Clustering data with hclust algorithm for (Study ST002634)
(Analysis AN004306)| Metabolite | Structure | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| agmatine | ME624348 | 0.10 | 0.11 | 1.05 | 1.02 | 0.59 | 9.78 | 0.08 | 0.11 | 0.09 | 0.07 | 0.10 | 0.09 | 0.06 |
| kynurenate | ME624416 | 1.25 | 0.57 | 0.58 | 0.58 | 0.33 | 0.39 | 0.31 | 0.42 | NA | 0.79 | 0.48 | 2.94 | 4.83 |
| histamine | ME624408 | 0.72 | 0.62 | 1.08 | 1.07 | 0.69 | 0.73 | 0.68 | 0.82 | 0.78 | 3.87 | 0.88 | 0.61 | 0.67 |
| N-nitroso-pyrrolidine | ME624448 | 1.40 | 1.74 | 1.22 | 1.28 | 0.19 | 0.31 | 2.56 | 0.85 | 0.85 | 0.87 | 0.38 | 1.77 | 0.17 |
| 21-deoxycortisol | ME624333 | 0.58 | 0.44 | 0.70 | 0.73 | 2.33 | 0.76 | 1.34 | 0.77 | 1.04 | 0.80 | 1.38 | 0.24 | 0.98 |
| urocanate | ME624475 | 1.01 | 0.48 | 0.83 | 0.82 | 2.17 | 0.67 | 1.31 | 0.96 | 0.91 | 1.08 | 0.73 | 0.78 | 0.49 |
| methylguanidine | ME624422 | 1.00 | 0.58 | 1.07 | 1.02 | 0.70 | 1.15 | 1.11 | 1.28 | 0.53 | 1.45 | 0.54 | 1.11 | 1.59 |
| 5-methylcytosine | ME624342 | 1.40 | 0.61 | 1.14 | 1.12 | 0.41 | 1.63 | 0.63 | 1.45 | 0.60 | 1.37 | 0.79 | 1.46 | 0.80 |
| N1-methyl-2-pyridone-5-carboxamide | ME624426 | 1.71 | 0.69 | 1.33 | 1.23 | 0.93 | 0.90 | 0.36 | 1.06 | 0.27 | 1.27 | 0.93 | 1.20 | 1.13 |
| cyclohexylamine | ME624395 | 0.77 | 1.18 | 1.09 | 1.08 | 0.74 | 0.80 | 1.15 | 0.91 | 1.59 | 0.79 | 0.55 | 1.80 | 0.73 |
| cystine | ME624397 | 1.40 | 1.64 | 0.85 | 0.91 | 1.30 | 0.57 | 0.61 | 0.59 | 0.64 | 1.07 | 0.59 | 0.89 | 1.71 |
| N-acetylmethionine | ME624438 | 1.36 | 1.50 | 1.05 | 1.06 | 0.64 | 0.73 | 0.91 | 0.77 | 0.63 | 1.53 | 0.71 | 1.33 | 1.04 |
| xanthine | ME624477 | 1.48 | 1.53 | 1.01 | 1.04 | 1.06 | 0.60 | 0.86 | 0.69 | 0.64 | 1.15 | 0.63 | 1.18 | 1.11 |
| N-acetylleucine | ME624437 | 0.85 | 1.13 | 1.00 | 1.01 | 1.17 | 1.08 | 1.18 | 1.64 | 0.92 | 0.62 | 0.57 | 0.85 | 0.89 |
| oleoyl glycine | ME624449 | 1.21 | 0.96 | 0.77 | 0.76 | 1.19 | 1.05 | 1.78 | 1.93 | 0.67 | 0.51 | 0.56 | 0.76 | 0.65 |
| 3-methoxytyramine | ME624337 | 1.47 | 0.62 | 0.73 | 1.19 | 1.09 | 0.75 | 0.70 | 0.82 | 0.96 | 1.66 | 1.08 | 1.16 | 0.66 |
| acisoga | ME624345 | 0.88 | 0.83 | 0.95 | 0.95 | 1.74 | 1.56 | 0.79 | 1.23 | 0.83 | 0.81 | 0.73 | 0.74 | 0.49 |
| ectoine | ME624399 | 0.79 | 0.70 | 1.01 | 1.02 | 1.07 | 1.99 | 0.79 | 1.84 | 0.79 | 0.81 | 0.73 | 0.78 | 0.66 |
| N-lauroylglycine | ME624446 | 0.83 | 0.85 | 1.10 | 1.01 | 0.83 | 1.66 | 0.88 | 0.97 | 1.07 | 1.18 | 1.12 | 0.81 | 0.84 |
| ala-ala | ME624349 | 1.07 | 0.67 | 1.00 | 1.01 | 1.16 | 1.41 | 0.78 | 1.16 | 0.97 | 0.73 | 1.28 | 1.06 | 0.61 |
| cAMP | ME624533 | 1.00 | 0.69 | 1.06 | 1.07 | 0.87 | 1.76 | 0.72 | 1.53 | 1.17 | 0.91 | 1.11 | 0.68 | 0.52 |
| N-acetyltryptophan | ME624442 | 1.08 | 0.72 | 0.97 | 0.97 | 1.14 | 1.58 | 0.66 | 1.58 | 0.87 | 0.94 | 1.04 | 0.81 | 0.54 |
| arachidoyl ethanolamide | ME624355 | 0.87 | 0.60 | 0.82 | 0.86 | 1.22 | 1.68 | 0.80 | 0.84 | 1.42 | 1.04 | 1.34 | 0.40 | 0.89 |
| methyl N-methylanthranilate | ME624421 | 0.78 | 0.93 | 0.88 | 0.93 | 1.36 | 1.12 | 0.58 | 1.11 | 0.98 | 1.20 | 1.42 | 0.46 | 1.00 |
| C16:0 Ceramide (d18:1) | ME624530 | 0.70 | 0.72 | 0.89 | 1.03 | 1.40 | 1.29 | 0.94 | 1.23 | 1.36 | 0.67 | 0.59 | 0.59 | 1.33 |
| biliverdin | ME624362 | 0.66 | 1.08 | 0.97 | 1.02 | 1.36 | 1.00 | 0.71 | 1.12 | 1.17 | 0.78 | 1.04 | 0.59 | 1.31 |
| C18:2 carnitine | ME624386 | 0.77 | 1.21 | 0.90 | 1.22 | 1.46 | 0.91 | 0.93 | 0.79 | 1.25 | 0.56 | 0.89 | 0.48 | 1.37 |
| homoarginine | ME624410 | 1.16 | 0.79 | 1.08 | 1.06 | 0.71 | 1.44 | 0.83 | 1.58 | 0.88 | 0.95 | 0.89 | 0.91 | 0.91 |
| hypotaurine | ME624412 | 1.31 | 0.84 | 1.08 | 1.07 | 0.67 | 1.26 | 0.80 | 1.42 | 0.89 | 1.09 | 0.85 | 1.08 | 0.88 |
| N4-acetylcytidine | ME624428 | 1.28 | 0.70 | 1.10 | 1.12 | 0.60 | 1.38 | 0.81 | 1.41 | 0.75 | 1.20 | 0.87 | 1.26 | 0.80 |
| 1-methylhistamine | ME624331 | 1.08 | 0.80 | 1.02 | 1.04 | 0.96 | 0.98 | 0.80 | 1.29 | 0.98 | 1.51 | 0.88 | 0.82 | 0.87 |
| beta-guanidinopropionate | ME624360 | 1.10 | 1.02 | 1.09 | 1.06 | 0.70 | 1.15 | 0.79 | 1.16 | 0.85 | 1.35 | 0.91 | 1.01 | 1.04 |
| trigonelline | ME624470 | 1.19 | 0.92 | 1.05 | 1.05 | 0.85 | 1.14 | 0.85 | 1.09 | 0.88 | 1.35 | 0.82 | 1.09 | 0.82 |
| imidazole propionate | ME624413 | 1.08 | 1.20 | 1.09 | 1.08 | 0.82 | 0.80 | 1.08 | 0.71 | 1.18 | 1.03 | 1.50 | 0.67 | 0.91 |
| 3-methylhistidine | ME624338 | 0.65 | 1.28 | 1.00 | 1.01 | 1.13 | 0.84 | 1.20 | 0.80 | 1.33 | 0.63 | 1.37 | 0.57 | 1.14 |
| anserine | ME624354 | 0.75 | 1.03 | 1.02 | 1.02 | 1.15 | 0.91 | 1.05 | 0.85 | 1.31 | 0.77 | 1.36 | 0.66 | 1.03 |
| C18:2 LPC | ME624483 | 0.94 | 0.85 | 0.94 | 0.93 | 1.66 | 0.86 | 0.76 | 0.84 | 0.98 | 0.85 | 1.07 | 0.96 | 0.92 |
| C5 carnitine | ME624371 | 0.92 | 0.95 | 0.95 | 0.93 | 1.64 | 0.80 | 1.02 | 0.88 | 1.02 | 0.80 | 0.98 | 0.74 | 0.96 |
| 2^-O-methyladenosine | ME624336 | 1.17 | 1.18 | 0.90 | 0.93 | 1.78 | 0.72 | 0.73 | 0.74 | 0.64 | 1.01 | 0.73 | 0.98 | 0.98 |
| cysteine | ME624396 | 1.26 | 1.14 | 0.92 | 0.92 | 1.45 | 0.76 | 0.76 | 0.89 | 0.82 | 0.90 | 0.79 | 1.01 | 1.07 |
| 2^-deoxyadenosine | ME624334 | 1.13 | 1.16 | 0.97 | 0.97 | 1.53 | 0.81 | 0.89 | 0.87 | 0.78 | 0.96 | 0.79 | 0.90 | 0.91 |
| C24:0 LPC | ME624490 | 1.27 | 1.06 | 0.93 | 0.95 | 1.47 | 0.91 | 0.92 | 0.83 | 0.81 | 0.93 | 0.72 | 0.99 | 0.90 |
| C18:1 LPC plasmalogen A | ME624491 | 1.16 | 1.06 | 0.97 | 0.95 | 1.38 | 0.82 | 1.02 | 0.71 | 0.96 | 0.94 | 0.83 | 0.93 | 1.02 |
| C18:1 LPC plasmalogen B | ME624492 | 1.30 | 1.08 | 0.98 | 0.94 | 1.51 | 0.86 | 0.94 | 0.62 | 0.91 | 0.84 | 0.83 | 0.71 | 1.14 |
| C20:1 LPC | ME624487 | 1.37 | 1.18 | 0.93 | 0.97 | 1.02 | 0.76 | 0.91 | 0.61 | 0.85 | 1.22 | 0.91 | 1.23 | 1.02 |
| C34:3 PC plasmalogen | ME624503 | 1.15 | 1.06 | 1.00 | 0.99 | 0.99 | 0.93 | 0.83 | 0.85 | 0.85 | 1.07 | 0.98 | 1.24 | 1.04 |
| C16 carnitine | ME624381 | 1.14 | 1.19 | 1.02 | 1.02 | 0.74 | 0.86 | 1.03 | 0.75 | 0.99 | 1.01 | 0.94 | 1.08 | 1.39 |
| trimethylamine-N-oxide | ME624471 | 1.30 | 1.19 | 1.10 | 1.12 | 0.67 | 0.69 | 0.94 | 0.59 | 0.86 | 1.16 | 1.24 | 1.19 | 1.21 |
| linoleoyl ethanolamide | ME624418 | 0.94 | 0.81 | 0.89 | 0.91 | 1.28 | 1.34 | 0.80 | 1.02 | 1.03 | 0.93 | 1.07 | 0.73 | 1.04 |
| 1-methylnicotinamide | ME624332 | 1.11 | 1.00 | 1.07 | 1.05 | 0.76 | 1.29 | 0.98 | 1.34 | 1.05 | 0.89 | 0.93 | 0.80 | 0.90 |
| cadaverine | ME624389 | 1.14 | 0.90 | 1.05 | 1.07 | 0.80 | 1.43 | 0.94 | 1.27 | 0.95 | 0.98 | 0.81 | 0.91 | 0.88 |
| citrulline | ME624392 | 1.14 | 1.03 | 1.04 | 1.12 | 0.71 | 1.31 | 0.98 | 1.18 | 0.93 | 1.05 | 0.78 | 1.00 | 0.91 |
| acetylcholine | ME624344 | 0.84 | 0.85 | 1.08 | 1.07 | 0.71 | 1.39 | 1.15 | 1.42 | 1.22 | 0.84 | 1.04 | 0.80 | 0.80 |
| N-acetylhistidine | ME624436 | 0.95 | 0.93 | 1.09 | 1.10 | 0.92 | 1.28 | 1.01 | 1.14 | 1.05 | 0.91 | 1.04 | 0.82 | 0.84 |
| serotonin | ME624465 | 0.90 | 0.89 | 1.05 | 1.06 | 0.86 | 1.42 | 0.97 | 1.15 | 1.16 | 0.92 | 1.17 | 0.79 | 0.76 |
| C20:0 SM | ME624526 | 0.89 | 0.86 | 1.01 | 1.05 | 0.96 | 1.20 | 0.98 | 1.18 | 1.25 | 0.91 | 0.88 | 0.93 | 0.93 |
| phytosphingosine | ME624528 | 0.86 | 0.94 | 1.08 | 1.11 | 0.80 | 1.22 | 1.12 | 1.13 | 1.19 | 0.86 | 1.04 | 0.94 | 0.87 |
| pro-gly | ME624456 | 1.01 | 1.15 | 0.97 | 0.80 | 1.28 | 0.91 | 0.93 | 0.99 | 0.91 | 1.09 | 1.17 | 0.77 | 0.82 |
| methylimidazoleacetate | ME624423 | 0.78 | 1.11 | 0.99 | 0.96 | 1.14 | 0.87 | 1.07 | 0.98 | 1.09 | 1.04 | 1.11 | 0.66 | 1.11 |
| C10 carnitine | ME624375 | 1.05 | 1.13 | 1.03 | 0.99 | 1.11 | 0.88 | 1.10 | 0.82 | 1.13 | 0.87 | 1.09 | 0.79 | 0.96 |
| C3-DC carnitine | ME624367 | 1.01 | 1.21 | 1.02 | 1.02 | 0.97 | 0.90 | 1.09 | 0.86 | 1.13 | 0.96 | 1.15 | 0.78 | 0.93 |
| carnitine | ME624364 | 0.91 | 1.10 | 1.03 | 1.03 | 1.02 | 0.86 | 1.11 | 0.86 | 1.13 | 0.99 | 1.15 | 0.78 | 1.02 |
| methionine | ME624420 | 0.85 | 1.05 | 1.02 | 1.03 | 1.11 | 0.95 | 1.00 | 1.09 | 1.08 | 0.88 | 1.04 | 0.82 | 1.02 |
| N-acetylornithine | ME624439 | 0.79 | 1.06 | 1.02 | 1.02 | 0.98 | 1.03 | 1.07 | 0.94 | 1.11 | 0.94 | 1.12 | 0.88 | 1.07 |
| pantothenate | ME624451 | 0.80 | 1.12 | 1.01 | 1.01 | 0.99 | 0.87 | 1.07 | 0.98 | 1.19 | 0.96 | 1.32 | 0.71 | 0.97 |
| C3 carnitine | ME624366 | 0.75 | 1.08 | 1.02 | 1.02 | 1.03 | 0.88 | 1.20 | 0.94 | 1.21 | 0.73 | 1.21 | 0.81 | 1.12 |
| C2 carnitine | ME624365 | 0.86 | 1.06 | 1.03 | 1.03 | 1.06 | 0.95 | 1.09 | 0.94 | 1.19 | 0.84 | 1.14 | 0.74 | 1.05 |
| hydroxyproline | ME624411 | 0.84 | 1.17 | 1.03 | 1.01 | 1.01 | 0.95 | 1.05 | 0.92 | 1.10 | 0.80 | 1.26 | 0.78 | 1.06 |
| C3-DC-CH3 carnitine | ME624368 | 0.78 | 1.22 | 1.03 | 1.04 | 1.25 | 1.02 | 1.03 | 0.94 | 1.16 | 0.80 | 1.07 | 0.60 | 0.93 |
| C8 carnitine | ME624374 | 0.96 | 1.05 | 1.01 | 0.97 | 1.15 | 0.99 | 1.04 | 0.89 | 1.27 | 0.80 | 1.23 | 0.70 | 0.82 |
| C4 carnitine | ME624369 | 0.84 | 0.92 | 0.99 | 0.98 | 1.34 | 0.97 | 1.07 | 0.96 | 1.13 | 0.82 | 1.14 | 0.73 | 0.88 |
| C6 carnitine | ME624373 | 0.91 | 0.98 | 0.97 | 0.94 | 1.23 | 0.93 | 1.21 | 0.81 | 1.16 | 0.85 | 1.10 | 0.85 | 0.92 |
| inosine | ME624414 | 1.13 | 1.35 | 1.05 | 1.00 | 1.00 | 0.76 | 0.95 | 0.80 | 0.87 | 1.11 | 0.82 | 1.01 | 1.16 |
| niacinamide | ME624445 | 1.14 | 1.13 | 1.04 | 1.05 | 0.97 | 0.79 | 0.93 | 0.87 | 0.80 | 1.25 | 0.92 | 1.00 | 1.14 |
| C20:4 LPC | ME624486 | 1.01 | 1.40 | 0.99 | 1.00 | 1.00 | 0.97 | 1.08 | 0.92 | 0.93 | 0.83 | 0.83 | 1.06 | 0.98 |
| C22:6 LPC | ME624488 | 0.98 | 1.37 | 1.01 | 1.01 | 1.03 | 0.98 | 1.02 | 0.95 | 0.91 | 0.89 | 0.88 | 0.94 | 0.99 |
| choline | ME624391 | 1.23 | 1.23 | 1.01 | 1.00 | 1.18 | 0.83 | 0.88 | 0.83 | 0.83 | 1.05 | 0.83 | 0.94 | 1.06 |
| guanosine | ME624406 | 1.10 | 1.28 | 1.01 | 1.03 | 1.16 | 0.86 | 0.94 | 0.90 | 0.91 | 0.85 | 0.81 | 0.94 | 1.12 |
| S-adenosylhomocysteine | ME624461 | 1.04 | 1.27 | 1.02 | 1.03 | 1.14 | 0.89 | 0.98 | 0.95 | 0.87 | 0.99 | 0.85 | 0.90 | 1.01 |
| C12:1 carnitine | ME624377 | 1.15 | 1.17 | 1.07 | 1.06 | 0.90 | 1.13 | 1.14 | 0.88 | 1.04 | 0.89 | 0.91 | 0.83 | 0.92 |
| C14:1 carnitine | ME624379 | 1.21 | 1.17 | 1.04 | 1.04 | 0.95 | 1.02 | 1.11 | 0.85 | 1.00 | 1.00 | 0.85 | 0.87 | 0.92 |
| C12 carnitine | ME624376 | 1.14 | 1.21 | 1.04 | 1.04 | 0.95 | 0.98 | 1.08 | 0.88 | 1.00 | 0.96 | 0.90 | 0.89 | 0.99 |
| C14 carnitine | ME624378 | 1.12 | 1.16 | 1.03 | 1.03 | 0.96 | 0.97 | 1.04 | 0.84 | 0.97 | 1.04 | 0.93 | 0.92 | 1.02 |
| C18:1 carnitine | ME624384 | 1.08 | 1.10 | 1.02 | 1.02 | 0.95 | 0.91 | 1.00 | 0.89 | 0.97 | 1.02 | 0.89 | 0.94 | 1.24 |
| C34:3 PE plasmalogen | ME624515 | 1.06 | 1.08 | 1.02 | 1.00 | 1.01 | 0.99 | 1.04 | 0.89 | 0.99 | 0.98 | 0.87 | 0.99 | 1.09 |
| adenosine | ME624346 | 1.12 | 1.17 | 1.04 | 1.03 | 1.07 | 0.87 | 0.97 | 0.93 | 0.87 | 0.96 | 0.87 | 1.02 | 1.06 |
| C36:3 PE plasmalogen | ME624505 | 1.14 | 1.12 | 1.00 | 0.99 | 1.05 | 0.91 | 1.01 | 0.81 | 0.94 | 1.03 | 0.83 | 1.04 | 1.12 |
| C18:1 LPC | ME624484 | 1.14 | 1.10 | 1.01 | 1.01 | 1.06 | 0.91 | 0.97 | 0.85 | 0.91 | 1.04 | 0.91 | 1.00 | 1.06 |
| C20:0 LPE | ME624498 | 1.20 | 1.10 | 1.00 | 0.97 | 1.06 | 0.96 | 0.96 | 0.82 | 0.94 | 0.97 | 0.93 | 0.98 | 1.05 |
| C16:1 LPC | ME624480 | 1.15 | 1.10 | 1.04 | 1.03 | 1.08 | 0.93 | 0.88 | 0.90 | 0.83 | 1.04 | 0.95 | 1.03 | 0.98 |
| C18:0 LPC | ME624485 | 1.19 | 1.09 | 1.00 | 1.00 | 0.97 | 0.98 | 0.95 | 0.93 | 0.95 | 1.05 | 0.93 | 1.04 | 0.94 |
| pantothenol | ME624452 | 1.00 | 0.87 | 1.12 | 1.07 | 0.81 | 1.01 | 1.15 | 1.12 | 1.13 | 1.12 | 0.99 | 0.89 | 0.87 |
| 2^-deoxycytidine | ME624335 | 0.93 | 1.14 | 1.06 | 1.06 | 0.76 | 1.04 | 1.12 | 1.01 | 1.15 | 0.86 | 1.12 | 0.89 | 1.03 |
| N-acetylalanine | ME624433 | 0.87 | 1.02 | 1.05 | 1.06 | 0.75 | 1.10 | 1.17 | 1.08 | 1.12 | 0.98 | 1.04 | 0.91 | 1.01 |
| N-carbamoyl-beta-alanine | ME624444 | 1.01 | 1.24 | 1.06 | 1.09 | 0.80 | 1.02 | 1.00 | 1.18 | 1.08 | 0.91 | 0.98 | 0.76 | 1.02 |
| NMMA | ME624447 | 1.04 | 1.28 | 1.08 | 1.06 | 0.81 | 0.98 | 0.98 | 0.99 | 0.98 | 1.04 | 0.97 | 0.89 | 1.05 |
| C16:0 SM | ME624523 | 0.87 | 0.87 | 1.05 | 1.07 | 1.15 | 1.17 | 0.93 | 1.33 | 1.04 | 0.85 | 0.92 | 0.81 | 0.87 |
| C18:0 SM | ME624525 | 0.84 | 0.78 | 1.06 | 1.07 | 1.06 | 1.16 | 0.98 | 1.38 | 1.09 | 0.87 | 0.96 | 0.90 | 0.86 |
| N-acetylphenylalanine | ME624440 | 0.90 | 0.89 | 0.98 | 0.98 | 1.11 | 1.13 | 1.02 | 1.09 | 1.01 | 0.96 | 1.17 | 0.77 | 0.90 |
| N6,N6-dimethyllysine | ME624430 | 0.92 | 0.96 | 1.01 | 1.00 | 1.16 | 1.12 | 0.97 | 1.16 | 1.05 | 0.85 | 1.04 | 0.82 | 0.86 |
| C18:0 LPE | ME624496 | 0.93 | 0.89 | 1.03 | 1.03 | 1.14 | 1.09 | 0.97 | 1.19 | 1.01 | 0.96 | 0.98 | 0.89 | 0.82 |
| C18:1 SM | ME624524 | 0.93 | 0.85 | 1.02 | 1.03 | 1.16 | 1.09 | 0.95 | 1.22 | 0.98 | 0.91 | 1.02 | 0.90 | 0.85 |
| C18:1-OH carnitine | ME624385 | 1.06 | 1.15 | 1.00 | 1.03 | 1.20 | 1.01 | 0.97 | 1.12 | 1.05 | 0.81 | 0.80 | 0.77 | 0.93 |
| C20:4 carnitine | ME624388 | 1.12 | 1.18 | 1.00 | 0.97 | 1.15 | 0.95 | 0.98 | 1.02 | 1.06 | 0.87 | 0.88 | 0.80 | 0.91 |
| C14:2 carnitine | ME624380 | 1.12 | 1.10 | 1.05 | 1.00 | 1.08 | 1.05 | 1.08 | 0.89 | 1.11 | 0.84 | 1.00 | 0.74 | 0.89 |
| ADMA | ME624347 | 1.00 | 1.13 | 1.02 | 1.03 | 1.03 | 1.08 | 0.99 | 1.04 | 1.04 | 0.89 | 1.01 | 0.84 | 0.88 |
| C16-OH carnitine | ME624382 | 1.06 | 1.04 | 1.02 | 1.03 | 1.04 | 1.09 | 1.01 | 0.98 | 1.17 | 0.86 | 0.93 | 0.83 | 0.92 |
| allantoin | ME624351 | 0.89 | 0.92 | 1.00 | 1.05 | 1.24 | 1.08 | 0.98 | 1.00 | 1.06 | 0.84 | 0.99 | 0.84 | 0.97 |
| guanidinoacetate | ME624405 | 0.90 | 1.08 | 0.99 | 1.01 | 1.20 | 1.13 | 1.02 | 0.96 | 1.02 | 0.93 | 0.88 | 0.85 | 0.92 |
| C4-OH carnitine | ME624370 | 0.91 | 1.18 | 0.98 | 0.99 | 1.28 | 0.89 | 1.00 | 0.90 | 1.03 | 0.84 | 1.01 | 0.79 | 1.01 |
| C5:1 carnitine | ME624372 | 0.97 | 1.08 | 1.02 | 1.01 | 1.29 | 0.90 | 1.04 | 1.02 | 1.04 | 0.91 | 1.00 | 0.71 | 0.84 |
| proline-betaine | ME624458 | 0.98 | 1.00 | 1.07 | 1.06 | 0.82 | 1.26 | 0.88 | 1.06 | 1.02 | 1.06 | 1.00 | 1.03 | 0.89 |
| S-methyl-L-cysteine-S-oxide | ME624466 | 0.92 | 1.01 | 1.01 | 1.10 | 0.95 | 1.13 | 0.87 | 1.09 | 0.98 | 0.96 | 0.96 | 1.08 | 1.00 |
| 4-guanidinobutanoate | ME624340 | 1.08 | 1.11 | 1.02 | 1.01 | 0.75 | 1.05 | 0.97 | 1.03 | 0.99 | 1.06 | 1.11 | 1.04 | 0.94 |
| lysine | ME624419 | 1.06 | 1.05 | 1.07 | 1.07 | 0.73 | 1.14 | 0.94 | 1.20 | 1.01 | 1.08 | 0.98 | 0.89 | 0.95 |
| C16:1 SM | ME624522 | 1.14 | 0.94 | 1.02 | 1.03 | 0.98 | 1.17 | 0.89 | 1.15 | 1.06 | 0.94 | 1.00 | 0.91 | 0.78 |
| thiamine | ME624468 | 1.02 | 1.10 | 0.99 | 1.01 | 1.12 | 0.96 | 0.88 | 0.99 | 0.95 | 1.12 | 1.01 | 0.83 | 0.94 |
| GABA | ME624400 | 1.01 | 1.08 | 1.00 | 1.01 | 0.93 | 0.96 | 1.01 | 0.97 | 1.00 | 1.16 | 1.02 | 0.98 | 0.92 |
| N-alpha-acetylarginine | ME624443 | 1.04 | 1.04 | 1.01 | 1.02 | 1.03 | 1.04 | 0.97 | 1.00 | 0.99 | 1.15 | 0.96 | 0.87 | 0.88 |
| ornithine | ME624450 | 0.97 | 1.02 | 1.06 | 1.03 | 0.89 | 1.06 | 0.99 | 1.04 | 1.05 | 1.18 | 0.99 | 0.88 | 0.92 |
| N-acetylputrescine | ME624441 | 0.94 | 1.03 | 1.01 | 1.06 | 0.97 | 1.04 | 1.18 | 1.02 | 0.97 | 0.96 | 0.90 | 0.98 | 0.97 |
| glutamate | ME624401 | 1.01 | 0.99 | 0.97 | 0.97 | 1.00 | 0.97 | 1.03 | 0.96 | 1.02 | 0.98 | 1.01 | 1.07 | 1.01 |
| C18:3 LPC | ME624482 | 1.03 | 1.10 | 1.00 | 1.01 | 1.01 | 0.98 | 1.02 | 0.93 | 0.97 | 1.02 | 0.98 | 0.98 | 0.96 |
| C16:0 LPC | ME624481 | 1.04 | 1.07 | 1.02 | 1.02 | 1.01 | 1.01 | 1.01 | 0.99 | 0.98 | 0.99 | 0.97 | 0.95 | 0.93 |
| C38:6 PC plasmalogen | ME624507 | 1.09 | 1.03 | 0.99 | 1.00 | 1.02 | 1.00 | 0.99 | 0.99 | 1.00 | 1.00 | 0.97 | 0.96 | 0.96 |
| arginine | ME624356 | 0.98 | 1.09 | 1.03 | 1.03 | 1.07 | 0.97 | 0.92 | 0.99 | 1.01 | 0.98 | 0.98 | 0.91 | 1.01 |
| C38:6 PE plasmalogen | ME624519 | 1.02 | 1.04 | 1.00 | 1.01 | 1.05 | 0.97 | 1.00 | 0.95 | 0.98 | 0.94 | 0.96 | 0.97 | 1.06 |
| phenylalanine-d8 | ME624328 | 1.00 | 1.03 | 1.03 | 1.02 | 0.98 | 1.01 | 1.00 | 0.94 | 1.00 | 0.98 | 0.97 | 0.99 | 1.06 |
| threonine | ME624469 | 1.00 | 1.05 | 0.98 | 0.99 | 1.05 | 0.99 | 1.01 | 0.99 | 1.05 | 0.90 | 0.98 | 0.91 | 1.04 |
| C38:5 PE plasmalogen | ME624520 | 0.97 | 0.99 | 1.00 | 1.00 | 1.07 | 0.98 | 1.02 | 1.02 | 1.01 | 0.94 | 1.00 | 0.97 | 1.00 |
| valine-d8 | ME624329 | 0.96 | 1.01 | 1.03 | 1.03 | 1.06 | 1.03 | 0.98 | 1.00 | 0.99 | 0.95 | 0.97 | 0.93 | 1.03 |
| pyridoxamine | ME624460 | 0.99 | 1.06 | 1.05 | 0.99 | 0.96 | 0.96 | 1.01 | 1.08 | 0.98 | 1.00 | 1.04 | 0.90 | 1.02 |
| C34:4 PC | ME624501 | 0.92 | 1.11 | 1.02 | 1.08 | 1.00 | 1.03 | 1.01 | 1.02 | 0.97 | 0.92 | 1.07 | 0.93 | 0.94 |
| phenylalanine | ME624453 | 0.96 | 1.13 | 1.02 | 1.02 | 0.98 | 0.97 | 1.03 | 0.95 | 1.04 | 0.96 | 1.04 | 0.89 | 1.02 |
| C34:0 PE | ME624509 | 0.93 | 0.95 | 1.02 | 0.99 | 1.09 | 1.04 | 1.00 | 1.10 | 1.05 | 0.86 | 1.07 | 0.93 | 0.90 |
| glutathione reduced | ME624403 | 0.95 | 0.94 | 1.03 | 1.02 | 1.03 | 1.10 | 0.97 | 1.08 | 1.06 | 0.91 | 1.05 | 0.91 | 0.95 |
| N6,N6,N6-trimethyllysine | ME624429 | 0.91 | 0.97 | 1.02 | 1.02 | 1.12 | 1.06 | 0.92 | 1.12 | 1.02 | 0.94 | 1.05 | 0.85 | 0.93 |
| S-adenosylmethionine | ME624462 | 0.94 | 1.03 | 1.02 | 1.02 | 1.05 | 1.10 | 0.96 | 1.11 | 1.04 | 0.89 | 1.03 | 0.86 | 0.93 |
| valine | ME624476 | 0.94 | 1.01 | 1.03 | 1.03 | 1.03 | 1.10 | 0.97 | 1.17 | 1.03 | 0.90 | 0.98 | 0.89 | 0.93 |
| C38:7 PE plasmalogen | ME624518 | 0.95 | 0.97 | 1.02 | 1.03 | 0.97 | 1.07 | 1.04 | 1.08 | 0.99 | 0.94 | 1.00 | 0.98 | 0.99 |
| serine | ME624464 | 0.99 | 0.97 | 1.03 | 1.03 | 0.95 | 1.06 | 0.99 | 1.06 | 1.01 | 0.92 | 1.03 | 1.00 | 1.00 |
| N-acetylaspartate | ME624434 | 0.94 | 1.00 | 1.02 | 1.04 | 1.05 | 1.02 | 0.98 | 1.08 | 1.00 | 0.95 | 1.03 | 0.90 | 0.98 |
| C40:7 PE plasmalogen | ME624521 | 0.95 | 0.96 | 1.00 | 1.01 | 1.02 | 1.04 | 1.02 | 1.04 | 1.03 | 0.98 | 0.98 | 0.95 | 0.99 |
| C36:4 PE | ME624510 | 0.94 | 1.00 | 1.02 | 1.02 | 0.99 | 1.06 | 1.02 | 1.07 | 1.05 | 0.89 | 1.04 | 0.93 | 0.98 |
| C38:6 PE | ME624512 | 0.94 | 1.00 | 1.02 | 1.02 | 1.00 | 1.06 | 1.01 | 1.04 | 1.03 | 0.94 | 1.04 | 0.94 | 0.98 |
| creatine | ME624393 | 0.94 | 0.98 | 1.02 | 1.02 | 1.01 | 1.05 | 1.01 | 1.06 | 1.04 | 0.94 | 1.03 | 0.94 | 0.97 |
| C36:5 PE plasmalogen | ME624517 | 0.94 | 1.04 | 1.01 | 1.00 | 1.06 | 1.00 | 1.02 | 1.08 | 1.02 | 0.86 | 1.02 | 0.97 | 0.95 |
| sphinganine | ME624529 | 0.92 | 1.00 | 0.98 | 0.98 | 1.09 | 1.12 | 1.08 | 1.08 | 1.00 | 0.92 | 0.93 | 0.91 | 0.93 |
| sphingosine | ME624527 | 0.94 | 1.00 | 1.00 | 0.99 | 1.07 | 1.12 | 1.05 | 1.05 | 0.98 | 0.93 | 0.97 | 0.94 | 0.91 |
| C30:0 PC | ME624500 | 0.97 | 0.97 | 1.02 | 0.99 | 1.06 | 1.08 | 1.02 | 1.08 | 1.00 | 0.93 | 0.99 | 0.96 | 0.89 |
| C38:4 PE | ME624513 | 0.95 | 0.97 | 1.01 | 1.01 | 1.05 | 1.04 | 1.04 | 1.07 | 1.02 | 0.91 | 1.00 | 0.96 | 0.95 |
| asparagine | ME624357 | 0.92 | 1.03 | 1.03 | 1.01 | 1.08 | 1.05 | 1.03 | 1.07 | 1.04 | 0.95 | 0.96 | 0.87 | 0.93 |
| alanine | ME624350 | 0.90 | 1.05 | 1.03 | 1.02 | 1.02 | 1.08 | 1.03 | 1.03 | 1.00 | 0.91 | 0.99 | 0.92 | 1.02 |
| 1-methyladenosine | ME624330 | 0.93 | 1.04 | 1.02 | 1.00 | 1.05 | 1.09 | 1.05 | 1.04 | 1.01 | 0.91 | 0.95 | 0.93 | 0.95 |
| taurine | ME624467 | 0.98 | 1.03 | 1.02 | 1.02 | 1.04 | 1.06 | 1.01 | 1.04 | 1.02 | 0.90 | 0.99 | 0.92 | 0.96 |
| glycine | ME624404 | 0.95 | 1.02 | 1.02 | 1.01 | 1.02 | 1.08 | 1.05 | 1.01 | 1.02 | 1.05 | 0.99 | 0.87 | 0.92 |
| 4-acetamidobutanoate | ME624339 | 0.90 | 1.00 | 1.06 | 1.01 | 1.04 | 1.12 | 0.96 | 1.06 | 0.98 | 1.00 | 0.98 | 0.88 | 1.00 |
| tyrosine | ME624474 | 0.91 | 1.06 | 1.02 | 1.02 | 1.04 | 1.06 | 0.96 | 1.03 | 1.07 | 0.95 | 1.03 | 0.87 | 0.98 |
| alpha-glycerophosphocholine | ME624353 | 0.95 | 0.95 | 1.02 | 1.02 | 1.05 | 1.02 | 0.96 | 1.04 | 1.00 | 1.06 | 1.03 | 0.87 | 0.99 |
| C36:2 PE | ME624511 | 0.99 | 0.99 | 1.00 | 0.99 | 1.06 | 0.98 | 0.98 | 0.97 | 1.00 | 1.06 | 0.98 | 0.95 | 1.00 |
| C34:3 PC | ME624502 | 0.95 | 0.93 | 1.00 | 0.98 | 1.03 | 1.04 | 1.02 | 1.11 | 1.03 | 0.98 | 1.03 | 0.97 | 0.92 |
| C40:6 PE | ME624514 | 0.93 | 0.94 | 1.00 | 1.01 | 1.05 | 1.02 | 0.98 | 1.06 | 1.02 | 1.02 | 1.05 | 0.95 | 0.93 |
| glutamine | ME624402 | 0.99 | 0.98 | 1.02 | 1.01 | 1.07 | 1.04 | 0.97 | 1.06 | 1.04 | 0.96 | 1.06 | 0.87 | 0.90 |
| C16:0 LPE | ME624493 | 0.95 | 0.98 | 1.01 | 1.02 | 1.10 | 1.05 | 0.96 | 1.08 | 0.98 | 0.96 | 1.01 | 0.92 | 0.92 |
| C18:3 LPE | ME624494 | 0.99 | 0.94 | 1.01 | 1.01 | 1.08 | 1.04 | 0.95 | 1.06 | 1.01 | 0.99 | 1.03 | 0.93 | 0.92 |
| aspartate | ME624358 | 0.97 | 1.01 | 1.03 | 1.02 | 1.00 | 1.02 | 0.93 | 1.05 | 1.04 | 0.99 | 1.11 | 0.89 | 0.95 |
| N6-methyllysine | ME624432 | 1.02 | 1.06 | 1.05 | 1.03 | 0.96 | 1.04 | 0.97 | 1.06 | 1.03 | 0.99 | 1.01 | 0.90 | 0.91 |
| phosphocholine | ME624454 | 0.98 | 1.01 | 1.03 | 1.04 | 0.98 | 1.05 | 0.91 | 1.09 | 1.00 | 1.03 | 1.01 | 0.96 | 0.94 |
| pipecolate | ME624455 | 0.96 | 1.01 | 1.03 | 1.03 | 1.04 | 1.08 | 0.93 | 1.08 | 0.96 | 1.02 | 1.02 | 0.92 | 0.91 |
| proline | ME624457 | 0.98 | 1.03 | 1.03 | 1.02 | 1.05 | 1.03 | 0.93 | 1.07 | 0.99 | 1.00 | 1.03 | 0.89 | 0.93 |
| isoleucine | ME624415 | 0.98 | 1.04 | 1.04 | 1.05 | 0.94 | 1.11 | 0.96 | 1.19 | 0.98 | 0.93 | 0.99 | 0.89 | 0.95 |
| leucine | ME624417 | 0.99 | 1.05 | 1.06 | 1.04 | 0.91 | 1.10 | 0.95 | 1.14 | 0.98 | 0.94 | 1.01 | 0.92 | 0.97 |
| N-acetylglutamine | ME624435 | 0.98 | 1.00 | 1.04 | 1.02 | 0.97 | 1.12 | 0.98 | 1.12 | 1.06 | 0.97 | 1.06 | 0.85 | 0.86 |
| SDMA | ME624463 | 1.00 | 1.03 | 1.03 | 1.06 | 1.03 | 1.14 | 0.94 | 1.11 | 0.99 | 0.98 | 0.98 | 0.90 | 0.83 |
| N6-acetyllysine | ME624431 | 1.01 | 0.99 | 1.08 | 1.04 | 0.83 | 1.15 | 0.99 | 1.12 | 1.10 | 0.95 | 1.04 | 0.89 | 0.93 |
| 5-methylcytidine | ME624341 | 0.94 | 1.03 | 1.06 | 1.02 | 0.90 | 1.08 | 1.03 | 1.10 | 1.05 | 0.86 | 1.02 | 0.95 | 1.04 |
| C36:5 PC plasmalogen | ME624504 | 0.94 | 1.09 | 1.02 | 1.03 | 0.93 | 1.07 | 1.00 | 1.05 | 1.10 | 0.91 | 1.03 | 0.95 | 0.94 |
| histidine | ME624409 | 0.96 | 1.08 | 1.05 | 1.05 | 0.90 | 1.11 | 0.99 | 1.05 | 1.10 | 0.94 | 1.02 | 0.87 | 0.95 |
| N1-acetylspermidine | ME624425 | 0.99 | 1.04 | 1.02 | 1.04 | 0.85 | 1.02 | 1.02 | 1.01 | 1.06 | 1.02 | 1.09 | 0.99 | 0.96 |
| C34:2 PE | ME624508 | 0.95 | 0.94 | 1.02 | 1.02 | 0.95 | 1.06 | 0.95 | 1.05 | 1.01 | 1.06 | 1.05 | 0.98 | 0.99 |
| putrescine | ME624459 | 0.99 | 1.01 | 1.03 | 1.02 | 0.93 | 1.07 | 1.06 | 1.01 | 1.04 | 0.96 | 0.97 | 1.00 | 0.95 |
| beta-alanine | ME624359 | 0.90 | 1.02 | 1.05 | 1.06 | 0.93 | 1.09 | 1.01 | 1.03 | 1.03 | 1.01 | 1.02 | 0.91 | 1.01 |
| butyrobetaine | ME624363 | 0.96 | 1.00 | 1.05 | 1.04 | 0.90 | 1.09 | 1.01 | 1.09 | 1.03 | 0.94 | 1.06 | 0.93 | 0.98 |
| C-glycosyltryptophan | ME624390 | 0.94 | 0.99 | 1.04 | 1.02 | 0.91 | 1.14 | 1.00 | 1.07 | 1.03 | 0.99 | 1.04 | 0.95 | 0.94 |
| alloisoleucine | ME624352 | 1.01 | 1.00 | 1.04 | 1.04 | 0.91 | 1.10 | 1.00 | 1.09 | 1.01 | 1.03 | 0.99 | 0.94 | 0.91 |
| C38:7 PC plasmalogen | ME624506 | 0.98 | 0.98 | 1.01 | 1.01 | 0.91 | 1.11 | 1.05 | 1.10 | 1.04 | 0.99 | 1.05 | 0.95 | 0.89 |
| C34:2 PE plasmalogen | ME624516 | 1.00 | 0.99 | 1.00 | 0.99 | 1.21 | 1.00 | 1.01 | 0.95 | 0.96 | 0.92 | 0.83 | 0.99 | 1.03 |
| C14:0 LPC | ME624479 | 0.99 | 1.09 | 1.00 | 1.00 | 1.15 | 1.00 | 0.97 | 1.02 | 0.91 | 0.91 | 0.88 | 0.99 | 1.00 |
| cytidine | ME624398 | 0.99 | 1.08 | 1.01 | 1.01 | 1.09 | 1.03 | 1.02 | 1.03 | 0.97 | 0.91 | 0.90 | 0.96 | 0.97 |
| C18 carnitine | ME624383 | 1.10 | 1.02 | 1.01 | 0.99 | 1.04 | 1.12 | 0.91 | 1.15 | 1.00 | 0.89 | 0.86 | 0.94 | 0.95 |
| tryptophan | ME624473 | 1.01 | 0.97 | 1.01 | 1.01 | 1.14 | 1.13 | 0.96 | 1.18 | 0.97 | 0.91 | 0.89 | 0.88 | 0.87 |
| 7-methylguanine | ME624343 | 1.00 | 0.99 | 1.01 | 0.96 | 1.08 | 1.12 | 0.93 | 1.05 | 0.94 | 0.97 | 0.97 | 1.00 | 0.92 |
| betaine | ME624361 | 1.02 | 0.93 | 1.02 | 1.02 | 1.06 | 1.15 | 0.90 | 1.02 | 1.02 | 1.06 | 0.86 | 1.01 | 0.90 |
| C34:1 DAG | ME624532 | 0.99 | 1.07 | 0.90 | 0.90 | 1.19 | 1.06 | 0.96 | 1.00 | 1.10 | 0.88 | 0.79 | 0.83 | 1.17 |
| trimethylbenzene | ME624472 | 0.93 | 1.09 | 0.83 | 0.84 | 1.21 | 1.00 | 0.97 | 0.87 | 1.10 | 0.90 | 0.86 | 0.86 | 1.35 |
| C24:1 ceramide (d18:1) | ME624531 | 0.97 | 0.88 | 0.93 | 1.01 | 1.13 | 1.16 | 0.78 | 1.22 | 1.09 | 0.89 | 0.78 | 0.89 | 1.18 |
| hippurate | ME624407 | 0.82 | 1.18 | 1.01 | 1.02 | 1.19 | 0.91 | 0.68 | 1.11 | 1.04 | 0.86 | 0.97 | 0.82 | 1.28 |
| creatinine | ME624394 | 0.84 | 1.07 | 1.06 | 1.06 | 1.12 | 1.11 | 0.88 | 1.05 | 1.03 | 0.95 | 0.85 | 0.80 | 1.14 |
| methylthioadenosine | ME624424 | 0.72 | 1.12 | 1.07 | 1.14 | 1.21 | 1.09 | 0.74 | 1.09 | 1.05 | 0.96 | 0.77 | 0.74 | 1.22 |
| xanthosine | ME624478 | 0.96 | 1.43 | 1.01 | 1.03 | 1.18 | 0.76 | 1.02 | 0.88 | 0.81 | 0.84 | 0.76 | 1.04 | 1.20 |
| C20 carnitine | ME624387 | 1.04 | 1.28 | 0.91 | 0.97 | 1.24 | 1.18 | 1.05 | 0.90 | 0.91 | 0.90 | 0.75 | 0.82 | 0.87 |
| C22:4 LPC | ME624489 | 0.93 | 1.30 | 1.05 | 1.02 | 1.26 | 0.94 | 1.05 | 0.90 | 0.92 | 0.73 | 0.83 | 0.70 | 1.22 |
| N2,N2-dimethylguanosine | ME624427 | 0.82 | 1.14 | 1.11 | 0.98 | 1.34 | 0.90 | 0.82 | 1.11 | 0.86 | 0.87 | 0.95 | 0.84 | 1.09 |
| C18:1 LPE | ME624495 | 0.97 | 1.15 | 0.98 | 0.98 | 1.31 | 0.99 | 0.93 | 0.96 | 0.90 | 0.90 | 0.88 | 0.88 | 0.99 |
| C20:4 LPE | ME624497 | 0.92 | 1.33 | 0.99 | 0.99 | 1.28 | 0.93 | 0.96 | 1.02 | 0.88 | 0.81 | 0.86 | 0.85 | 1.04 |
| C22:6 LPE | ME624499 | 0.91 | 1.28 | 1.03 | 1.01 | 1.13 | 1.02 | 1.00 | 1.04 | 0.92 | 0.86 | 0.87 | 0.87 | 1.00 |
Factors:
| F1 | Group:Control | Timepoint:8 weeks of training or control time | Sex:Female |
| F2 | Group:Control | Timepoint:8 weeks of training or control time | Sex:Male |
| F3 | Group:QC-DriftCorrection | Timepoint:0 hour | Sex:- |
| F4 | Group:QC-Pooled | Timepoint:0 hour | Sex:- |
| F5 | Group:QC-Reference | Timepoint:0 hour | Sex:- |
| F6 | Group:Training | Timepoint:1 week of training or control time | Sex:Female |
| F7 | Group:Training | Timepoint:1 week of training or control time | Sex:Male |
| F8 | Group:Training | Timepoint:2 weeks of training | Sex:Female |
| F9 | Group:Training | Timepoint:2 weeks of training | Sex:Male |
| F10 | Group:Training | Timepoint:4 weeks of training | Sex:Female |
| F11 | Group:Training | Timepoint:4 weeks of training | Sex:Male |
| F12 | Group:Training | Timepoint:8 weeks of training or control time | Sex:Female |
| F13 | Group:Training | Timepoint:8 weeks of training or control time | Sex:Male |