Data for (Study ST000385)
(Analysis AN000620)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 studyMetabolite | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 | F14 | F15 | F16 | F17 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1,5-anhydroglucitol | 0.7332 | 0.6096 | 0.6060 | 0.5117 | 0.6762 | 0.8693 | 0.6242 | 0.7990 | 1.3456 | 1.4036 | 1.3233 | 1.0649 | 1.5336 | 1.9106 | 1.2110 | 1.7484 | 0.6454 |
1-monoolein | 0.8467 | 0.7646 | 0.5243 | 0.7745 | 0.3793 | 0.3834 | 0.5067 | 0.7085 | 2.1321 | 0.7964 | 1.2980 | 2.0471 | 1.0047 | 0.7757 | 1.1571 | 1.5715 | 0.8846 |
1-monopalmitin | 0.6638 | 0.5172 | 0.6058 | 0.5575 | 0.8300 | 0.6437 | 0.7769 | 0.5488 | 1.4350 | 1.4618 | 1.3577 | 1.4337 | 1.6105 | 1.3392 | 1.5173 | 1.3691 | 0.6690 |
1-monostearin | 0.7404 | 0.6924 | 0.7834 | 0.7313 | 0.6054 | 0.8488 | 1.2215 | 0.7978 | 1.1717 | 1.1619 | 1.1413 | 1.1978 | 1.3917 | 1.2914 | 1.4198 | 1.3203 | 0.6386 |
2,3,5-trihydroxypyrazine NIST | 0.8913 | 0.9880 | 0.8761 | 0.7861 | 0.6610 | 0.7965 | 0.7271 | 0.8720 | 1.2414 | 1.3611 | 1.1469 | 1.1799 | 1.2183 | 1.4302 | 1.1018 | 1.3088 | 0.8001 |
2,3-dihydroxybutanoic acid NIST | 0.8150 | 0.6728 | 0.7135 | 0.9285 | 0.8609 | 0.6793 | 0.8270 | 0.5760 | 1.1038 | 1.2143 | 1.0988 | 1.8942 | 1.5020 | 1.0394 | 1.4981 | 1.1076 | 0.6218 |
2-deoxyerythritol | 0.7521 | 0.6429 | 0.8563 | 0.6832 | 0.7625 | 1.3918 | 1.0453 | 0.7596 | 1.0256 | 1.0838 | 1.0872 | 1.0844 | 1.0370 | 2.0834 | 1.4773 | 1.1325 | 0.6851 |
2-deoxytetronic acid NIST | 0.5199 | 0.7327 | 0.7237 | 0.9187 | 0.5008 | 0.7255 | 0.8289 | 0.6582 | 0.8925 | 1.5541 | 1.2352 | 1.8692 | 0.8351 | 1.3674 | 1.3816 | 1.4915 | 0.7218 |
2-hydroxybutanoic acid | 0.5616 | 0.9608 | 0.7555 | 0.7505 | 0.5702 | 0.4412 | 0.8501 | 0.4922 | 1.1910 | 2.1751 | 1.5229 | 1.6534 | 0.8616 | 1.0499 | 1.6377 | 1.1274 | 0.6822 |
2-hydroxyglutaric acid | 0.4406 | 0.4116 | 0.4445 | 0.4114 | 0.3852 | 0.5655 | 0.4653 | 0.3853 | 1.5044 | 1.8879 | 1.4905 | 1.4837 | 1.6238 | 2.2453 | 1.8065 | 2.0384 | 0.2907 |
2-hydroxyhippuric acid | 0.6320 | 0.5433 | 0.6109 | 0.4472 | 1.3272 | 0.5520 | 0.9653 | 0.5007 | 1.0144 | 1.0638 | 0.8951 | 1.0057 | 3.5119 | 1.1528 | 1.0302 | 1.0502 | 1.1461 |
2-hydroxyvaleric acid | 4.1049 | 0.2987 | 0.3744 | 0.3787 | 0.3342 | 0.2803 | 0.3201 | 0.2663 | 7.4652 | 0.6034 | 0.7271 | 0.7011 | 0.4916 | 0.5774 | 0.6419 | 0.6549 | 0.6528 |
2-ketoisocaproic acid | 0.8832 | 1.2593 | 0.9430 | 0.9574 | 0.7812 | 0.8867 | 1.0117 | 0.9675 | 0.9854 | 1.6562 | 0.9269 | 1.1783 | 0.7757 | 1.1073 | 0.9415 | 0.9998 | 1.0486 |
3-aminoisobutyric acid | 0.4522 | 0.4475 | 0.3769 | 2.2332 | 0.5059 | 0.3720 | 0.3771 | 0.4252 | 0.8970 | 1.1763 | 0.9277 | 4.1349 | 0.8162 | 1.0857 | 0.7798 | 0.7184 | 0.7304 |
3-hydroxybutanoic acid | 0.2684 | 1.1510 | 0.7850 | 1.0208 | 0.3101 | 0.5499 | 0.8581 | 0.5397 | 0.5064 | 2.3282 | 1.3950 | 2.1946 | 0.5758 | 1.1685 | 1.6466 | 1.0647 | 0.7314 |
3-phosphoglycerate | 0.5924 | 0.9554 | 0.7020 | 0.7216 | 0.4301 | 1.0806 | 0.7986 | 1.5123 | 0.6048 | 1.4139 | 0.5913 | 1.0405 | 0.6204 | 2.0753 | 1.2048 | 2.2724 | 0.7063 |
4-hydroxyproline | 0.8056 | 0.5970 | 0.7299 | 0.5744 | 0.6993 | 0.6705 | 0.7374 | 0.6662 | 1.6799 | 1.4082 | 1.4237 | 1.3574 | 1.5405 | 1.4078 | 1.2730 | 1.4951 | 0.4540 |
5-hydroxynorvaline NIST | 0.3904 | 0.4854 | 0.6066 | 0.4259 | 0.9235 | 1.0618 | 0.6217 | 0.5019 | 1.0050 | 0.9521 | 1.1848 | 1.1190 | 2.6680 | 2.4663 | 1.2791 | 1.1591 | 0.9438 |
5-methoxytryptamine | 0.7665 | 0.5730 | 0.7277 | 0.9909 | 0.4220 | 0.3318 | 0.4315 | 0.9670 | 1.2366 | 1.5323 | 0.9296 | 1.4029 | 0.8697 | 1.1625 | 1.4582 | 1.4263 | 1.2602 |
acetophenone NIST | 0.7093 | 0.7784 | 0.8743 | 0.7598 | 0.7420 | 0.8592 | 0.8087 | 0.7926 | 1.3314 | 1.1504 | 1.2390 | 1.2309 | 1.4714 | 1.6166 | 1.4169 | 1.2242 | 0.5032 |
aconitic acid | 0.8077 | 0.6431 | 0.7350 | 0.9131 | 0.6444 | 0.9230 | 0.9612 | 0.7870 | 1.2618 | 0.8808 | 1.0231 | 1.3258 | 1.1621 | 1.2936 | 1.3835 | 1.3529 | 0.8269 |
adenosine-5-phosphate | 1.3099 | 1.1252 | 1.7524 | 1.7522 | 1.4128 | 0.5605 | 0.5895 | 1.5101 | 0.6410 | 0.6455 | 0.6344 | 0.6307 | 1.2994 | 0.9986 | 0.5944 | 0.4980 | 0.9106 |
adipic acid | 0.5397 | 0.4877 | 0.4702 | 0.5165 | 0.6387 | 0.7987 | 0.4837 | 0.4565 | 1.3331 | 1.5183 | 1.4705 | 1.2510 | 1.4019 | 1.6587 | 1.5850 | 2.1686 | 0.5905 |
alanine | 0.5757 | 0.5837 | 0.6336 | 0.4925 | 0.6123 | 0.5153 | 0.6245 | 0.6813 | 1.6266 | 1.5643 | 1.5289 | 1.3676 | 1.5449 | 1.2566 | 1.4208 | 1.5487 | 0.6523 |
alpha ketoglutaric acid | 1.4497 | 1.1994 | 1.3190 | 1.2578 | 1.0478 | 0.7058 | 1.1207 | 1.0669 | 0.7257 | 0.4041 | 0.6042 | 0.8901 | 0.5846 | 0.6129 | 0.5730 | 0.5911 | 1.8439 |
aminomalonic acid | 1.0989 | 0.4871 | 0.7155 | 0.6315 | 0.9259 | 0.7554 | 0.8348 | 0.7576 | 1.5625 | 0.9275 | 1.2324 | 0.9886 | 1.6791 | 1.2355 | 1.2751 | 1.1962 | 0.8558 |
arabinose | 0.8544 | 0.6614 | 0.8022 | 0.7483 | 0.6512 | 0.8191 | 0.7547 | 0.6834 | 1.0539 | 1.4734 | 1.5157 | 1.3200 | 1.2300 | 1.6842 | 1.2938 | 1.2990 | 0.5760 |
arabitol | 0.7101 | 0.5036 | 0.6726 | 0.8970 | 0.6522 | 1.0717 | 0.8035 | 0.5619 | 1.3150 | 1.3748 | 1.1508 | 1.8101 | 1.1548 | 1.6088 | 1.0914 | 1.2938 | 0.7159 |
arachidic acid | 1.2168 | 1.1643 | 1.1037 | 1.3214 | 1.2063 | 1.1973 | 1.4482 | 1.0748 | 0.7256 | 0.7635 | 0.7362 | 0.7482 | 0.7202 | 0.6988 | 0.6657 | 0.5902 | 1.3523 |
arachidonic acid | 0.4534 | 0.4141 | 0.5029 | 0.3878 | 0.4940 | 0.4996 | 0.7408 | 0.5766 | 1.5933 | 1.5249 | 1.4444 | 1.4863 | 1.9135 | 1.5411 | 2.1437 | 1.7534 | 0.1150 |
asparagine | 0.4052 | 0.4428 | 0.5135 | 0.4324 | 0.6352 | 0.6669 | 0.5500 | 0.5055 | 1.6803 | 1.5095 | 1.7957 | 1.5601 | 1.7719 | 1.6935 | 1.5301 | 1.3251 | 0.5059 |
aspartic acid | 0.2635 | 0.2824 | 0.2744 | 0.2768 | 0.2015 | 0.1893 | 0.2396 | 0.3404 | 2.7907 | 2.3040 | 3.8634 | 2.0602 | 0.9041 | 0.9236 | 0.8514 | 1.0402 | 0.2647 |
azelaic acid | 0.1804 | 0.1729 | 0.1619 | 0.1796 | 0.1685 | 0.1420 | 0.1602 | 0.1569 | 1.9440 | 1.4515 | 2.3152 | 1.4788 | 1.5767 | 1.3909 | 1.7506 | 3.3963 | 0.1698 |
behenic acid | 0.5785 | 0.9011 | 0.6951 | 0.5469 | 0.9670 | 0.8857 | 0.7119 | 0.6862 | 1.3065 | 1.2080 | 1.2280 | 1.4551 | 1.5586 | 1.5389 | 1.1915 | 1.2472 | 0.7996 |
benzoic acid | 0.6570 | 0.6228 | 0.7016 | 0.6903 | 0.7057 | 0.7969 | 0.7091 | 0.6959 | 1.1934 | 1.1304 | 1.4880 | 1.3573 | 1.2574 | 1.4529 | 1.3449 | 1.3214 | 0.8502 |
benzylalcohol | 0.7167 | 0.7754 | 0.7174 | 0.7216 | 0.7149 | 0.7664 | 0.7046 | 0.7396 | 1.3324 | 1.3915 | 1.1878 | 1.3844 | 1.4178 | 1.4273 | 1.2861 | 1.3497 | 0.7460 |
beta alanine | 0.4635 | 0.6454 | 0.4783 | 0.6932 | 0.4456 | 0.5647 | 0.7088 | 0.6553 | 1.5155 | 1.9064 | 1.3741 | 2.0474 | 0.9258 | 1.3838 | 1.5133 | 1.4328 | 0.5682 |
beta-glycerolphosphate | 0.6830 | 0.5747 | 0.6456 | 0.7486 | 0.5962 | 0.7895 | 0.7294 | 0.6088 | 1.3696 | 1.2555 | 1.2455 | 1.5487 | 1.4108 | 1.7586 | 1.4099 | 1.4363 | 0.5986 |
beta-mannosylglycerate | 0.8858 | 0.6987 | 0.8141 | 0.5569 | 0.6768 | 0.9691 | 0.6227 | 0.9473 | 1.4828 | 1.2446 | 1.0922 | 1.0157 | 1.3071 | 1.5197 | 1.0295 | 1.5918 | 0.8841 |
capric acid | 0.6332 | 0.6642 | 0.7018 | 0.6552 | 0.6767 | 0.7021 | 0.6412 | 0.5992 | 1.2725 | 1.6099 | 1.4558 | 1.3636 | 1.4748 | 1.2706 | 1.3961 | 1.3129 | 0.8085 |
caprylic acid | 0.6988 | 0.7595 | 0.7624 | 0.6769 | 0.8536 | 0.9049 | 0.8142 | 0.8227 | 1.2184 | 1.1977 | 1.2746 | 1.2465 | 1.4677 | 1.4874 | 1.4927 | 1.3988 | 0.4358 |
cholesterol | 0.7425 | 0.8641 | 0.7264 | 0.7432 | 0.8264 | 0.8125 | 0.7582 | 0.7313 | 1.1396 | 1.2621 | 1.1272 | 1.2543 | 1.6261 | 1.3262 | 1.2804 | 1.2664 | 0.8509 |
citric acid | 0.9893 | 0.7590 | 0.9099 | 0.9898 | 0.7896 | 0.9655 | 1.2311 | 0.9749 | 1.0972 | 0.8474 | 0.8998 | 1.1630 | 0.7901 | 1.1217 | 1.1663 | 1.0586 | 0.9994 |
citrulline | 0.5567 | 0.5752 | 0.5341 | 0.5984 | 0.8346 | 0.7764 | 0.7156 | 0.6284 | 1.4832 | 1.2821 | 1.0730 | 1.4364 | 1.8276 | 1.5885 | 1.5088 | 1.3614 | 0.7325 |
conduritol beta epoxide | 0.6231 | 0.4802 | 0.6041 | 0.5863 | 0.5206 | 0.6403 | 1.0720 | 0.4507 | 1.1355 | 1.0003 | 2.7154 | 1.2286 | 0.7374 | 1.3229 | 1.9037 | 0.8127 | 0.6234 |
creatinine | 0.4027 | 0.4334 | 0.4854 | 0.7683 | 0.4716 | 0.4169 | 0.6145 | 0.5513 | 1.4272 | 1.1484 | 1.0971 | 2.4036 | 1.5823 | 1.3822 | 1.7121 | 1.4368 | 0.5956 |
cysteine | 0.4777 | 0.7086 | 0.7390 | 0.6037 | 0.6699 | 0.5133 | 0.7498 | 0.7739 | 1.1749 | 1.8062 | 1.3323 | 1.3898 | 1.7041 | 1.2996 | 1.3773 | 1.3246 | 0.6982 |
cysteine-glycine | 0.7626 | 0.6708 | 0.9184 | 0.8413 | 0.7393 | 0.5775 | 0.7395 | 0.6322 | 1.4133 | 1.3096 | 1.2099 | 1.2908 | 1.5227 | 1.3116 | 1.1944 | 1.1785 | 0.8410 |
cystine | 0.3800 | 0.5838 | 0.5445 | 0.6011 | 0.5590 | 0.5804 | 0.7691 | 0.6980 | 1.2136 | 1.3294 | 1.2765 | 1.5276 | 1.3659 | 1.6409 | 1.8351 | 1.5384 | 0.6576 |
dihydro-3-coumaric acid | 0.4850 | 0.6637 | 0.5586 | 0.5556 | 0.5851 | 0.4915 | 0.6385 | 0.7115 | 1.2697 | 1.7341 | 1.4821 | 1.5260 | 1.5763 | 1.2807 | 1.5463 | 1.4592 | 0.6750 |
erythritol | 0.6128 | 0.9492 | 1.1984 | 0.6987 | 0.4701 | 0.6017 | 0.6140 | 0.5948 | 1.0285 | 1.7883 | 2.0255 | 1.2572 | 0.8806 | 1.1979 | 1.0660 | 1.1306 | 0.8134 |
erythrose | 0.5537 | 0.4769 | 0.4883 | 0.5647 | 0.5591 | 0.7015 | 0.7279 | 0.5255 | 1.2691 | 1.1205 | 1.5387 | 1.6247 | 1.5519 | 1.6457 | 1.7366 | 1.7299 | 0.4049 |
ethanolamine | 0.8346 | 0.7073 | 0.6242 | 0.9530 | 0.4542 | 0.4361 | 0.4783 | 0.6201 | 1.5535 | 1.6152 | 1.1883 | 1.7016 | 0.6718 | 0.7195 | 1.0831 | 1.0677 | 1.6363 |
fructose | 0.3593 | 0.6449 | 0.4911 | 0.4612 | 0.5997 | 0.7062 | 0.7826 | 0.7233 | 0.8983 | 1.6494 | 1.2778 | 1.4703 | 1.8644 | 1.8424 | 1.8733 | 2.0243 | 0.1131 |
fucose | 0.6418 | 0.6737 | 0.6474 | 0.6677 | 0.6767 | 0.7637 | 0.6563 | 0.7268 | 1.2793 | 1.3187 | 1.3841 | 1.4989 | 1.2601 | 1.4687 | 1.3832 | 1.4596 | 0.6968 |
fumaric acid | 0.6185 | 0.7950 | 0.7989 | 0.7013 | 0.5658 | 0.4982 | 0.7054 | 0.6482 | 1.4428 | 1.5152 | 1.5215 | 1.5237 | 1.0269 | 1.3898 | 1.3509 | 1.3957 | 0.6480 |
gamma-tocopherol | 0.7843 | 1.2330 | 0.6663 | 0.9454 | 0.5301 | 0.8571 | 0.5675 | 0.8372 | 1.3025 | 1.9480 | 1.0551 | 1.6139 | 0.9908 | 1.5768 | 0.9291 | 1.3226 | 0.7311 |
gluconic acid | 0.5516 | 0.4537 | 0.6915 | 0.9503 | 0.6704 | 0.6243 | 0.9908 | 0.7543 | 1.1189 | 1.0456 | 1.1309 | 2.0948 | 1.0563 | 1.1935 | 1.2720 | 1.3614 | 0.6873 |
glucose | 0.6462 | 0.7458 | 0.7334 | 0.7214 | 0.7381 | 0.7135 | 0.8011 | 0.8536 | 1.0391 | 1.3577 | 1.1374 | 1.3071 | 1.1711 | 1.3349 | 1.3869 | 1.4384 | 0.8863 |
glucuronic acid | 0.6364 | 0.3707 | 0.4173 | 0.6431 | 0.8072 | 0.7762 | 0.5959 | 0.7871 | 1.2728 | 1.0251 | 0.8409 | 1.7021 | 1.9977 | 2.0615 | 1.2035 | 1.7764 | 0.6347 |
glutamic acid | 0.6710 | 0.7346 | 0.6353 | 0.6308 | 0.3524 | 0.5700 | 0.4974 | 0.6039 | 1.9397 | 2.0726 | 2.3092 | 1.6203 | 0.7389 | 1.2840 | 1.0419 | 1.1095 | 0.5715 |
glutamine | 0.5279 | 0.5975 | 0.5332 | 0.5970 | 0.9420 | 0.9177 | 0.8878 | 0.7568 | 1.3506 | 0.9632 | 0.9599 | 1.2356 | 1.7766 | 1.6136 | 1.6089 | 1.4972 | 0.6655 |
glutaric acid | 0.5306 | 0.4159 | 0.5169 | 0.3827 | 0.6108 | 0.5067 | 0.5079 | 0.4524 | 1.5798 | 1.1490 | 1.5667 | 1.5980 | 1.6139 | 1.8469 | 1.4433 | 1.9637 | 0.5462 |
glyceric acid | 0.7981 | 0.4629 | 0.6759 | 0.5835 | 0.6548 | 0.5896 | 0.8894 | 0.6841 | 1.4184 | 1.1831 | 1.4113 | 1.2613 | 1.5424 | 1.2072 | 1.9508 | 1.4242 | 0.4047 |
glycerol | 0.7963 | 0.6113 | 0.8075 | 0.6238 | 0.7865 | 0.7257 | 1.0894 | 0.5525 | 1.2826 | 1.0888 | 1.3846 | 1.2510 | 1.3295 | 1.4693 | 1.6584 | 1.0080 | 0.6930 |
glycerol-3-galactoside | 1.0793 | 1.0262 | 1.0902 | 1.0666 | 1.1356 | 0.8247 | 1.0732 | 1.0824 | 0.6405 | 0.6098 | 0.6981 | 1.3182 | 0.6991 | 0.9100 | 0.9858 | 1.3158 | 0.9941 |
glycerol-alpha-phosphate | 0.3133 | 0.2285 | 0.3591 | 0.2341 | 0.3142 | 0.3464 | 0.4764 | 0.3236 | 1.8738 | 1.4615 | 1.7833 | 1.5446 | 2.1769 | 1.9581 | 2.3536 | 1.8317 | 0.0700 |
glycine | 0.7282 | 0.4099 | 0.6113 | 0.4834 | 0.6993 | 0.6099 | 0.6441 | 0.6171 | 1.8200 | 1.1065 | 1.5880 | 1.2321 | 1.7456 | 1.4649 | 1.3757 | 1.3563 | 0.7133 |
glycolic acid | 0.8397 | 0.7151 | 0.8051 | 0.7507 | 0.7267 | 0.6989 | 0.8625 | 0.9062 | 1.1981 | 1.2118 | 1.1967 | 1.2798 | 1.2905 | 1.3660 | 1.4394 | 1.3699 | 0.5638 |
heptadecanoic acid NIST | 0.6702 | 0.7576 | 0.8331 | 0.7256 | 0.8305 | 0.7775 | 1.1381 | 0.8332 | 1.0323 | 0.9552 | 1.0795 | 1.2867 | 1.1977 | 1.2300 | 1.2780 | 1.4717 | 0.7784 |
hippuric acid | 1.1730 | 0.7119 | 0.9496 | 0.7596 | 0.5288 | 0.4776 | 0.5230 | 0.5904 | 1.6511 | 1.4378 | 1.6422 | 1.1169 | 1.0521 | 0.9999 | 1.0424 | 1.0518 | 1.1251 |
histidine | 0.6161 | 0.5285 | 0.5725 | 0.6415 | 0.6729 | 0.6189 | 0.7826 | 0.6957 | 1.8412 | 1.1945 | 1.1669 | 1.4729 | 1.1943 | 1.2305 | 1.3263 | 1.4156 | 0.9622 |
hydroxylamine | 0.6387 | 0.6572 | 0.5084 | 0.6609 | 0.5769 | 0.6116 | 0.5952 | 0.6318 | 1.5911 | 1.2266 | 1.3052 | 1.6952 | 1.4419 | 1.3586 | 1.3847 | 1.6711 | 0.6428 |
indole-3-acetate | 0.3937 | 1.6018 | 0.4465 | 0.6538 | 0.5883 | 1.1537 | 0.6287 | 0.6346 | 0.7991 | 3.0577 | 0.8873 | 1.3103 | 1.1267 | 2.4031 | 1.3934 | 1.3414 | 0.6742 |
indole-3-lactate | 0.5552 | 0.6680 | 0.6330 | 0.7916 | 1.0160 | 0.8180 | 0.6399 | 0.6119 | 1.0516 | 1.2428 | 1.0504 | 1.6456 | 2.0666 | 1.7000 | 1.1981 | 1.1624 | 0.7518 |
inosine | 0.3022 | 0.3188 | 0.2754 | 0.2870 | 0.3353 | 0.3304 | 0.3087 | 0.3399 | 0.8127 | 2.8378 | 0.9705 | 1.6215 | 2.9859 | 1.8310 | 2.6581 | 1.7694 | 0.3202 |
inulobiose | 0.5440 | 0.4587 | 0.8853 | 0.7408 | 0.6167 | 0.7214 | 1.9035 | 0.5314 | 0.7844 | 0.9648 | 1.8050 | 1.3652 | 1.0696 | 1.4725 | 0.9066 | 1.0772 | 0.7092 |
isocitric acid | 0.9800 | 0.8296 | 1.0541 | 1.2865 | 0.6885 | 1.0389 | 1.3108 | 1.0273 | 0.9567 | 0.7910 | 0.7729 | 1.1162 | 0.7007 | 1.0394 | 0.9974 | 0.9654 | 1.0626 |
isoleucine | 0.6243 | 0.7780 | 0.7640 | 0.7392 | 0.5563 | 0.6582 | 0.7754 | 0.6793 | 1.2214 | 1.6896 | 1.4116 | 1.4914 | 1.0362 | 1.3441 | 1.3980 | 1.3144 | 0.7218 |
isothreonic acid | 0.5811 | 0.4540 | 0.6326 | 0.6732 | 0.6871 | 0.6304 | 0.9375 | 0.6765 | 1.0697 | 1.0829 | 1.2941 | 1.5303 | 1.6507 | 1.4324 | 1.8714 | 1.4611 | 0.4227 |
kynurenine | 0.6585 | 0.7010 | 0.7240 | 0.7723 | 0.5514 | 0.6661 | 0.7003 | 0.6865 | 1.3123 | 1.4459 | 1.1253 | 1.4698 | 1.2282 | 1.5311 | 1.1309 | 1.7346 | 0.7697 |
lactamide | 0.8603 | 0.6888 | 0.8167 | 0.8852 | 0.6129 | 0.3291 | 0.4727 | 0.4967 | 1.3769 | 1.5696 | 1.6701 | 1.7357 | 1.4977 | 1.1078 | 1.0035 | 1.1668 | 0.7704 |
lactic acid | 0.7951 | 0.6527 | 0.9292 | 0.7862 | 0.5691 | 0.2817 | 0.3745 | 0.5133 | 1.6552 | 1.5726 | 1.7643 | 1.9191 | 1.5253 | 0.9351 | 0.9909 | 1.0693 | 0.6875 |
lauric acid | 0.9165 | 0.7751 | 0.8730 | 0.7209 | 0.6813 | 0.6671 | 0.6397 | 0.5939 | 1.4272 | 1.5058 | 1.4100 | 1.4043 | 1.1754 | 1.2686 | 1.1630 | 1.1119 | 0.8887 |
leucine | 0.5281 | 0.7289 | 0.7622 | 0.6083 | 0.5840 | 0.5766 | 0.7322 | 0.6860 | 1.1964 | 1.8934 | 1.6239 | 1.3764 | 1.1973 | 1.1399 | 1.4988 | 1.3834 | 0.6566 |
levoglucosan | 0.4934 | 0.9791 | 0.6041 | 0.8678 | 0.6542 | 0.5758 | 0.4183 | 1.0562 | 0.8304 | 1.9945 | 1.0437 | 1.7240 | 1.1254 | 1.1707 | 0.8121 | 2.1497 | 0.7356 |
lignoceric acid | 0.9726 | 0.5075 | 0.7465 | 0.8484 | 0.7740 | 1.6768 | 0.5852 | 0.5736 | 1.2251 | 0.8639 | 1.0250 | 1.1389 | 1.8775 | 1.1193 | 1.1517 | 1.0445 | 1.1458 |
linoleic acid | 0.6308 | 0.5603 | 0.7488 | 0.5374 | 0.5853 | 0.5969 | 0.9006 | 0.4993 | 1.3450 | 1.2849 | 1.4994 | 1.3441 | 1.5115 | 1.3800 | 2.0477 | 1.2242 | 0.4897 |
linolenic acid | 0.5311 | 0.3773 | 0.5293 | 0.6600 | 0.5976 | 0.6980 | 1.0111 | 0.4873 | 1.3723 | 1.5216 | 1.0957 | 1.5862 | 1.7172 | 1.7988 | 1.5207 | 1.5855 | 0.4829 |
lysine | 0.5918 | 0.5466 | 0.6268 | 0.6086 | 0.6116 | 0.5436 | 0.7580 | 0.6505 | 1.5160 | 1.3812 | 1.4327 | 1.4310 | 1.3832 | 1.2959 | 1.5755 | 1.4144 | 0.6990 |
malate | 0.6331 | 0.5880 | 0.6878 | 0.6330 | 1.1275 | 0.5228 | 0.7955 | 0.6284 | 1.0704 | 1.1506 | 3.3857 | 1.0925 | 0.6701 | 0.8845 | 0.8481 | 1.0063 | 0.6210 |
maleimide | 0.4134 | 0.1768 | 0.2006 | 0.1821 | 0.2253 | 0.2760 | 0.2396 | 0.1828 | 1.9842 | 2.4029 | 2.0465 | 1.8342 | 1.6656 | 2.1877 | 1.7493 | 2.0524 | 0.1805 |
maltose | 1.1514 | 0.3105 | 0.6413 | 1.3283 | 0.5281 | 0.4180 | 0.6971 | 0.7999 | 1.3900 | 1.0889 | 1.8875 | 2.1167 | 0.5482 | 0.7387 | 0.8142 | 0.9544 | 0.8012 |
maltotriose | 1.2436 | 0.6566 | 0.7012 | 1.4745 | 0.5812 | 0.5198 | 0.6754 | 1.0478 | 1.1353 | 1.0681 | 1.2103 | 1.3396 | 0.8502 | 1.1824 | 0.8229 | 1.0867 | 1.0413 |
mannitol | 0.4951 | 0.3733 | 0.9442 | 0.7229 | 0.4038 | 0.8198 | 1.3016 | 0.5080 | 1.0765 | 0.9516 | 1.6739 | 1.5035 | 0.7676 | 1.5489 | 1.4527 | 1.0692 | 0.8341 |
methanolphosphate | 0.5046 | 0.6196 | 0.7429 | 0.6255 | 0.7309 | 0.8195 | 0.6767 | 0.6658 | 1.2294 | 1.4937 | 1.2147 | 1.4939 | 1.6280 | 1.6677 | 1.5122 | 1.1752 | 0.6965 |
methionine | 0.5046 | 0.6744 | 0.7160 | 0.5520 | 0.6734 | 0.5934 | 0.6465 | 0.7768 | 1.2691 | 1.8222 | 1.5353 | 1.3749 | 1.4091 | 1.2823 | 1.2512 | 1.4268 | 0.7422 |
methionine sulfoxide | 0.5926 | 0.4756 | 0.5625 | 0.5760 | 0.5997 | 0.5851 | 0.7276 | 0.6067 | 1.2588 | 1.3041 | 1.5549 | 1.4520 | 1.5742 | 1.9240 | 1.7300 | 1.4290 | 0.4479 |
methylhexadecanoic acid | 0.7565 | 0.6667 | 0.7881 | 0.6534 | 0.6901 | 0.6489 | 0.8518 | 0.6237 | 1.4020 | 1.2701 | 1.3640 | 1.3944 | 1.4124 | 1.2218 | 1.4325 | 1.2605 | 0.6978 |
myo-inositol | 0.6806 | 0.4349 | 0.7174 | 0.8691 | 0.5127 | 0.7105 | 0.7960 | 0.6045 | 1.3438 | 1.0225 | 1.4998 | 1.8237 | 0.9747 | 1.5106 | 1.4379 | 1.1080 | 0.7412 |
myristic acid | 0.8401 | 0.6441 | 0.8644 | 0.6473 | 0.7985 | 0.7198 | 0.8302 | 0.5292 | 1.3646 | 1.2079 | 1.4106 | 1.2988 | 1.3542 | 1.3922 | 1.3954 | 1.0646 | 0.8108 |
N-acetylglucosamine | 1.7313 | 1.9412 | 1.7279 | 1.8554 | 1.8541 | 1.9454 | 1.7428 | 1.8488 | 0.0060 | 0.0059 | 0.0056 | 0.0073 | 0.0054 | 0.0058 | 0.0058 | 0.0051 | 1.7692 |
N-acetylglutamate | 0.9371 | 0.6907 | 0.8334 | 0.7311 | 0.6857 | 0.6060 | 0.6767 | 0.6070 | 1.5371 | 1.3680 | 1.0962 | 1.3332 | 1.5195 | 1.2303 | 1.2928 | 1.1574 | 0.9297 |
N-acetylglycine NIST | 0.8075 | 0.4991 | 0.7721 | 0.6891 | 0.7671 | 0.7954 | 0.9715 | 0.6357 | 1.3519 | 0.9184 | 1.3864 | 1.1060 | 1.5462 | 1.5402 | 1.4715 | 1.1260 | 0.7379 |
naproxen | 0.0438 | 0.0418 | 0.9132 | 0.0769 | 0.1085 | 1.4699 | 0.4635 | 1.9870 | 0.1029 | 0.0759 | 1.5342 | 0.1357 | 0.0863 | 3.1376 | 0.8853 | 4.2327 | 0.5941 |
nicotinic acid | 2.4194 | 1.1079 | 1.4362 | 1.7568 | 1.6038 | 1.0551 | 1.1864 | 1.2573 | 0.3799 | 0.3958 | 0.3344 | 0.3796 | 0.4067 | 0.3859 | 0.3700 | 0.3887 | 1.5996 |
N-methylalanine | 0.5358 | 0.7068 | 0.7749 | 0.6219 | 0.5290 | 0.5472 | 0.8053 | 0.6473 | 1.3125 | 1.6798 | 1.5081 | 1.4644 | 1.0590 | 1.1497 | 1.6254 | 1.3912 | 0.6685 |
oleic acid | 0.7213 | 0.6366 | 0.8576 | 0.6649 | 0.7475 | 0.5656 | 0.9828 | 0.4007 | 1.2386 | 1.2426 | 1.4279 | 1.3572 | 1.5223 | 1.2493 | 1.9732 | 0.8173 | 0.6952 |
ornithine | 0.7357 | 0.4596 | 0.7078 | 0.5615 | 0.4616 | 0.5079 | 0.5771 | 0.4905 | 2.0579 | 1.3394 | 1.9044 | 1.5113 | 1.1789 | 1.3394 | 1.3589 | 1.2072 | 0.6651 |
oxalic acid | 2.3523 | 1.3170 | 1.5526 | 1.9213 | 1.7711 | 1.3130 | 1.3134 | 1.4471 | 0.1970 | 0.1256 | 0.1659 | 0.1521 | 0.2137 | 0.1554 | 0.2445 | 0.1932 | 1.8155 |
oxoproline | 0.7464 | 0.6617 | 0.7734 | 0.5603 | 0.7946 | 0.6691 | 0.7446 | 0.6474 | 1.4894 | 1.4399 | 1.4078 | 1.2714 | 1.7084 | 1.4278 | 1.4389 | 1.2968 | 0.4964 |
palmitic acid | 0.7541 | 0.6732 | 0.7963 | 0.6366 | 0.6799 | 0.6950 | 0.8458 | 0.5830 | 1.3709 | 1.3226 | 1.4090 | 1.3332 | 1.4133 | 1.3753 | 1.5410 | 1.1440 | 0.6838 |
palmitoleic acid | 1.0359 | 0.6850 | 0.9379 | 0.5684 | 0.9131 | 0.8076 | 0.7893 | 0.2837 | 1.5863 | 1.3712 | 1.3823 | 1.1172 | 1.6594 | 1.7093 | 1.7115 | 0.5420 | 0.7254 |
parabanic acid NIST | 1.2991 | 0.6890 | 0.7846 | 1.1180 | 0.9713 | 0.7619 | 0.8298 | 0.7920 | 1.0044 | 0.9399 | 1.0550 | 1.1416 | 1.0670 | 0.9777 | 1.1236 | 1.0004 | 1.1758 |
paracetamol | 0.7802 | 0.8263 | 1.1563 | 0.3509 | 0.4219 | 1.8777 | 0.2879 | 0.4862 | 1.3007 | 1.7788 | 1.9324 | 0.7485 | 0.7106 | 4.1403 | 0.5924 | 0.9734 | 0.6411 |
pelargonic acid | 0.6506 | 0.6411 | 0.6809 | 0.6798 | 0.6935 | 0.7640 | 0.6533 | 0.6763 | 1.3930 | 1.3904 | 1.2830 | 1.4832 | 1.3680 | 1.3438 | 1.4763 | 1.4148 | 0.6787 |
phenylacetic acid | 0.5467 | 0.4774 | 0.6034 | 0.6377 | 0.8629 | 0.7200 | 0.6603 | 0.6675 | 1.4188 | 1.2255 | 1.2485 | 1.3932 | 1.7656 | 1.3259 | 1.4187 | 1.4524 | 0.7615 |
phenylalanine | 0.6175 | 0.6006 | 0.6616 | 0.6363 | 0.5173 | 0.6479 | 0.7229 | 0.6206 | 1.5344 | 1.4585 | 1.6429 | 1.5704 | 1.0762 | 1.4143 | 1.4413 | 1.3028 | 0.6592 |
phenylethylamine | 0.4274 | 0.6369 | 0.4859 | 0.6170 | 0.4087 | 1.2850 | 0.4495 | 0.7160 | 1.2431 | 1.5780 | 1.2601 | 1.6606 | 1.0247 | 2.9722 | 1.1541 | 1.8644 | 0.4101 |
pimelic acid | 0.7769 | 0.5042 | 0.3602 | 0.4592 | 0.3385 | 0.3060 | 0.3192 | 0.4046 | 2.1637 | 1.8748 | 1.7094 | 1.6310 | 1.1024 | 1.3538 | 1.2842 | 2.2338 | 0.5338 |
pipecolic acid | 0.1662 | 0.8459 | 0.3298 | 0.3014 | 0.3828 | 2.1389 | 0.3784 | 0.6666 | 0.6511 | 3.2512 | 0.9204 | 1.0787 | 0.8494 | 4.7822 | 0.8770 | 1.9721 | 0.5283 |
proline | 0.3945 | 0.6098 | 0.6383 | 0.4825 | 0.4542 | 0.7183 | 0.5778 | 0.7022 | 1.2704 | 1.8359 | 1.6699 | 1.3767 | 1.1272 | 1.7517 | 1.3888 | 1.7563 | 0.6021 |
pseudo uridine | 0.6877 | 0.6236 | 0.6403 | 0.9150 | 0.6994 | 0.8462 | 0.7667 | 0.7213 | 1.2019 | 1.1645 | 1.0560 | 1.7379 | 1.3080 | 1.7060 | 1.2210 | 1.2984 | 0.7143 |
pyrophosphate | 1.9362 | 1.2484 | 1.7944 | 2.1093 | 0.5678 | 0.5178 | 0.7111 | 1.5254 | 0.4636 | 0.4451 | 0.5152 | 0.5850 | 0.5338 | 0.5541 | 0.5234 | 0.6572 | 1.3275 |
pyruvic acid | 2.5025 | 1.3746 | 2.1172 | 1.8724 | 0.6085 | 0.4585 | 0.8145 | 0.9383 | 0.3425 | 0.2425 | 0.2629 | 0.5909 | 0.2000 | 0.1901 | 0.1779 | 0.2406 | 2.3873 |
quinic acid | 0.1935 | 0.3702 | 0.3446 | 0.3271 | 1.2976 | 0.9991 | 0.3707 | 0.2853 | 0.3618 | 0.8846 | 5.4080 | 0.7197 | 1.4172 | 1.8336 | 0.7191 | 0.5565 | 0.4681 |
rhamnose | 0.6600 | 0.7095 | 0.6505 | 0.7990 | 0.4670 | 0.8604 | 0.6090 | 0.7980 | 1.2305 | 1.3901 | 1.2192 | 1.7186 | 0.8671 | 1.8301 | 1.2618 | 1.5554 | 0.6753 |
ribose | 0.6965 | 0.6443 | 0.6478 | 0.5913 | 0.8076 | 0.6375 | 0.8186 | 0.7814 | 1.2620 | 0.9279 | 1.2756 | 1.5086 | 1.2604 | 1.8806 | 1.4225 | 1.4115 | 0.6358 |
saccharic acid | 0.6825 | 0.3794 | 0.5977 | 0.6427 | 0.8662 | 0.5733 | 0.5754 | 0.4723 | 1.1409 | 0.6992 | 3.9881 | 1.1104 | 1.1876 | 0.9635 | 0.8038 | 0.7659 | 0.6517 |
salicylic acid | 0.0510 | 0.0243 | 0.0807 | 0.0465 | 4.3870 | 0.0489 | 0.5025 | 0.0777 | 0.0898 | 0.0522 | 0.1562 | 0.0944 | 10.7606 | 0.0945 | 0.4867 | 0.1477 | 1.5771 |
serine | 0.4737 | 0.5427 | 0.6735 | 0.5098 | 0.5373 | 0.4957 | 0.6479 | 0.5532 | 1.5515 | 1.9588 | 2.0706 | 1.4034 | 1.3450 | 1.1837 | 1.3280 | 1.3132 | 0.6110 |
shikimic acid | 0.1469 | 0.1557 | 0.1250 | 0.2870 | 0.1672 | 0.2747 | 0.1914 | 0.2220 | 2.3044 | 1.7405 | 1.8085 | 1.6971 | 1.8018 | 1.7693 | 1.5880 | 2.8090 | 0.3084 |
stearic acid | 0.8022 | 0.7352 | 0.8066 | 0.6879 | 0.7159 | 0.7194 | 0.8758 | 0.6733 | 1.3144 | 1.3518 | 1.3125 | 1.3315 | 1.3110 | 1.2644 | 1.3594 | 1.1865 | 0.7583 |
succinic acid | 0.7513 | 0.6031 | 0.5596 | 0.5220 | 0.6320 | 0.5541 | 0.5736 | 0.5024 | 1.6535 | 1.3740 | 1.4963 | 1.3076 | 1.7962 | 1.5879 | 1.4713 | 1.5093 | 0.6139 |
sucrose | 0.2392 | 0.2182 | 0.2672 | 0.2530 | 1.9792 | 0.2254 | 0.3042 | 0.3065 | 0.4477 | 0.4881 | 6.6594 | 0.3794 | 1.8275 | 0.4835 | 0.3056 | 0.5564 | 0.5115 |
tagatose | 0.4387 | 0.5334 | 0.3898 | 0.4081 | 0.4302 | 0.5899 | 0.5710 | 0.6231 | 1.0679 | 1.4819 | 1.2104 | 1.7522 | 2.0376 | 1.8363 | 1.8998 | 2.0426 | 0.2813 |
taurine | 0.4639 | 0.3697 | 0.5641 | 0.4464 | 0.1951 | 0.2132 | 0.2916 | 0.4561 | 2.2013 | 1.9236 | 2.3130 | 1.8800 | 1.3540 | 1.5343 | 1.4064 | 1.3370 | 0.3752 |
threitol | 0.7815 | 0.5019 | 0.7062 | 0.7995 | 0.6994 | 0.7867 | 0.8080 | 0.7178 | 1.2926 | 1.0256 | 1.2093 | 1.5807 | 1.2322 | 1.6045 | 1.2275 | 1.3227 | 0.7671 |
threonic acid | 0.5652 | 0.2629 | 0.5327 | 0.3594 | 0.7913 | 0.3552 | 1.0587 | 0.5935 | 1.6721 | 0.6581 | 1.6198 | 1.0380 | 1.9939 | 0.8803 | 2.4356 | 1.4214 | 0.4267 |
threonine | 0.7204 | 0.5746 | 0.7013 | 0.6745 | 0.8276 | 0.5695 | 0.7202 | 0.5519 | 1.4588 | 1.3435 | 1.3790 | 1.4657 | 1.7847 | 1.2161 | 1.4445 | 1.1068 | 0.7240 |
threose | 0.5400 | 0.6255 | 0.6338 | 0.5216 | 0.6214 | 0.5917 | 0.7336 | 0.6409 | 1.3756 | 1.4575 | 1.2412 | 1.5061 | 1.4090 | 1.6807 | 1.6183 | 1.4975 | 0.6542 |
tocopherol alpha | 0.7985 | 0.5395 | 0.8452 | 0.6593 | 0.7794 | 0.5309 | 1.0861 | 0.6503 | 1.3101 | 0.8783 | 1.2060 | 1.1976 | 1.5159 | 1.0248 | 1.8547 | 1.0802 | 0.7802 |
trans-4-hydroxyproline | 1.1211 | 0.6669 | 0.6380 | 0.6745 | 0.5142 | 0.9665 | 0.6431 | 0.8022 | 2.0013 | 0.9721 | 0.9849 | 1.3879 | 0.9503 | 1.8325 | 1.1438 | 1.4409 | 0.7752 |
tryptophan | 0.5746 | 0.6631 | 0.5863 | 0.6063 | 0.6237 | 0.5764 | 0.7467 | 0.6247 | 1.5634 | 1.6311 | 1.2745 | 1.4696 | 1.4317 | 1.4313 | 1.6124 | 1.3751 | 0.6439 |
tyrosine | 0.6566 | 0.7091 | 0.7229 | 0.6679 | 0.5166 | 0.6834 | 0.8424 | 0.6612 | 1.3563 | 1.4013 | 1.3290 | 1.4605 | 1.1889 | 1.4986 | 1.5660 | 1.2764 | 0.6858 |
urea | 0.8569 | 0.7575 | 0.8268 | 0.8576 | 0.6828 | 0.8613 | 0.8394 | 0.8297 | 1.2451 | 1.0461 | 1.1320 | 1.2084 | 0.9094 | 1.5556 | 1.2385 | 1.4743 | 0.7751 |
uric acid | 0.5956 | 0.6007 | 0.6681 | 0.6948 | 0.5662 | 0.7668 | 0.8329 | 0.7660 | 1.2578 | 1.2829 | 1.2026 | 1.4702 | 1.1471 | 1.7018 | 1.5203 | 1.5593 | 0.5983 |
uridine | 0.9039 | 1.0109 | 0.9164 | 1.0066 | 1.0089 | 0.9493 | 1.0292 | 0.9232 | 1.0357 | 1.3573 | 0.8860 | 1.1850 | 0.9713 | 1.3456 | 1.0484 | 0.9589 | 0.8782 |
valine | 0.5423 | 0.7041 | 0.7140 | 0.5992 | 0.6008 | 0.5659 | 0.7116 | 0.6935 | 1.2952 | 1.7761 | 1.4875 | 1.4388 | 1.2751 | 1.2037 | 1.4559 | 1.4724 | 0.6646 |
xanthine | 0.5863 | 0.5381 | 0.5779 | 0.6318 | 0.4948 | 0.5495 | 0.5126 | 0.4783 | 1.7312 | 1.4140 | 1.8983 | 1.5703 | 1.5314 | 1.4829 | 1.3586 | 1.3799 | 0.5428 |
xylitol | 0.7908 | 0.6649 | 0.6062 | 0.5806 | 0.8179 | 0.9949 | 0.4603 | 1.4295 | 1.4695 | 1.2468 | 1.2057 | 0.9761 | 1.7618 | 2.1278 | 0.8488 | 1.2214 | 0.6782 |
xylose | 0.6216 | 0.5555 | 0.5696 | 0.7434 | 0.4845 | 0.6989 | 0.6742 | 0.9608 | 1.2217 | 1.1761 | 1.1916 | 1.6312 | 1.2594 | 1.5483 | 1.2667 | 1.8410 | 0.5925 |
Factors:
F1 | Organ:Plasma | Health State:Adenocarcinoma | Smoking Status:Current | Gender:F |
F2 | Organ:Plasma | Health State:Adenocarcinoma | Smoking Status:Current | Gender:M |
F3 | Organ:Plasma | Health State:Adenocarcinoma | Smoking Status:Former | Gender:F |
F4 | Organ:Plasma | Health State:Adenocarcinoma | Smoking Status:Former | Gender:M |
F5 | Organ:Plasma | Health State:Healthy | Smoking Status:Current | Gender:F |
F6 | Organ:Plasma | Health State:Healthy | Smoking Status:Current | Gender:M |
F7 | Organ:Plasma | Health State:Healthy | Smoking Status:Former | Gender:F |
F8 | Organ:Plasma | Health State:Healthy | Smoking Status:Former | Gender:M |
F9 | Organ:Serum | Health State:Adenocarcinoma | Smoking Status:Current | Gender:F |
F10 | Organ:Serum | Health State:Adenocarcinoma | Smoking Status:Current | Gender:M |
F11 | Organ:Serum | Health State:Adenocarcinoma | Smoking Status:Former | Gender:F |
F12 | Organ:Serum | Health State:Adenocarcinoma | Smoking Status:Former | Gender:M |
F13 | Organ:Serum | Health State:Healthy | Smoking Status:Current | Gender:F |
F14 | Organ:Serum | Health State:Healthy | Smoking Status:Current | Gender:M |
F15 | Organ:Serum | Health State:Healthy | Smoking Status:Former | Gender:F |
F16 | Organ:Serum | Health State:Healthy | Smoking Status:Former | Gender:M |
F17 | Organ:Serum or Plasma | Health State:NA | Smoking Status:NA | Gender:NA |