Data for (Study ST000743)
(Analysis AN001159)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 |
|---|---|---|---|---|---|---|---|---|
| 16:0-18:0 PC (M+H)+ | 0.4958 | 2.2542 | 2.0027 | 0.3136 | 0.6705 | 0.5068 | NA | 1.0146 |
| 16:0 LYSO PC (M+H)+ | 0.8310 | 1.1957 | 0.9900 | 0.6362 | 0.8666 | 0.8145 | 1.6290 | 0.9571 |
| 16:0 LYSO PC (M+NA)+ | 1.3252 | 0.8212 | 0.5028 | 1.4203 | 0.8116 | 1.1482 | 0.7753 | 0.7563 |
| 18:0 LYSO-PE (M+H)+ | 0.9720 | 1.3660 | 0.7481 | 0.8508 | 0.7524 | 0.9337 | 0.8633 | 0.4997 |
| 1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID (M+H)+ | 1.3135 | 0.8491 | 0.3820 | 1.2313 | 0.2600 | 1.3359 | 1.0766 | 1.3775 |
| 1-METHYLADENOSINE (M+H)+ | 0.7580 | 1.0565 | 1.3066 | 0.7883 | 1.0783 | 1.0766 | 1.1630 | 1.0874 |
| 1-METHYLXANTHINE (M+H)+ | 0.8897 | 1.0286 | 1.0502 | 0.8692 | 1.0487 | 1.0762 | 1.1326 | 1.1498 |
| 24:0 SM (D18:1/24:0) (M+NA)+ | NA | NA | NA | 1.0000 | NA | NA | NA | NA |
| 25-HYDROXYCHOLESTEROL (M+H)+[-H2O] | 0.6951 | 0.2896 | 5.3628 | 0.6597 | 0.5919 | 0.2793 | NA | 0.4420 |
| 2-HYDROXY-3-METHYLBUTYRIC ACID (M+NA)+ | 0.9671 | 0.9744 | 1.2353 | 0.6206 | 0.5936 | 2.1919 | 0.8875 | 0.6466 |
| 3-(4-HYDROXYPHENYL)LACTIC ACID (M+NA)+ | 0.8374 | 0.8481 | 1.1950 | 0.8519 | 1.4998 | 1.5499 | 0.9464 | 1.2153 |
| 3-HYDROXYBENZALDEHYDE (M+H)+[-H2O] | 0.7204 | 0.3826 | 0.1686 | 0.1251 | 1.2428 | 6.6833 | 0.9858 | 0.3824 |
| 3-HYDROXYLAUROYLCARNITINE (*) (M+H)+ | 1.5662 | 0.9990 | 0.6493 | 0.2045 | 0.7655 | NA | 0.6414 | 0.4783 |
| 3-METHOXYTYROSINE (M+H)+ | 0.8950 | 1.0880 | 1.6728 | 1.2474 | 0.4324 | 0.9645 | 1.0455 | 0.6885 |
| 3-METHYLXANTHINE (M+H)+ | 0.8982 | 1.0264 | 1.0517 | 0.8961 | 1.0401 | 1.0545 | 1.1064 | 1.1525 |
| 4-ACETAMINOPHEN SULFATE (M+H)+ | 1.0000 | NA | NA | NA | NA | NA | NA | NA |
| 4-HYDROXYPHENYLACETIC ACID (M+H)+ | 1.1613 | 0.8277 | 1.8318 | NA | 0.3682 | 0.8330 | NA | NA |
| 5^-METHYLTHIOADENOSINE (M+H)+ | 0.8426 | 1.1032 | 1.0769 | 0.6920 | 1.0764 | 0.9769 | 1.0724 | 1.3221 |
| ACETAMINOPHEN (TN TYLENOL) (M+H)+ | 1.3320 | NA | NA | NA | NA | 0.0040 | NA | NA |
| ACETAMINOPHEN (TN TYLENOL) (M+NA)+ | 2.9481 | 0.0290 | NA | 0.0230 | NA | NA | 0.0215 | 0.0241 |
| ACETYLCARNITINE (M+H)+ | 1.9396 | 1.0173 | 0.2559 | 0.1632 | 0.9062 | 0.2289 | 0.3436 | 0.2744 |
| ADENOSINE 5^-MONOPHOSPHATE (M+H)+ | 0.9833 | 1.0453 | 1.1512 | 2.1316 | 0.5347 | 0.7656 | 0.3553 | 0.9927 |
| ADIPIC ACID (M+H)+ | 2.2462 | 0.5209 | 0.2441 | 0.3903 | 1.5710 | NA | 0.2693 | 0.2239 |
| ADIPIC ACID (M+NA)+ | 1.1458 | 1.3410 | 0.8468 | 1.1290 | 0.5468 | 1.0483 | 0.3735 | 0.4493 |
| ALPHA-LINOLENIC ACID (M+NA)+ | 1.2570 | 0.8235 | 1.7690 | 1.2814 | 0.9673 | 0.3589 | 0.5881 | 0.7132 |
| ALPHA-TOCOPHEROL (M+H)+ | 1.0014 | 1.1114 | 1.2621 | 1.0003 | 1.0225 | 0.6523 | 0.6675 | 0.9443 |
| ASPARAGINE (M+H)+ | 0.3882 | 2.1247 | 1.4737 | 0.6555 | 0.9028 | 0.4676 | 1.4377 | 0.1358 |
| BILIVERDIN (M+H)+ | 0.8878 | 1.1910 | 1.4269 | 0.3829 | 0.8028 | NA | 0.9789 | 0.8688 |
| BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+H)+ | 0.2936 | 2.8359 | 1.0157 | 0.4064 | 0.3046 | 0.1726 | NA | 0.4185 |
| BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+NA)+ | 0.0800 | 3.0424 | 0.1853 | 0.0976 | 0.1018 | 0.0590 | NA | 0.0668 |
| BUTYRYLCARNITINE (*) (M+H)+ | 0.9370 | 1.0276 | 0.5188 | 1.1554 | 0.9214 | 0.8300 | 0.9847 | 1.7591 |
| C12 GALACTOSYL(BETA) CERAMIDE (D18:1/12:0) (M+NA)+ | 0.9964 | 0.3749 | NA | 0.7755 | 1.6384 | 0.3471 | NA | 1.8784 |
| CAFFEINE (M+H)+ | 1.4638 | 0.6433 | 0.3592 | 1.3165 | 0.8923 | 2.7569 | 0.0406 | 0.2061 |
| CAFFEINE (M+NA)+ | 1.3814 | 0.5814 | 0.4612 | 1.2464 | 0.9294 | 2.2921 | NA | 0.2197 |
| CALCIDIOL (M+H)+[-H2O] | 1.3033 | 1.3302 | NA | 0.4195 | 0.2599 | 1.1994 | 0.5603 | 0.3572 |
| CARNITINE (M+H)+ | 0.2292 | 0.2044 | 0.0599 | 3.8479 | NA | NA | 2.0841 | 0.3701 |
| CARNOSINE (M+NA)+ | 1.2173 | 1.2905 | 0.5612 | 0.8017 | 1.5147 | 0.1212 | 0.8548 | 0.6230 |
| CHOLESTEROL (M+H)+[-H2O] | 0.8475 | 0.7318 | 2.1812 | 1.8224 | 0.5137 | 2.0835 | 0.4040 | 0.6778 |
| CHOLINE PHOSPHATE (M+H)+ | 0.7648 | 1.6334 | 0.6955 | 0.6354 | 0.6620 | 0.6901 | 0.7770 | 0.7120 |
| CITRIC ACID (M+NA)+ | 1.1936 | 0.8434 | 1.1168 | 0.9015 | 0.7142 | 1.6180 | 0.7381 | 0.7632 |
| CORTISOL 21-ACETIC ACID (M+NA)+ | NA | NA | NA | NA | NA | NA | 1.0000 | NA |
| CREATINE (M+H)+ | 1.1845 | 1.1236 | NA | 0.6919 | NA | NA | NA | NA |
| CREATININE (M+H)+ | 0.6154 | NA | NA | 2.1087 | NA | NA | NA | 0.2759 |
| CYSTATHIONINE (M+H)+ | 0.8695 | 1.0833 | 0.7555 | 0.8970 | 1.1754 | 1.6551 | 0.8610 | 0.8446 |
| CYSTEIC ACID (M+H)+ | 0.7994 | 1.1217 | 0.8454 | 1.0119 | 1.1392 | 1.2402 | NA | NA |
| CYTIDINE 5^-DIPHOSPHOCHOLINE (M+K)+ | 1.0734 | 1.2564 | 0.8428 | 0.7759 | 0.9550 | 0.7090 | 0.9183 | 1.0662 |
| DECANOYLCARNITINE (*) (M+H)+ | 1.1550 | 0.8608 | 2.0088 | 0.2661 | 1.1482 | 0.6606 | 1.3333 | 0.5197 |
| DECENOYLCARNITINE (*) (M+H)+ | 1.2386 | 0.8398 | 1.3888 | 0.3084 | 0.8737 | 1.0557 | 1.4690 | 0.5910 |
| DEOXYURIDINE (M+NA)+ | NA | 1.9452 | 0.4748 | 0.5273 | NA | 0.7533 | 0.4620 | 0.8920 |
| DEPHOSPHO-COA (M+H)+ | 0.8459 | 1.1730 | 0.9708 | 1.0448 | 0.8628 | 0.6680 | 1.1943 | 1.2028 |
| DESLORATADINE (M+H)+ | 1.9508 | NA | NA | NA | 0.0492 | NA | NA | NA |
| DESMOSTEROL (M+H)+[-H2O] | 0.9986 | 0.6606 | 0.1790 | 1.3007 | 1.1701 | 3.0552 | 0.3322 | 0.6471 |
| DODECENOYLCARNITINE (*) II M+ | 1.5735 | 1.0364 | 0.9181 | 0.4846 | 0.4184 | 0.4818 | 0.5863 | 0.6711 |
| DODECENOYLCARNITINE (*) M+ | 0.9391 | 0.7822 | 3.2602 | 0.2535 | 0.5960 | 0.9301 | 0.8912 | 1.1837 |
| EICOSADIENOYLCARNITINE (*) (M+H)+ | 1.0876 | 0.4649 | NA | 0.1602 | NA | 2.0245 | NA | NA |
| EICOSANOYLCARNITINE (*) (M+H)+ | 1.0502 | 0.2369 | NA | 0.2241 | NA | 2.3384 | NA | NA |
| EICOSENOYLCARNITINE (*) (M+H)+ | 1.9385 | 0.1042 | NA | 0.0187 | NA | NA | NA | NA |
| ELAIDIC ACID (M+H)+ | 1.1059 | 1.0168 | 1.5085 | 0.6933 | 0.9895 | 0.6909 | 0.8990 | 0.7282 |
| EPIBRASSINOLIDE [ISTD] (M+H)+ | 1.0123 | 0.9929 | 0.9967 | 0.9254 | 0.9829 | 0.9963 | 1.0400 | 1.0379 |
| EPIBRASSINOLIDE [ISTD] (M+NA)+ | 1.0141 | 0.9665 | 1.0458 | 1.0046 | 0.9947 | 0.9614 | 1.0176 | 1.0538 |
| GALACTURONIC ACID (M+NA)+[-H2O] | 0.7583 | 0.7717 | NA | 0.6229 | 2.3487 | NA | 1.3451 | 0.6365 |
| GLUCOSE (2M+NA)+ | 0.4526 | 1.7466 | 0.6017 | NA | NA | NA | NA | NA |
| GLUCOSE (M+NA)+ | 1.0077 | 1.7340 | 0.4915 | 0.7795 | NA | 0.4123 | 0.4340 | 0.6500 |
| GLYCEROL MYRISTATE (M+NA)+ | 0.8202 | 0.8550 | 1.1689 | 1.4240 | 1.3201 | NA | 1.1739 | 0.7427 |
| GLYCOCHENODEOXYCHOLIC ACID (M+H)+ | 1.0396 | 0.9541 | 2.3169 | 1.5977 | 0.1062 | 0.5931 | 0.8794 | 0.6109 |
| GLYCOCHENODEOXYCHOLIC ACID (M+H)+[-H2O] | 0.8095 | 1.0143 | 1.7345 | 2.3080 | 0.2836 | 1.1949 | 0.6552 | 0.5283 |
| GLYCOCHENODEOXYCHOLIC ACID (M+NA)+ | 0.8812 | 0.8989 | 1.6863 | 2.7042 | 0.2593 | 1.1393 | 0.5818 | 0.5089 |
| GLYCOCHOLIC ACID (M+H)+[-H2O] | 1.2408 | 0.6861 | NA | 1.2621 | 0.9634 | 1.3327 | 0.4204 | NA |
| GUANINE (M+H)+ | 1.6212 | 0.6656 | 0.8677 | 0.7621 | 0.5971 | 0.6933 | 0.5641 | 1.0340 |
| HEXANOYLCARNITINE (*) M+ | 1.1364 | 0.9954 | 1.3718 | 0.5953 | 1.1204 | 0.6780 | 1.0360 | 0.6716 |
| HIPPURIC ACID (M+H)+ | 0.6520 | 0.3449 | 0.1576 | NA | 1.1364 | 6.4220 | 0.9332 | 0.3633 |
| HIPPURIC ACID (M+NA)+ | 0.5977 | 0.4631 | 0.1401 | NA | 1.0576 | 5.2465 | 0.8938 | 0.3453 |
| HOMOGENTISIC ACID (M+H)+ | 0.7832 | 1.6167 | 1.1776 | 1.1317 | 1.3793 | 0.4249 | 0.3589 | 0.5446 |
| HOMOVANILLIC ACID (M+H)+ | 0.1078 | NA | 4.8700 | 0.3489 | NA | 0.4577 | NA | NA |
| HYPOXANTHINE (M+H)+ | 0.6579 | 1.5484 | 1.0842 | 1.0887 | 0.4842 | 0.6895 | 1.4395 | 0.3885 |
| IBUPROFEN (M+NA)+ | 0.7170 | 0.1469 | 0.2564 | 0.0152 | 4.3159 | 2.5446 | 0.4230 | NA |
| INDOLE-3-ACETALDEHYDE (M+H)+ | 0.4611 | 1.0703 | 0.0936 | 1.8878 | 1.0329 | 0.1030 | 0.9141 | 3.3040 |
| INDOLE-3-ACETIC ACID (M+H)+ | 1.0659 | 0.8471 | NA | 0.8476 | 1.9989 | NA | 0.9461 | 0.7530 |
| INDOLE-3-ACETIC ACID (M+NA)+ | 0.7994 | 1.0204 | 0.5330 | 1.0372 | 2.3262 | 0.7295 | 1.1741 | 0.9210 |
| INOSINE (M+H)+ | NA | 1.9890 | NA | 0.0110 | NA | NA | NA | NA |
| INOSINE (M+NA)+ | NA | 1.9827 | 0.0262 | NA | NA | NA | NA | 0.0084 |
| ISO-BUTYRYLCARNITINE (*) (M+H)+ | 0.6850 | 1.6086 | 0.6055 | 0.6343 | 1.0138 | 0.5446 | 0.9174 | 1.1100 |
| ISOLEUCINE (M+H)+ | 0.9370 | 0.9215 | 0.8506 | 0.7753 | 0.8152 | 0.9968 | 1.5816 | 1.5462 |
| ISOVALERYLCARNITINE (*) (M+H)+ | 1.3257 | 0.8053 | 0.4947 | 0.4131 | 0.9756 | 0.5510 | 1.6339 | 1.4077 |
| KYNURENIC ACID (M+H)+ | 0.7593 | 0.9215 | 1.2917 | 0.4660 | 1.3816 | 1.1316 | 2.0230 | 0.9833 |
| KYNURENINE (M+H)+ | 0.9068 | 0.9938 | 1.0267 | 0.8804 | 1.2957 | 0.8528 | 1.0567 | 1.2852 |
| KYNURENINE (M+NA)+ | 0.8574 | 0.9696 | 0.9717 | 1.0325 | 1.4024 | 0.9434 | 1.0125 | 1.3293 |
| LAUROYLCARNITINE (M+H)+ | 1.1344 | 0.9999 | 1.6422 | 0.3925 | 0.8323 | 0.6029 | 1.0280 | 0.9650 |
| LEUKOTRIENE B4 (M+H)+ | 1.3521 | 0.8697 | 1.2176 | 0.5718 | 1.2083 | 0.5404 | 0.9066 | 0.5380 |
| L-HISTIDINE (M+H)+ | 0.9988 | 1.0217 | 0.3806 | 0.8718 | NA | NA | 1.4232 | 1.2834 |
| LINOLEOYLCARNITINE (*) (M+H)+ | 0.2480 | 4.0962 | 0.5571 | 0.0022 | 0.5200 | 0.5808 | NA | 0.1555 |
| L-TRYPTOPHAN-15N2 [ISTD] (M+H)+ | 1.0301 | 0.9793 | 1.0086 | 0.9986 | 0.9741 | 1.0681 | 0.9270 | 0.9858 |
| LYSINE (M+H)+ | 0.8868 | 1.2472 | 0.9122 | 0.8173 | 0.6577 | 0.9795 | 1.0714 | 1.0256 |
| LYSINE (M+NA)+ | 0.7592 | 1.2752 | 0.9536 | 0.7739 | 0.6567 | 1.0447 | 1.2681 | 1.1658 |
| METHIONINE (M+H)+ | 0.9020 | 1.0007 | 1.1804 | 0.9480 | 0.9048 | 0.9719 | 1.0325 | 1.3515 |
| METHYL JASMONATE (M+NA)+ | 2.0684 | 0.8469 | 0.2284 | 1.1688 | 1.0169 | 1.6186 | 0.2083 | 0.2347 |
| MYRISTOYLCARNITINE (*) (M+H)+ | 0.7481 | 1.5183 | 1.0519 | 0.2384 | 0.7856 | 0.4128 | 1.8639 | 0.5814 |
| N-ACETYL-DL-SERINE (M+H)+[-H2O] | 0.8771 | 1.1721 | 0.8707 | 0.8471 | 0.9953 | 0.9852 | 1.0713 | 1.0334 |
| N-ACETYLGLYCINE (M+NA)+ | 0.8053 | 1.1650 | 2.3283 | NA | 0.3643 | NA | NA | 0.2017 |
| N-ACETYL-L-PHENYLALANINE (M+NA)+ | 0.9382 | 0.8826 | NA | 0.6850 | 1.7543 | NA | 1.0176 | 1.0807 |
| N-ACETYLNEURAMINIC ACID (M+H)+ | 0.9714 | 0.8648 | 1.5620 | 0.8395 | 0.3501 | 1.2625 | 1.0385 | 1.5453 |
| N-CYCLOHEXYLFORMAMIDE (M+H)+ | 1.1470 | 0.8744 | 0.5820 | 1.3040 | 1.1231 | 1.2978 | 0.7143 | 0.8932 |
| NICOTINAMIDE (M+H)+ | 0.7895 | 0.9415 | 1.4885 | 1.6043 | 0.8873 | 1.0129 | 0.7274 | 1.2970 |
| OCTANOYLCARNITINE (*) (M+H)+ | 1.1667 | 0.8690 | 1.9615 | 0.2949 | 1.1824 | 0.6457 | 1.2647 | 0.5080 |
| OCTENOYLCARNITINE (*) M+ | 0.9884 | 0.9950 | 0.9632 | 0.3852 | 0.5539 | 1.6267 | 1.9750 | 0.5623 |
| OLEIC ACID (M+H)+ | 1.0548 | 1.0608 | 1.1004 | 1.0587 | 0.6210 | 0.8190 | 0.9297 | 1.0086 |
| OLEIC ACID (M+NA)+ | 0.8599 | 0.9340 | 1.2844 | 1.8220 | 0.9735 | 0.7721 | 0.7371 | 1.1694 |
| OLEOYLCARNITINE (*) (M+H)+ | 0.9200 | 0.7028 | NA | 0.1714 | NA | 1.4009 | NA | 2.0449 |
| OLEOYL-GLYCEROL (M+NA)+ | 0.7357 | 1.5589 | 1.1963 | 0.6956 | 0.6172 | 0.6440 | 1.0860 | 0.5825 |
| OMEPRAZOLE (M+H)+ | NA | 1.9614 | NA | NA | 0.0386 | NA | NA | NA |
| ORNITHINE (M+H)+ | 0.9346 | 1.1776 | 0.8194 | 0.7484 | 0.6799 | 0.7590 | 1.2945 | 1.2501 |
| P-ACETAMIDOPHENYL BETA-D-GLUCURONIDE (2M+H)+ | 1.0000 | NA | NA | NA | NA | NA | NA | NA |
| P-ACETAMIDOPHENYL BETA-D-GLUCURONIDE (M+H)+ | 1.0000 | NA | NA | NA | NA | NA | NA | NA |
| P-ACETAMIDOPHENYL BETA-D-GLUCURONIDE (M+NA)+ | 1.0000 | NA | NA | NA | NA | NA | NA | NA |
| PALMITOLEYLCARNITINE (*) M+ | 1.1410 | 1.0934 | 0.9495 | 0.5347 | 1.2778 | 0.7019 | 0.9741 | 0.6242 |
| PALMITOYLCARNITINE (M+H)+ | 1.0119 | 0.5822 | NA | 0.2694 | NA | 2.1011 | NA | NA |
| PANTOTHENIC ACID (M+H)+ | 1.3346 | 1.2741 | 0.4766 | 0.4633 | 0.3295 | 0.2869 | 0.9222 | 1.0866 |
| PANTOTHENIC ACID (M+NA)+ | 1.3234 | 1.4124 | 0.3815 | 0.7829 | 0.4032 | 0.4441 | 0.6070 | 0.4380 |
| PIMELIC ACID (M+NA)+ | 0.4975 | 0.5609 | 1.3778 | 0.9269 | NA | 3.1781 | NA | 0.4004 |
| PIPECOLIC ACID (M+H)+ | 1.1214 | 0.8811 | 1.5020 | 1.0104 | 1.0311 | 0.5590 | 1.0708 | 0.8164 |
| PROPIONYLCARNITINE (*) (M+H)+ | 0.8193 | 1.1144 | 0.6273 | 0.7176 | 1.4541 | 0.6023 | 1.6377 | 1.2259 |
| RAFFINOSE (M+NA)+ | 1.3711 | 0.5435 | 1.3065 | 1.1841 | 0.6657 | 1.1901 | 0.7335 | 1.1763 |
| RIBOFLAVIN (M+H)+ | 1.4982 | 0.9928 | 0.6224 | 0.6410 | 0.4318 | NA | 0.8787 | 0.4552 |
| SALICYLURIC ACID (M+H)+ | 1.4124 | 0.0971 | NA | NA | 0.8784 | NA | 1.6121 | NA |
| SALICYLURIC ACID (M+NA)+ | 1.9283 | 0.2016 | NA | 0.2066 | 0.9622 | NA | 2.3774 | 0.3238 |
| SN-GLYCERO-3-PHOSPHOCHOLINE (M+H)+ | 1.1405 | 0.5199 | 0.8907 | 2.5425 | 1.7914 | 0.7521 | 0.9886 | 0.5336 |
| SPERMIDINE (M+H)+ | 0.6148 | 1.1005 | 1.1907 | 2.2178 | 0.7411 | 1.1605 | 0.6434 | 1.1856 |
| SPERMINE (M+H)+ | 0.6863 | 0.8573 | 1.4728 | 1.7043 | 0.8542 | 1.4832 | 0.7114 | 1.5997 |
| SPHINGANINE (M+H)+ | 0.1312 | 4.8951 | 0.1574 | 0.0361 | 0.2351 | 0.1713 | NA | 0.0852 |
| SPHINGOSINE (M+H)+ | 1.3285 | 0.5259 | NA | 0.1601 | NA | NA | NA | NA |
| STEAROYLCARNITINE (*) (M+H)+ | 1.5030 | 0.3171 | NA | 0.1738 | NA | NA | NA | NA |
| SUBERIC ACID (M+NA)+ | 0.7025 | 1.5108 | 0.8820 | 1.1141 | 0.7032 | 1.2245 | 0.6307 | 0.5927 |
| SULFADIMETHOXINE (M+H)+ | 1.6335 | 0.5862 | 0.4361 | 1.5398 | 0.1757 | 2.3504 | 0.1964 | 0.4231 |
| SULFADIMETHOXINE (M+NA)+ | 1.5912 | 0.6119 | 0.5393 | 1.5707 | 0.2488 | 2.0780 | 0.2373 | 0.5134 |
| TAUROLITHOCHOLIC ACID (M+H)+ | 0.7930 | 1.4264 | 0.5465 | 0.1631 | 0.4460 | NA | 2.1739 | 0.7927 |
| TETRADECADIENOYLCARNITINE (*) M+ | 0.9896 | 1.0049 | 2.0001 | 0.2210 | 0.5587 | 0.7179 | 1.2058 | 1.3187 |
| TETRADECENOYLCARNITINE (*) M+ | 1.1729 | 1.0038 | 1.7501 | 0.3015 | 0.8602 | 0.4821 | 0.8791 | 1.0202 |
| THEOBROMINE (M+H)+ | 1.3069 | 0.6725 | 0.4483 | 2.6404 | 1.8310 | 0.7943 | 0.0537 | 0.3147 |
| THEOPHYLLINE (M+H)+ | 1.1242 | 1.0117 | 0.5344 | 1.1562 | 1.0046 | 1.2578 | 0.0709 | 1.4443 |
| THEOPHYLLINE (M+NA)+ | 1.2825 | 0.8758 | 0.8200 | 1.5497 | 1.2274 | 1.2439 | 0.1460 | 0.3797 |
| TRYPTOPHAN (M+H)+ | 0.9114 | 1.0063 | 0.9537 | 1.0115 | 1.0693 | 0.8133 | 1.2468 | 1.2344 |
| TRYPTOPHAN (M+NA)+ | 0.9591 | 0.9806 | 0.9536 | 1.2376 | 1.0874 | 0.8181 | 1.0584 | 1.0861 |
| TYROSINE (M+H)+ | 0.7891 | 0.8782 | 1.0039 | 0.9898 | 1.1132 | 1.2822 | 1.4213 | 1.5207 |
| TYROSINE (M+NA)+ | 0.9843 | 0.9724 | 1.7306 | 1.1726 | 0.6706 | 1.0266 | 0.7026 | 0.8270 |
| URIC ACID (M+H)+ | 0.8962 | 1.1181 | 1.1194 | 0.8436 | 1.0482 | 0.8470 | 1.1367 | 0.9478 |
| URIDINE (M+H)+ | 0.6228 | 1.5293 | 0.0909 | 1.7283 | 1.1100 | 0.8739 | 0.6885 | 0.9000 |
| URIDINE (M+NA)+ | 0.6261 | 1.3365 | 1.4874 | 0.8227 | 0.7758 | 1.0078 | 0.6866 | 1.3693 |
| VALINE (M+H)+ | 0.8711 | 0.9706 | 1.0087 | 0.9706 | 1.2216 | 1.2330 | 1.0852 | 1.1144 |
| VALINE (M+NA)+ | 0.5302 | 1.5837 | 1.1295 | 0.7199 | 0.8840 | 0.8535 | 0.8931 | 1.0645 |
| XANTHOSINE (M+H)+ | NA | 0.8487 | NA | NA | NA | NA | 1.4539 | NA |
| ZEATIN [ISTD] (M+H)+ | 0.9953 | 0.9903 | 0.9994 | 1.0102 | 1.0189 | 1.0040 | 1.0161 | 1.0088 |
Factors:
| F1 | Gender:female | Glycemic status:diabetic | Neuropathy:Neuropathy |
| F2 | Gender:female | Glycemic status:diabetic | Neuropathy:no neuropathy |
| F3 | Gender:female | Glycemic status:normoglycemic | Neuropathy:Neuropathy |
| F4 | Gender:female | Glycemic status:normoglycemic | Neuropathy:no neuropathy |
| F5 | Gender:male | Glycemic status:diabetic | Neuropathy:Neuropathy |
| F6 | Gender:male | Glycemic status:diabetic | Neuropathy:no neuropathy |
| F7 | Gender:male | Glycemic status:pre-diabetic | Neuropathy:Neuropathy |
| F8 | Gender:male | Glycemic status:pre-diabetic | Neuropathy:no neuropathy |
