 0.8214 | 0.7993 | 0.7055 | 0.7475 | 0.7027 | 0.7642 | 1.5190 | 0.8102 | 0.9543 | 0.7060 | 0.7510 | 2.2282 | 0.9129 | 0.6213 |
| URIDINE 5^-DIPHOSPHATE | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 1.2910 | NA | NA | 0.7090 |
| URIDINE 5^-DIPHOSPHO-N-ACETYLGALACTOSAMINE | NA | NA | NA | NA | NA | NA | NA | NA | 1.7552 | NA | NA | 1.1871 | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.6235 | NA | NA |
| UROCANATE | 0.6933 | 0.4719 | 1.3820 | 0.8383 | 1.0479 | 0.8278 | 0.8879 | 0.5957 | 0.6623 | 0.9860 | 0.7166 | 0.6094 | 2.3147 | 0.7105 | 1.7929 | 1.5161 | 1.0248 | 0.6351 | 0.8997 | 1.2845 | 0.6467 | 0.7309 | 0.7448 | 0.6283 |
| URSODIOL | 1.0084 | NA | 0.7306 | 0.9408 | NA | 0.9120 | 1.2688 | 0.9305 | 0.8289 | NA | 0.4712 | 1.0451 | NA | 1.7069 | NA | 1.0649 | NA | NA | 0.9938 | 0.6280 | NA | NA | 0.6420 | NA |
| VALINE | 0.8667 | 1.0415 | 0.8913 | 0.8007 | 1.9285 | 1.0220 | 0.8092 | 0.8600 | 1.1489 | 3.5957 | 0.8092 | 1.1236 | 0.4857 | 0.6683 | 0.6356 | 0.5079 | 1.4303 | 0.6977 | 0.8008 | 0.5654 | 0.6337 | 2.7572 | 0.7501 | 0.7013 |
| VITAMIN B12 | NA | NA | NA | NA | NA | NA | NA | 1.1925 | NA | 1.0008 | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | 0.9068 | NA | NA | 0.7065 |
| XANTHINE | 0.4079 | NA | 0.6150 | 0.6029 | NA | 0.4681 | 0.7045 | 0.4710 | 0.6380 | 1.3294 | 0.4609 | 0.6540 | 0.6245 | 0.9716 | 0.8819 | 0.8503 | 2.3126 | 0.7067 | 1.3788 | 0.7501 | 1.0012 | 2.4210 | 1.0030 | 1.3533 |
| XANTHOSINE | NA | NA | NA | NA | NA | NA | NA | NA | 0.5024 | NA | NA | 1.2064 | NA | NA | NA | NA | NA | NA | NA | NA | 1.6159 | NA | NA | 0.6752 |
| XANTHURENIC ACID | NA | NA | NA | NA | NA | NA | NA | 0.8972 | NA | 1.1781 | NA | NA | NA | NA | NA | NA | 1.1328 | NA | NA | 0.6592 | NA | NA | NA | NA |
Factors:
| F1 | AFTER_MEAL_TIME:30_MIN | gender:female | POST_SURGERY_TIME:12MO | SURGERY:GASTRIC_BAND |
| F2 | AFTER_MEAL_TIME:30_MIN | gender:female | POST_SURGERY_TIME:12MO | SURGERY:ROUX_EN_Y |
| F3 | AFTER_MEAL_TIME:30_MIN | gender:female | POST_SURGERY_TIME:6MO | SURGERY:GASTRIC_BAND |
| F4 | AFTER_MEAL_TIME:30_MIN | gender:female | POST_SURGERY_TIME:6MO | SURGERY:ROUX_EN_Y |
| F5 | AFTER_MEAL_TIME:30_MIN | gender:female | POST_SURGERY_TIME:NO_SURGERY | SURGERY:LEAN_CONTROL |
| F6 | AFTER_MEAL_TIME:30_MIN | gender:female | POST_SURGERY_TIME:PRE_SURGERY | SURGERY:GASTRIC_BAND |
| F7 | AFTER_MEAL_TIME:30_MIN | gender:female | POST_SURGERY_TIME:PRE_SURGERY | SURGERY:ROUX_EN_Y |
| F8 | AFTER_MEAL_TIME:30_MIN | gender:male | POST_SURGERY_TIME:12MO | SURGERY:GASTRIC_BAND |
| F9 | AFTER_MEAL_TIME:30_MIN | gender:male | POST_SURGERY_TIME:6MO | SURGERY:ROUX_EN_Y |
| F10 | AFTER_MEAL_TIME:30_MIN | gender:male | POST_SURGERY_TIME:NO_SURGERY | SURGERY:LEAN_CONTROL |
| F11 | AFTER_MEAL_TIME:30_MIN | gender:male | POST_SURGERY_TIME:PRE_SURGERY | SURGERY:GASTRIC_BAND |
| F12 | AFTER_MEAL_TIME:30_MIN | gender:male | POST_SURGERY_TIME:PRE_SURGERY | SURGERY:ROUX_EN_Y |
| F13 | AFTER_MEAL_TIME:NO_WAIT | gender:female | POST_SURGERY_TIME:12MO | SURGERY:GASTRIC_BAND |
| F14 | AFTER_MEAL_TIME:NO_WAIT | gender:female | POST_SURGERY_TIME:12MO | SURGERY:ROUX_EN_Y |
| F15 | AFTER_MEAL_TIME:NO_WAIT | gender:female | POST_SURGERY_TIME:6MO | SURGERY:GASTRIC_BAND |
| F16 | AFTER_MEAL_TIME:NO_WAIT | gender:female | POST_SURGERY_TIME:6MO | SURGERY:ROUX_EN_Y |
| F17 | AFTER_MEAL_TIME:NO_WAIT | gender:female | POST_SURGERY_TIME:NO_SURGERY | SURGERY:LEAN_CONTROL |
| F18 | AFTER_MEAL_TIME:NO_WAIT | gender:female | POST_SURGERY_TIME:PRE_SURGERY | SURGERY:GASTRIC_BAND |
| F19 | AFTER_MEAL_TIME:NO_WAIT | gender:female | POST_SURGERY_TIME:PRE_SURGERY | SURGERY:ROUX_EN_Y |
| F20 | AFTER_MEAL_TIME:NO_WAIT | gender:male | POST_SURGERY_TIME:12MO | SURGERY:GASTRIC_BAND |
| F21 | AFTER_MEAL_TIME:NO_WAIT | gender:male | POST_SURGERY_TIME:6MO | SURGERY:ROUX_EN_Y |
| F22 | AFTER_MEAL_TIME:NO_WAIT | gender:male | POST_SURGERY_TIME:NO_SURGERY | SURGERY:LEAN_CONTROL |
| F23 | AFTER_MEAL_TIME:NO_WAIT | gender:male | POST_SURGERY_TIME:PRE_SURGERY | SURGERY:GASTRIC_BAND |
| F24 | AFTER_MEAL_TIME:NO_WAIT | gender:male | POST_SURGERY_TIME:PRE_SURGERY | SURGERY:ROUX_EN_Y |
