Data for (Study ST002916)
(Analysis AN004786)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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1,3-dimethylurate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 1-methylxanthine | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 2,5-dihydroxybenzoate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 2-hydroxy-3-methylbutyrate | 0.9811 | 0.9554 | 0.9858 | 0.9931 | 1.0289 | 1.1407 | 0.9852 | 0.9799 | 0.9849 | 0.9481 | 1.0020 | 1.0054 | 0.9853 | 0.9625 |
| 2-hydroxybutyrate | 0.7199 | 0.9503 | 0.7226 | 1.9529 | 1.1183 | 2.8272 | 0.5747 | 0.4507 | 0.7101 | 0.3869 | 0.3274 | 0.3169 | 0.5206 | 0.3719 |
| 3,4-dihydroxybenzoate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| 3-hydroxybutyrate | 1.4600 | 0.5050 | 1.0625 | 1.5170 | 0.9381 | 0.7281 | 1.5969 | 0.5486 | 1.8075 | 0.6272 | 1.0727 | 0.6107 | 1.2359 | 0.5732 |
| 3-methyl-2-oxovalerate | 0.5436 | 0.4654 | 0.8952 | 0.8908 | 5.0604 | 0.8673 | 1.4931 | 0.4292 | 1.4917 | 0.7314 | 0.6850 | 0.4692 | 0.5371 | 0.3735 |
| 3-methylxanthine | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| alanine-13C3 | 0.7006 | 0.6570 | 0.5690 | 0.7142 | 0.6468 | 0.6271 | 0.6854 | 0.6458 | 0.6620 | 0.6097 | 0.6251 | 0.5928 | 0.6107 | 0.6741 |
| alpha-muricholate | 1.1761 | 0.9771 | 1.1447 | 1.3289 | 0.7833 | 1.2242 | 1.6655 | 0.7164 | 0.5268 | 0.6152 | 1.0643 | 0.4475 | 0.7801 | 0.9101 |
| alpha-N-phenylacetylglutamine | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| alpha-tocopherol | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| AMP | 0.8321 | 0.9554 | 1.3853 | 1.7867 | 0.0631 | 1.2171 | 0.7136 | 1.1292 | 0.7988 | 1.1730 | 0.9510 | 0.8888 | 0.9420 | 0.8706 |
| androsterone sulfate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| anthranilic acid-15N | 0.9882 | 1.0069 | 1.0289 | 0.9062 | 1.0182 | 1.0017 | 0.9928 | 1.0464 | 1.0061 | 1.0079 | 1.0268 | 1.0465 | 0.9930 | 1.0053 |
| asparagine-15N2 | 0.6528 | 0.5352 | 0.5817 | 0.6262 | 0.3061 | 0.5428 | 0.5723 | 0.5291 | 0.5690 | 0.5718 | 0.5630 | 0.5889 | 0.6257 | 0.5412 |
| aspartate | 1.4477 | 1.0397 | 0.9947 | 1.4023 | 0.1975 | 1.0191 | 1.0167 | 1.0404 | 1.1744 | 1.2001 | 0.9710 | 1.1447 | 1.3110 | 0.9701 |
| aspartate-13C4 | 1.0128 | 1.2339 | 0.6382 | 0.8346 | 0.3615 | 0.9980 | 1.0361 | 0.9283 | 0.9733 | 1.0473 | 0.8597 | 1.0245 | 0.9842 | 1.0285 |
| aspirin | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| beta-muricholate | 0.9839 | 0.6579 | 1.1308 | 1.0858 | 0.8877 | 1.1077 | 2.2012 | 0.4008 | 0.8628 | 1.6481 | 1.1223 | 0.3257 | 0.5091 | 0.8078 |
| caffeate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| chenodeoxycholate | 0.8651 | 0.1659 | 0.9563 | 0.8552 | 4.0276 | 0.5662 | 2.1667 | 0.1975 | 2.8196 | 0.7473 | 1.0179 | 0.1295 | 0.3291 | 0.2219 |
| cholate | 1.2887 | 0.1151 | 1.0887 | 0.6376 | 0.9138 | 0.6628 | 4.8066 | 0.0917 | 2.3244 | 1.0957 | 1.0905 | 0.0192 | 0.3085 | 0.1237 |
| cholesterol sulfate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| cis-aconitate | 0.9580 | 0.8778 | 0.8992 | 1.2719 | 0.5588 | 0.9755 | 1.1529 | 0.9964 | 1.0495 | 1.0330 | 1.0619 | 1.0412 | 0.9743 | 0.8104 |
| citramalate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| citrate | 0.9097 | 0.8117 | 1.0219 | 1.6307 | 0.3973 | 0.8721 | 1.1461 | 0.8862 | 0.9785 | 1.0751 | 0.9522 | 0.8704 | 0.9328 | 0.7014 |
| citric acid-13C6 | 0.9916 | 0.9469 | 0.9153 | 0.7598 | 1.4026 | 1.3576 | 0.9224 | 0.9065 | 1.1380 | 0.8949 | 0.9752 | 0.8328 | 0.9811 | 0.9733 |
| dehydroepiandrosterone sulfate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| deoxycholate | 0.8204 | 0.7431 | 1.0380 | 1.1168 | 1.0782 | 0.9215 | 1.9262 | 0.7746 | 1.4848 | 0.8944 | 0.9795 | 0.8503 | 0.6021 | 0.6698 |
| deoxycytidine | 0.9171 | 1.3230 | 1.0643 | 0.6993 | 1.0175 | 0.6457 | 1.1059 | 1.1941 | 0.9706 | 1.2782 | 0.8958 | 1.2891 | 0.8825 | 1.2552 |
| edetate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| epibrassinolide+HCOOH | 1.0929 | 1.0295 | 1.0469 | 0.9716 | 1.1646 | 1.0611 | 1.1194 | 1.0282 | 1.1205 | 1.0647 | 1.1206 | 1.0557 | 1.1014 | 1.0419 |
| FA(10:0) | 1.0219 | 0.8996 | 1.1751 | 1.1588 | 1.0967 | 0.9740 | 0.9115 | 1.0982 | 0.9712 | 0.8993 | 1.1571 | 1.0804 | 0.8907 | 0.9614 |
| FA(10:0-COOH) | 0.9608 | 0.7486 | 1.6279 | 1.9553 | 0.9943 | 0.7667 | 0.8964 | 0.6675 | 0.8651 | 0.7167 | 0.8311 | 0.9515 | 0.8411 | 0.6829 |
| FA(10:0-OH) | 0.7050 | 0.6645 | 2.2021 | 1.6661 | 0.5815 | 0.8062 | 0.7059 | 1.0112 | 0.7883 | 0.8200 | 1.1656 | 1.0074 | 0.7393 | 0.6970 |
| FA(11:0-COOH) | 0.7936 | 0.7915 | 1.8725 | 1.6801 | 0.8842 | 0.8919 | 0.7057 | 0.8005 | 0.8915 | 0.8419 | 0.7915 | 0.9508 | 0.7204 | 0.7611 |
| FA(12:0) | 0.9181 | 0.7391 | 2.6967 | 2.1561 | 0.3603 | 0.5961 | 0.4823 | 0.8256 | 0.5573 | 0.6181 | 0.8175 | 1.0644 | 0.7251 | 0.5698 |
| FA(12:0-OH) | 0.9503 | 0.7701 | 1.4678 | 1.8214 | 0.2455 | 0.8414 | 0.7995 | 1.0293 | 0.5903 | 0.7567 | 1.0271 | 1.0203 | 0.8256 | 0.5326 |
| FA(12:1) | 0.8191 | 0.6738 | 1.4975 | 1.8387 | NA | 0.4834 | 0.7967 | 1.0604 | 0.7711 | 0.6601 | 1.0363 | 0.9738 | 0.8270 | 0.5670 |
| FA(12:2) | 0.7122 | 0.7083 | 1.1300 | 1.7328 | 0.6743 | 0.7580 | 0.9951 | 0.9935 | 0.9525 | 0.9470 | 1.0754 | 1.0136 | 0.7469 | 0.6831 |
| FA(14:0) | 0.9020 | 0.8188 | 1.6101 | 1.4244 | 0.5263 | 0.9143 | 0.7417 | 1.3108 | 0.8479 | 0.9873 | 1.2167 | 1.8769 | 0.8199 | 0.7203 |
| FA(14:0-OH) | 0.8855 | 0.7650 | 1.5367 | 1.7202 | 0.1041 | 0.9193 | 0.5995 | 1.2305 | 0.5540 | 0.7271 | 1.0732 | 1.2117 | 0.8108 | 0.5456 |
| FA(14:1) | 0.7686 | 0.6926 | 1.4555 | 1.9368 | 0.1154 | 0.5289 | 0.6766 | 1.1700 | 0.7854 | 0.7637 | 1.0290 | 1.4760 | 0.6831 | 0.6268 |
| FA(14:2) | 0.8889 | 0.7988 | 1.4395 | 1.6354 | 0.0666 | 0.4881 | 0.8175 | 1.2982 | 0.8609 | 0.9033 | 1.1970 | 1.2483 | 0.8580 | 0.5939 |
| FA(15:0) | 0.6169 | 0.7975 | 1.4228 | 1.0487 | 0.9785 | 0.9860 | 0.7810 | 1.3907 | 1.0826 | 1.0709 | 1.1362 | 2.4522 | 0.6066 | 0.8733 |
| FA(16:0) | 1.2273 | 0.9992 | 1.2217 | 1.3665 | 0.7841 | 0.9449 | 0.8264 | 1.2472 | 0.7794 | 0.7459 | 1.3582 | 1.4850 | 1.1687 | 0.8408 |
| FA(16:0-COOH) | 1.3322 | 0.7737 | 1.2352 | 1.6516 | 0.6548 | 0.9901 | 1.6289 | 0.7192 | 1.3900 | 0.7384 | 0.9057 | 0.7928 | 0.9424 | 0.6753 |
| FA(16:0-OH) | 0.8557 | 0.8272 | 1.2140 | 1.4251 | 0.5857 | 0.7760 | 1.1339 | 1.2125 | 1.0160 | 1.2535 | 1.1900 | 1.5991 | 0.9647 | 0.7022 |
| FA(16:1) | 0.9664 | 0.7654 | 1.2160 | 1.8793 | 0.4332 | 1.0354 | 0.8145 | 0.7733 | 1.0160 | 1.0348 | 0.8554 | 2.1631 | 0.7456 | 0.6836 |
| FA(17:0) | 0.6963 | 0.7906 | 1.3531 | 1.4931 | 0.6572 | 0.8466 | 0.9480 | 1.2660 | 0.9902 | 1.1771 | 1.1825 | 2.0000 | 0.7724 | 0.7417 |
| FA(18:0) | 1.0572 | 0.9633 | 1.2019 | 1.3118 | 0.9233 | 0.8421 | 0.9945 | 1.2176 | 0.8801 | 1.0508 | 1.3603 | 1.3664 | 1.1115 | 0.8648 |
| FA(18:1) | 1.1089 | 0.8812 | 1.1415 | 2.0337 | 0.4869 | 1.2003 | 0.9284 | 1.0522 | 0.7284 | 0.9821 | 1.0299 | 1.0773 | 0.8963 | 0.6574 |
| FA(18:2) | 1.0660 | 0.9600 | 1.1602 | 1.5482 | 0.4394 | 1.2658 | 1.0196 | 1.0535 | 0.7854 | 1.0247 | 1.0112 | 1.0955 | 0.9822 | 0.8468 |
| FA(18:3) | 0.9963 | 0.5126 | 1.1396 | 1.3234 | 0.1181 | 0.5372 | 1.6964 | 0.8121 | 1.2794 | 1.1273 | 1.3543 | 1.1195 | 1.1531 | 0.4602 |
| FA(18:4) | 1.3646 | 0.5118 | 1.1122 | 1.0507 | 0.1309 | 0.3515 | 1.5604 | 0.8045 | 1.3097 | 0.9097 | 1.4950 | 1.3949 | 1.4396 | 0.6517 |
| FA(19:1) | 0.7566 | 0.6500 | 1.0266 | 1.7522 | 0.3474 | 0.7214 | 0.8330 | 1.0065 | 0.8513 | 1.1419 | 1.0368 | 1.5398 | 0.8177 | 0.6370 |
| FA(20:0) | 0.7422 | 0.8278 | 1.2211 | 1.6924 | 0.5690 | 0.5847 | 1.0548 | 1.3728 | 0.8680 | 1.4691 | 1.1253 | 1.8761 | 0.7134 | 0.6960 |
| FA(20:1) | 0.7202 | 0.5821 | 1.2688 | 1.5724 | 0.0789 | 0.4632 | 1.8721 | 1.0435 | 1.4444 | 1.7334 | 0.9883 | 1.8462 | 0.8783 | 0.5932 |
| FA(20:2) | 0.6169 | 0.6567 | 0.9605 | 2.0562 | 0.1987 | 0.8595 | 0.8375 | 1.0484 | 0.6664 | 1.4198 | 0.8673 | 1.2888 | 0.7111 | 0.4925 |
| FA(20:3) | 0.8375 | 0.7139 | 1.1950 | 1.4563 | 0.2864 | 0.7825 | 1.2319 | 1.3845 | 0.8715 | 1.8932 | 1.4153 | 1.1814 | 1.0788 | 0.6838 |
| FA(20:4) | 1.1134 | 0.9511 | 1.2249 | 1.5596 | 0.2953 | 0.9004 | 1.3598 | 0.8814 | 1.2214 | 1.2931 | 1.2404 | 1.0925 | 1.0299 | 0.7233 |
| FA(20:5(5Z,8Z,11Z,14Z,17Z))) | 0.9828 | 0.7812 | 0.9741 | 1.4398 | 0.2563 | 0.5687 | 0.7778 | 1.2808 | 0.8260 | 1.5135 | 1.6459 | 2.3466 | 1.2141 | 0.7807 |
| FA(22:0) | 1.6189 | 0.6491 | 1.0419 | 1.0762 | 0.7912 | 0.5815 | 0.9268 | 1.4719 | 0.9531 | 1.4237 | 1.0513 | 1.6871 | 0.5575 | 1.7256 |
| FA(22:3) | 0.7175 | 0.7425 | 0.9713 | 2.0587 | 0.1289 | 0.5283 | 0.6483 | 1.2371 | 0.5754 | 1.5075 | 0.8917 | 1.4006 | 0.7970 | 0.6504 |
| FA(22:4) | 0.7210 | 0.7721 | 1.0754 | 1.5134 | 0.0580 | 0.5164 | 0.9536 | 1.3795 | 0.8148 | 1.7435 | 1.0567 | 1.3891 | 0.8312 | 0.6156 |
| FA(22:5) | 0.2326 | 0.8465 | 1.0745 | 1.7900 | 0.1437 | 0.8094 | 0.6828 | 1.2145 | 0.5482 | 0.4907 | 0.7288 | 2.7599 | 0.7073 | 0.9216 |
| FA(22:6(4Z,7Z,10Z,16Z,19Z)) | 1.0126 | 0.8843 | 1.1942 | 1.3550 | 0.2797 | 0.6171 | 1.2855 | 1.2477 | 1.1431 | 1.3761 | 1.3247 | 1.5186 | 1.1170 | 0.9117 |
| FA(23:0) | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| FA(24:0) | 0.6168 | 0.7701 | 1.2399 | 1.1918 | 0.8492 | 0.7103 | 0.9749 | 1.6566 | 0.9476 | 1.6461 | 0.9607 | 2.1834 | 0.5266 | 0.7330 |
| FA(24:1) | 0.6362 | 0.6956 | 1.0407 | 1.2112 | 0.1487 | 0.6095 | 1.3753 | 1.3121 | 1.0626 | 1.5812 | 0.8220 | 2.0636 | 0.6307 | 0.5966 |
| FA(26:0) | 0.5763 | 0.6763 | 1.3945 | 2.0767 | 0.3787 | 0.5502 | 1.0550 | 1.2311 | 0.9421 | 1.3810 | 0.7557 | 1.8384 | 0.5365 | 0.6805 |
| FA(8:0-COOH) | 0.6797 | 0.7879 | 1.8754 | 1.5566 | 0.7882 | 0.8647 | 0.6870 | 0.8771 | 0.7091 | 0.7799 | 0.8234 | 0.9252 | 0.7767 | 0.7149 |
| FA(8:0-OH) | 0.8838 | 0.8182 | 1.3155 | 1.8903 | 0.4088 | 1.1644 | 0.8201 | 0.9169 | 0.6644 | 0.6633 | 0.8184 | 0.8359 | 0.7319 | 0.6263 |
| FA(9:0-COOH) | 0.8439 | 0.8348 | 1.5890 | 1.6363 | 0.9367 | 0.9589 | 0.8073 | 0.8371 | 1.0468 | 0.8586 | 0.8389 | 0.9212 | 0.7340 | 0.7491 |
| gamma-glutamylisoleucine | 1.1042 | 0.8879 | 1.0250 | 0.9358 | 0.4597 | 0.9058 | 1.2363 | 0.9271 | 1.2061 | 0.9969 | 1.2337 | 0.9208 | 1.1341 | 1.0370 |
| gamma-glutamylleucine | 1.0943 | 0.9246 | 0.7174 | 1.1879 | 0.3202 | 0.7570 | 1.2344 | 1.2308 | 1.2769 | 1.3007 | 1.0038 | 1.1634 | 0.7077 | 1.0347 |
| gibberellic acid | 0.9951 | 1.0070 | 1.0171 | 0.9218 | 0.9976 | 0.9923 | 1.0130 | 1.0278 | 1.0144 | 1.0077 | 1.0299 | 1.0337 | 1.0036 | 1.0042 |
| glutamate | 1.2953 | 1.0183 | 0.7364 | 1.3362 | 0.1483 | 0.9421 | 1.4209 | 0.9288 | 1.1208 | 1.4714 | 1.1843 | 1.4762 | 1.1708 | 1.1531 |
| glutamate-13C5 | 0.4335 | 0.4384 | 0.4361 | 0.4651 | 1.6010 | 0.4686 | 0.4052 | 0.4220 | 0.4047 | 0.4118 | 0.4056 | 0.4206 | 0.4222 | 0.4241 |
| glutamine | 1.0690 | 1.0792 | 0.9909 | 1.3354 | 0.4159 | 1.0127 | 1.1165 | 1.0569 | 1.1511 | 1.0819 | 1.1157 | 1.0531 | 1.0692 | 1.0718 |
| glutamine-13C5 | 0.4277 | 0.3946 | 0.3747 | 0.4427 | 0.4336 | 0.3898 | 0.4027 | 0.3928 | 0.3742 | 0.3697 | 0.3663 | 0.3823 | 0.3701 | 0.3853 |
| glutarate | 0.9621 | 0.9027 | 1.0062 | 1.2979 | 0.9675 | 0.9980 | 0.9553 | 1.5367 | 0.9267 | 0.8191 | 1.0538 | 0.7555 | 0.8423 | 0.6099 |
| glycochenodeoxycholate | 1.6846 | 0.9359 | 1.1092 | 1.0729 | 0.3415 | 0.5857 | 2.1230 | 0.6585 | 1.0552 | 0.7735 | 1.4333 | 0.6132 | 1.2508 | 0.8464 |
| glycocholate | 1.6100 | 1.0073 | 1.1604 | 1.0361 | 0.0674 | 0.2372 | 3.0062 | 0.3017 | 1.2026 | 0.6157 | 1.8155 | 0.1159 | 1.2767 | 0.6789 |
| glycodeoxycholate | 1.5928 | 0.8629 | 1.0841 | 1.0283 | 0.3521 | 0.6360 | 1.9923 | 0.5910 | 1.0129 | 0.7365 | 1.3752 | 0.5760 | 1.1837 | 0.8849 |
| glycohyocholate | 1.6121 | 1.0074 | 1.1634 | 1.0379 | 0.0747 | 0.2361 | 2.9963 | 0.2988 | 1.1975 | 0.6129 | 1.8112 | 0.1214 | 1.2772 | 0.6827 |
| glycohyodeoxycholate | 0.7269 | 0.2917 | 1.1375 | 0.9531 | 0.5674 | 0.2871 | 4.9316 | 0.4576 | 2.4459 | 0.5785 | 0.6330 | 0.3044 | 0.6494 | 0.3510 |
| glycoursodeoxycholate | 0.7241 | 0.2958 | 1.1458 | 0.9594 | 0.6151 | 0.3043 | 4.8374 | 0.4669 | 2.4107 | 0.5753 | 0.6546 | 0.3064 | 0.6510 | 0.3548 |
| hippurate | 1.3156 | 0.8815 | 0.9834 | 0.9145 | 1.2774 | 1.2478 | 0.9478 | 0.4082 | 0.9406 | 0.8296 | 1.0694 | 0.8099 | 1.5547 | 0.8391 |
| histidine | 1.0073 | 0.9898 | 1.0394 | 1.0899 | 2.6089 | 0.8866 | 1.0046 | 1.0262 | 0.9551 | 1.0520 | 1.1652 | 1.0610 | 1.0706 | 1.0741 |
| histidine-13C6 | 0.4553 | 0.4104 | 0.4099 | 0.4433 | 0.4441 | 0.4403 | 0.4804 | 0.5022 | 0.5185 | 0.4055 | 0.3926 | 0.4351 | 0.4112 | 0.4149 |
| hydroxyindole acetate | 1.1081 | 1.3761 | 0.8212 | 1.1927 | 0.7752 | 1.0800 | 1.3199 | 0.9933 | 1.0689 | 0.6663 | 0.7581 | 0.7950 | 0.5772 | NA |
| hydroxyphenyllactic acid | 0.8682 | 0.9531 | 0.9560 | 1.2645 | 0.7292 | 1.0908 | 0.9047 | 0.9441 | 0.9165 | 0.9724 | 0.9940 | 0.9963 | 0.9881 | 1.0226 |
| hyodeoxycholate | 0.6822 | 0.2329 | 1.0514 | 0.7259 | 1.6214 | 0.2941 | 3.6952 | 0.7267 | 3.4118 | 0.6832 | 0.5587 | 0.5191 | 0.3616 | 0.2817 |
| indoleacrylate | 1.0043 | 0.9426 | 0.9987 | 1.0076 | 1.1107 | 1.0707 | 1.0287 | 0.9204 | 1.1026 | 0.8633 | 0.9994 | 0.9741 | 1.0075 | 0.9408 |
| indole lactate | 0.8280 | 0.8285 | 0.9206 | 1.2519 | 1.0112 | 1.2477 | 0.9551 | 0.8544 | 0.9671 | 0.9234 | 0.9438 | 1.0095 | 0.9328 | 0.9250 |
| isoleucine-13C6 | 0.8164 | 0.9143 | 0.9328 | 0.6400 | 1.4700 | 0.6079 | 0.8392 | 0.9077 | 0.8775 | 0.8654 | 0.8034 | 0.8282 | 0.8990 | 0.9858 |
| isoleucine-13C6+leucine-13C6 | 0.8486 | 0.9397 | 0.9614 | 0.7842 | 1.0698 | 0.8304 | 0.8926 | 0.9546 | 0.9311 | 0.9011 | 0.8799 | 0.9456 | 0.8898 | 0.9692 |
| ketoleucine | 0.5060 | 0.5097 | 0.9617 | 0.4226 | 6.6712 | 0.9981 | 1.4458 | 0.4294 | 1.4195 | 0.5255 | 0.6341 | 0.4433 | 0.5001 | 0.3843 |
| kynurenate | 0.8536 | 1.0311 | 0.8752 | 0.9460 | 0.4491 | 1.2079 | 0.8723 | 0.9822 | 1.0254 | 1.2624 | 1.0660 | 1.2137 | 1.0077 | 1.1123 |
| lactate | 1.2466 | 1.5960 | 1.1315 | 0.9743 | 0.8867 | 1.6927 | 0.6679 | 1.0561 | 0.6939 | 0.9190 | 0.8718 | 1.0165 | 1.1494 | 1.3965 |
| lactate-13C3 | 0.7150 | 0.6716 | 0.7078 | 0.6402 | 0.8909 | 0.4567 | 0.8315 | 0.6769 | 0.7551 | 0.6827 | 0.7211 | 0.7132 | 0.6730 | 0.6918 |
| leucine-13C6 | 0.8519 | 0.9358 | 0.9812 | 0.8347 | 0.9569 | 0.9098 | 0.9058 | 0.9686 | 0.9366 | 0.9084 | 0.9080 | 0.9916 | 0.8761 | 0.9582 |
| lithocholate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| lithocholate glycine conjugate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| lysine-13C6 | 0.4634 | 0.5510 | 0.5036 | 0.4595 | 0.4873 | 0.4815 | 0.4338 | 0.4385 | 0.5380 | 0.4672 | 0.4770 | 0.4490 | 0.4813 | 0.5205 |
| malate | 1.3444 | 1.1724 | 0.9755 | 1.1014 | 0.7365 | 1.5161 | 1.0472 | 1.0822 | 1.1667 | 1.1496 | 0.9379 | 0.9857 | 1.1646 | 0.9000 |
| malate-13C4 | 0.8808 | 0.9951 | 0.8117 | 0.7305 | 1.1325 | 1.2095 | 0.7686 | 1.1370 | 0.8204 | 0.9914 | 1.0378 | 0.9809 | 0.8179 | 0.9697 |
| maleate | 1.3480 | 1.1167 | 0.9716 | 0.6709 | 0.6084 | 1.5347 | 0.8426 | 1.1665 | 0.9578 | 1.1536 | 1.0156 | 1.0717 | 0.9571 | 0.5973 |
| methyl-3-hydroxybenzoate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| m-hydroxybenzoate | 1.0630 | 0.9755 | 1.1722 | 1.1634 | 1.2095 | 0.8097 | 0.7072 | 0.8733 | 0.7389 | 0.7725 | 0.9553 | 1.2064 | 1.1553 | 1.0584 |
| N-acetylleucine | 1.1683 | 0.8222 | 0.9883 | 1.3900 | 0.3943 | 0.8666 | 1.4624 | 0.7469 | 1.2095 | 0.8077 | 1.0703 | 0.6876 | 1.0568 | 0.8271 |
| N-acetylphenylalanine | 0.9061 | 1.0055 | 0.9226 | 1.5016 | 0.6147 | 1.1418 | 1.1008 | 0.8196 | 1.0055 | 0.6970 | 0.9582 | 0.7443 | 1.0318 | 0.8329 |
| naproxen | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| N-methylaspartate | 0.7618 | 1.0508 | 0.5843 | 0.7722 | 1.9494 | 1.6958 | 0.8626 | 0.8618 | 1.6140 | 0.6372 | 0.7722 | 0.6839 | 0.9559 | 1.0934 |
| omega-muricholate | 1.1145 | 0.7527 | 1.0746 | 1.0104 | 0.6420 | 1.0342 | 2.2834 | 0.4233 | 0.8618 | 1.6801 | 1.1693 | 0.3687 | 0.5478 | 0.8881 |
| ortho-hydroxyphenylacetate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| oxaloacetate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| PA(16:0) | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| PA(18:1) | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| pantothenate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| phenylacetate | 0.8557 | 0.9323 | 0.9578 | 1.2765 | 0.7338 | 1.0781 | 0.9307 | 0.9227 | 0.9230 | 0.9501 | 1.0083 | 1.0011 | 0.9889 | 1.0343 |
| phenylalanine | 0.9806 | 1.0055 | 1.0530 | 0.8958 | 0.8872 | 0.8840 | 1.0662 | 1.0021 | 1.0611 | 1.0128 | 1.1021 | 1.0186 | 1.0878 | 1.0834 |
| phenylalanine-13C9 | 1.0184 | 1.0239 | 1.0307 | 0.7459 | 1.0195 | 0.9856 | 1.0188 | 1.0373 | 1.0103 | 1.0130 | 1.0086 | 1.0408 | 0.9885 | 0.9968 |
| phenyllactate | 0.2955 | 1.6975 | 0.9366 | 0.8755 | 0.2895 | 0.2414 | 0.2074 | 4.4929 | 0.5487 | 1.5204 | 0.2848 | 0.6266 | 0.2838 | 1.7022 |
| phthalate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| pregnenolone sulfate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| retinoate | 1.0258 | 0.8813 | 1.2719 | 1.1654 | 0.6920 | 0.6698 | 0.8635 | 1.0331 | 1.0511 | 1.6654 | 0.9466 | 1.6329 | 0.9365 | 0.8237 |
| rosmarinate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| salicylate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| salicylurate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| S-allylcysteine | 0.4131 | 0.6370 | 1.1215 | 1.1196 | 0.6445 | 2.2662 | 0.7643 | 0.9140 | 1.0257 | 0.7951 | 1.3520 | 1.1829 | 0.5688 | 0.3157 |
| serine | 1.0471 | 0.7587 | 1.0047 | 1.0073 | 2.4504 | 0.6756 | 1.2174 | 0.8890 | 1.2069 | 1.0107 | 1.2390 | 0.9832 | 1.3004 | 1.0433 |
| serine-13C3 | 0.5709 | 0.6144 | 0.6171 | 0.5933 | 0.7453 | 0.5007 | 0.6091 | 0.5820 | 0.7246 | 0.5732 | 0.5378 | 0.5993 | 0.6986 | 0.5532 |
| sphingosine-1P (C18) | 1.0608 | 1.1129 | 0.9541 | 1.2059 | 0.4867 | 1.4793 | 1.4944 | 0.9396 | 1.1978 | 1.4272 | 0.8872 | 0.8708 | 0.9675 | 1.0241 |
| succinate | 0.9982 | 1.2246 | 0.9944 | 1.2121 | 0.4961 | 1.5591 | 0.7596 | 0.8598 | 0.8404 | 0.8308 | 0.7224 | 0.8327 | 0.9330 | 1.0494 |
| taurine | 1.1508 | 1.1756 | 1.0667 | 1.1566 | 0.5166 | 1.1950 | 1.1247 | 1.1224 | 1.1303 | 1.1563 | 1.1068 | 1.1474 | 1.1242 | 1.1652 |
| tauro-alpha-muricholate | 2.0337 | 1.0737 | 1.0995 | 1.0545 | 0.1891 | 0.2102 | 2.5039 | 0.5954 | 1.2764 | 0.7430 | 1.6021 | 0.5345 | 0.6996 | 0.5709 |
| tauro-alpha-muricholate + tauro-beta-muricholiate | 1.5854 | 1.6282 | 1.0717 | 1.2253 | 0.0972 | 0.1623 | 1.8168 | 1.1700 | 0.7931 | 1.0854 | 1.1596 | 0.8659 | 0.3822 | 0.9656 |
| tauro-beta-muricholate | 1.4330 | 1.9193 | 1.0585 | 1.2710 | 0.0494 | 0.1358 | 1.4915 | 1.4171 | 0.5676 | 1.2570 | 0.9704 | 1.0210 | 0.2332 | 1.1433 |
| taurochenodeoxycholate | 0.5552 | 0.2818 | 1.0760 | 0.6355 | 0.3251 | 0.0942 | 4.4926 | 1.4301 | 3.3233 | 0.9737 | 0.4633 | 0.8004 | 0.2097 | 0.1395 |
| taurocholate | 1.8386 | 1.6058 | 1.0665 | 1.1028 | 0.0571 | 0.1524 | 2.2700 | 0.8680 | 1.1768 | 0.9229 | 1.6489 | 0.5182 | 0.3966 | 0.5322 |
| taurodeoxycholate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| taurohyocoholate | 1.8401 | 1.6154 | 1.0672 | 1.1135 | 0.0571 | 0.1284 | 2.2710 | 0.8701 | 1.1758 | 0.9240 | 1.6496 | 0.5194 | 0.3961 | 0.5302 |
| taurohyodeoxycholate | 1.2828 | 1.7586 | 1.0726 | 1.1428 | NA | 0.2924 | 1.4912 | 1.3099 | 0.7085 | 0.9820 | 1.0230 | 0.9152 | 0.4188 | 0.6702 |
| taurolithocholate | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA | NA |
| tauroursodeoxycholate | 1.3980 | 1.8909 | 1.0992 | 1.2212 | 0.1083 | 0.2739 | 1.6226 | 1.4093 | 0.7518 | 1.0527 | 1.0223 | 0.9750 | 0.4381 | 0.6693 |
| threonine | 0.6574 | 0.7076 | 0.7060 | 1.2988 | 1.8858 | 0.7003 | 0.7038 | 0.7894 | 0.7465 | 0.7100 | 0.7874 | 0.7529 | 0.8142 | 0.8274 |
| threonine-13C4 | 0.3269 | 0.4348 | 0.3668 | 0.5734 | 0.9281 | 0.4717 | 0.3478 | 0.3294 | 0.3683 | 0.3848 | 0.3851 | 0.3942 | 0.3192 | 0.3902 |
| tryptophan | 0.9808 | 0.9578 | 0.9794 | 1.0127 | 1.1957 | 1.0626 | 1.0584 | 0.9084 | 1.0700 | 0.8729 | 0.9976 | 0.9649 | 0.9995 | 0.9381 |
| tryptophan-15N2 | 0.9826 | 1.0077 | 0.9755 | 0.9041 | 1.0498 | 1.0123 | 0.9852 | 1.0218 | 0.9867 | 0.9743 | 1.0199 | 1.0549 | 0.9621 | 0.9625 |
| tyrosine | 0.9491 | 0.8078 | 0.8486 | 1.1537 | 2.1109 | 0.6275 | 1.1198 | 0.8193 | 1.0242 | 0.9038 | 1.1606 | 0.9173 | 1.0048 | 0.9046 |
| tyrosine-13C9 | 0.8494 | 0.7243 | 0.7285 | 0.8634 | 1.3950 | 0.7037 | 0.9756 | 0.8114 | 0.9048 | 0.8454 | 0.9645 | 0.8966 | 0.7746 | 0.7037 |
| urate | 1.5305 | 0.8529 | 1.1928 | 0.6448 | 0.4504 | 0.7458 | 1.9797 | 0.6685 | 1.7204 | 0.9231 | 1.6062 | 0.7302 | 1.6790 | 1.4205 |
| uridine | 0.5933 | 1.2695 | 0.9738 | 1.6270 | 0.3496 | 2.6761 | 0.4101 | 0.7457 | 0.6171 | 0.5016 | 0.5926 | 0.6057 | 0.6605 | 0.5048 |
| ursodeoxycholate | 1.0936 | 0.8187 | 1.4200 | 1.2181 | 0.8472 | 0.9752 | 1.0001 | 1.0182 | 0.9975 | 1.0202 | 0.7856 | 0.9004 | 0.4728 | 0.9030 |
| valine-13C5 | 0.4518 | 0.4796 | 0.4918 | 0.4022 | 0.5892 | 0.5342 | 0.4466 | 0.4569 | 0.4880 | 0.4209 | 0.4269 | 0.4519 | 0.4467 | 0.4888 |
| xanthosine | 0.7809 | 0.7071 | 1.0106 | 0.6756 | 0.3453 | 2.1523 | 1.5006 | 0.4623 | 1.3759 | 0.6469 | 1.1377 | 0.4498 | 1.1019 | 1.2136 |
Factors:
| F1 | Group:Control | Timepoint:8 weeks of training or control time | Sex:Female | Tissue:Rat Heart Powder |
| F2 | Group:Control | Timepoint:8 weeks of training or control time | Sex:Male | Tissue:Rat Heart Powder |
| F3 | Group:QC-DriftCorrection | Timepoint:0 hour | Sex:- | Tissue:- |
| F4 | Group:QC-Pooled | Timepoint:0 hour | Sex:- | Tissue:- |
| F5 | Group:QC-ReCAS | Timepoint:0 hour | Sex:- | Tissue:- |
| F6 | Group:QC-Reference | Timepoint:0 hour | Sex:- | Tissue:- |
| F7 | Group:Training | Timepoint:1 week of training or control time | Sex:Female | Tissue:Rat Heart Powder |
| F8 | Group:Training | Timepoint:1 week of training or control time | Sex:Male | Tissue:Rat Heart Powder |
| F9 | Group:Training | Timepoint:2 weeks of training | Sex:Female | Tissue:Rat Heart Powder |
| F10 | Group:Training | Timepoint:2 weeks of training | Sex:Male | Tissue:Rat Heart Powder |
| F11 | Group:Training | Timepoint:4 weeks of training | Sex:Female | Tissue:Rat Heart Powder |
| F12 | Group:Training | Timepoint:4 weeks of training | Sex:Male | Tissue:Rat Heart Powder |
| F13 | Group:Training | Timepoint:8 weeks of training or control time | Sex:Female | Tissue:Rat Heart Powder |
| F14 | Group:Training | Timepoint:8 weeks of training or control time | Sex:Male | Tissue:Rat Heart Powder |
