Data for ST002556
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1,5-anhydroglucitol | 26815.94 | 41378.83 | 23866.21 | 31842.67 | 19052.18 | 23798.17 | 28303.16 | 34184.78 | 28565.95 | 28071.88 | 18166.42 | 22556.87 | |
| 1-hexadecanol | 603.44 | 653.00 | 609.59 | 639.33 | 673.44 | 542.22 | 680.16 | 623.69 | 678.26 | 554.36 | 532.58 | 535.39 | |
| 1-monoolein | 25157.88 | 25990.00 | 17975.59 | 17266.06 | 25924.76 | 28212.44 | 20204.95 | 28625.22 | 20560.74 | 14865.67 | 18011.00 | 23871.16 | |
| 1-monopalmitin | 1126.38 | 1121.44 | 1358.15 | 1294.06 | 1119.59 | 1146.94 | 1053.37 | 1099.66 | 1222.89 | 1285.79 | 1043.89 | 1063.58 | |
| 1-monostearin | 1966.18 | 2209.17 | 2050.65 | 1929.33 | 1335.41 | 1493.33 | 1969.11 | 2128.00 | 1838.68 | 1876.45 | 1159.16 | 1324.16 | |
| 2,5-dihydroxypyrazine | 554.38 | 584.33 | 554.68 | 564.06 | 477.26 | 510.22 | 610.47 | 670.06 | 566.32 | 545.79 | 538.16 | 510.19 | |
| 2,6-diaminopimelic acid | 472.38 | 491.33 | 520.82 | 431.56 | 507.35 | 466.28 | 478.47 | 487.66 | 463.89 | 454.21 | 438.42 | 416.71 | |
| 2,8-dihydroxyquinoline | 684.03 | 366.72 | 696.35 | 438.50 | 516.26 | 455.67 | 600.21 | 419.06 | 541.84 | 392.48 | 473.89 | 399.39 | |
| 2-aminobutyric acid | 46572.85 | 78534.61 | 88157.62 | 125483.72 | 38359.38 | 44647.33 | 46589.58 | 66051.03 | 106721.84 | 117509.91 | 34714.95 | 40778.81 | |
| 2^-deoxyguanosine | 212.06 | 281.94 | 222.12 | 251.39 | 249.74 | 225.72 | 240.11 | 288.09 | 287.74 | 278.76 | 264.74 | 205.42 | |
| 2-deoxypentitol | 808.18 | 848.11 | 1254.94 | 1240.67 | 804.44 | 769.28 | 1065.00 | 816.88 | 1480.74 | 1244.91 | 916.37 | 748.19 | |
| 2-deoxytetronic acid | 2006.53 | 2039.61 | 2010.94 | 1812.00 | 1482.53 | 1683.39 | 1970.53 | 1941.31 | 1688.63 | 1689.39 | 1278.63 | 1428.71 | |
| 2-hydroxy-2-methylbutanoic acid | 4254.62 | 2721.28 | 5334.35 | 3372.39 | 2597.47 | 2854.00 | 3585.47 | 2413.16 | 4661.11 | 1892.42 | 2125.53 | 2517.71 | |
| 2-hydroxybutanoic acid | 56753.76 | 133047.72 | 81275.97 | 125795.83 | 28825.88 | 31027.17 | 115960.89 | 154245.97 | 196572.74 | 244013.12 | 32937.89 | 31946.03 | |
| 2-hydroxyglutaric acid | 2696.62 | 3147.06 | 2576.29 | 2492.39 | 2032.50 | 2476.89 | 3627.74 | 2886.25 | 4606.89 | 3435.64 | 2540.26 | 2142.68 | |
| 2-hydroxyhexanoic acid | 4900.41 | 7934.39 | 3949.88 | 6909.83 | 4924.03 | 3311.39 | 3802.42 | 2750.75 | 4908.26 | 4043.79 | 4970.79 | 3549.03 | |
| 2-hydroxyvaleric acid | 10730.21 | 11399.22 | 13130.74 | 11893.56 | 14597.97 | 13651.06 | 10823.58 | 11415.03 | 13181.84 | 11499.64 | 14095.84 | 12329.10 | |
| 2-ketoadipic acid | 16004.65 | 21011.28 | 19358.06 | 14066.33 | 20007.59 | 12525.72 | 11318.42 | 14535.31 | 14603.26 | 13977.33 | 16223.68 | 13051.19 | |
| 2-ketobutyric acid | 6634.50 | 7181.50 | 7149.12 | 6795.22 | 7252.88 | 6674.61 | 6443.26 | 6265.91 | 6739.42 | 6174.33 | 6960.95 | 6635.00 | |
| 2-ketoglucose dimethylacetal | 757.82 | 683.17 | 893.03 | 823.72 | 899.38 | 1009.83 | 646.58 | 647.06 | 859.53 | 760.30 | 818.11 | 834.77 | |
| 2-ketoisocaproic acid | 27653.59 | 29949.00 | 29803.18 | 27830.67 | 33552.82 | 31193.61 | 30419.74 | 29279.44 | 32237.74 | 28093.76 | 31560.37 | 30570.23 | |
| 2-ketoisovaleric acid | 8939.03 | 9639.39 | 8960.32 | 9244.83 | 9405.00 | 9082.83 | 7569.26 | 8547.81 | 8412.74 | 7956.36 | 8087.32 | 9826.35 | |
| 2-methylglyceric acid | 1148.59 | 1256.39 | 1276.06 | 1250.94 | 1462.59 | 1552.22 | 1167.84 | 1020.44 | 1290.21 | 1203.06 | 1781.37 | 1484.23 | |
| 2-monoolein | 6226.47 | 26062.83 | 11334.91 | 11986.22 | 2265.12 | 2285.61 | 1611.26 | 19008.06 | 6307.68 | 6878.58 | 2446.63 | 2446.74 | |
| 2-monopalmitin | 1618.06 | 2764.17 | 1607.53 | 1667.61 | 1746.26 | 1372.61 | 1665.58 | 2102.72 | 1653.95 | 1560.64 | 1641.16 | 1455.23 | |
| 2-picolinic acid | 584.91 | 602.83 | 632.76 | 638.78 | 785.41 | 660.83 | 622.37 | 578.16 | 763.47 | 601.91 | 682.89 | 625.65 | |
| 3-(4-hydroxyphenyl)propionic acid | 696.06 | 542.44 | 648.62 | 607.22 | 721.09 | 634.39 | 513.00 | 589.81 | 1692.63 | 1965.73 | 607.21 | 600.29 | |
| 3-aminoisobutyric acid | 6779.18 | 4087.06 | 5745.76 | 6095.94 | 11541.91 | 7703.06 | 3831.00 | 3141.84 | 2918.32 | 4117.61 | 6356.11 | 6356.48 | |
| 3-hydroxy-3-methylglutaric acid | 440.35 | 467.44 | 522.26 | 479.94 | 495.03 | 491.67 | 387.32 | 430.81 | 619.89 | 570.97 | 374.79 | 424.32 | |
| 3-hydroxybutyric acid | 856268.06 | 876985.89 | 1424635.41 | 1250090.39 | 583594.32 | 576547.11 | 1259898.00 | 935592.53 | 1866214.37 | 1726179.12 | 674713.05 | 558021.65 | |
| 3-hydroxypalmitic acid | 341.79 | 392.61 | 414.76 | 370.00 | 303.94 | 323.00 | 387.58 | 397.69 | 364.26 | 402.42 | 321.47 | 315.48 | |
| 3-hydroxypropionic acid | 8870.12 | 7057.94 | 19623.97 | 10619.50 | 9366.82 | 7622.78 | 9324.53 | 6681.44 | 100547.26 | 14848.61 | 9496.32 | 6089.42 | |
| 3-phenyllactic acid | 1139.91 | 959.67 | 1045.71 | 928.33 | 1046.91 | 737.17 | 1220.68 | 973.56 | 1106.84 | 989.52 | 1003.68 | 684.03 | |
| 3-phosphoglycerate | 246.68 | 234.28 | 242.29 | 232.78 | 260.03 | 249.72 | 226.89 | 213.25 | 225.16 | 242.64 | 236.58 | 238.87 | |
| 3-ureidopropionate | 874.00 | 838.94 | 1620.21 | 1053.61 | 793.56 | 935.94 | 858.68 | 896.22 | 1042.95 | 905.12 | 736.95 | 918.13 | |
| 4-aminobutyric acid | 257.53 | 260.11 | 321.38 | 236.39 | 233.76 | 297.50 | 271.74 | 326.75 | 273.68 | 236.30 | 246.42 | 266.23 | |
| 4-hydroxybutyric acid | 8362.41 | 6378.67 | 9790.56 | 8043.17 | 6693.68 | 5378.11 | 6193.63 | 5163.03 | 9843.21 | 8771.52 | 5233.21 | 4432.35 | |
| 4-hydroxycinnamic acid | 13362.88 | 13731.39 | 13161.06 | 12733.56 | 14320.03 | 14026.44 | 14632.53 | 14728.53 | 13980.26 | 13406.70 | 13956.32 | 15393.74 | |
| 4-hydroxyphenylacetic acid | 1012.24 | 863.67 | 1887.12 | 1422.06 | 1485.32 | 1273.11 | 925.95 | 828.31 | 1604.79 | 1485.24 | 1108.05 | 1291.84 | |
| 5,6-dihydrouracil | 332.50 | 299.78 | 363.74 | 337.89 | 361.03 | 374.94 | 333.58 | 331.19 | 345.63 | 357.15 | 332.42 | 353.32 | |
| 5-aminovaleric acid | 3914.35 | 4036.06 | 4876.97 | 4623.06 | 3811.71 | 3859.28 | 4141.05 | 3966.41 | 18015.26 | 15646.61 | 3883.11 | 3937.16 | |
| 5-hydroxynorvaline | 1341.26 | 1361.94 | 1537.29 | 1508.44 | 1274.12 | 1373.83 | 1181.95 | 1306.09 | 1354.16 | 1261.94 | 1267.42 | 1252.55 | |
| 5-methoxytryptamine | 284.82 | 291.06 | 305.18 | 322.89 | 684.47 | 292.89 | 294.95 | 302.16 | 280.84 | 325.21 | 297.26 | 299.97 | |
| 9-myristoleate | 11680.41 | 16337.00 | 16144.82 | 15156.83 | 7246.09 | 6975.33 | 20023.16 | 14826.56 | 19508.16 | 10322.82 | 8492.74 | 7319.32 | |
| aconitic acid | 1128.50 | 1171.00 | 1378.12 | 1059.11 | 923.47 | 982.61 | 1213.21 | 984.84 | 998.16 | 871.03 | 761.37 | 794.90 | |
| adenine | 1882.62 | 1990.67 | 4782.65 | 5914.78 | 1158.41 | 2415.78 | 1259.37 | 1298.03 | 3249.63 | 858.03 | 838.00 | 736.74 | |
| adenosine | 349.18 | 333.72 | 381.18 | 272.22 | 465.29 | 268.83 | 411.16 | 258.00 | 283.74 | 421.15 | 404.74 | 327.71 | |
| adenosine-5-monophosphate | 304.44 | 321.83 | 320.09 | 288.17 | 333.79 | 286.72 | 281.21 | 280.16 | 324.63 | 316.73 | 485.26 | 284.00 | |
| adipic acid | 5817.03 | 5371.72 | 6134.12 | 5748.44 | 5618.97 | 5299.39 | 5855.68 | 5367.44 | 6522.37 | 5622.97 | 5335.63 | 5387.00 | |
| alanine | 604324.94 | 657359.28 | 674390.24 | 592619.94 | 696110.59 | 684358.67 | 575502.05 | 556844.00 | 511067.11 | 485127.97 | 623823.42 | 615567.94 | |
| alanine-alanine | 4972.50 | 5251.22 | 6124.62 | 5052.67 | 5095.50 | 4627.89 | 4502.47 | 4046.41 | 4508.95 | 4163.73 | 4714.32 | 4291.10 | |
| allantoic acid | 51206.24 | 37443.83 | 73632.03 | 51639.44 | 41384.74 | 37094.67 | 41422.95 | 32418.91 | 43834.26 | 39824.45 | 36072.05 | 34412.61 | |
| alpha-aminoadipic acid | 1532.12 | 1658.72 | 2996.56 | 2674.56 | 2788.24 | 2142.61 | 1838.95 | 1556.28 | 2490.00 | 2434.21 | 2790.42 | 2117.19 | |
| alpha-ketoglutarate | 2811.97 | 2646.56 | 2250.06 | 2063.44 | 2718.24 | 2127.61 | 3881.11 | 3092.09 | 3770.32 | 2625.67 | 2838.68 | 2317.26 | |
| aminomalonate | 7693.38 | 8011.94 | 12651.62 | 13641.11 | 6593.12 | 6529.33 | 7267.63 | 6641.16 | 10997.84 | 10866.97 | 6426.47 | 6696.03 | |
| arachidic acid | 6552.38 | 6852.17 | 6811.62 | 6482.00 | 5999.29 | 6009.61 | 7170.16 | 6583.94 | 6986.37 | 6497.61 | 5595.00 | 6364.94 | |
| arachidonic acid | 4398.18 | 5291.28 | 5338.56 | 5335.22 | 4373.47 | 5827.00 | 4643.63 | 6082.53 | 5804.11 | 6123.06 | 4112.47 | 5282.32 | |
| asparagine | 12021.47 | 11043.72 | 15706.76 | 13370.00 | 12401.21 | 12066.67 | 11893.68 | 9610.94 | 12147.74 | 12315.45 | 10275.84 | 11169.35 | |
| aspartic acid | 8040.47 | 9804.06 | 9934.41 | 9967.56 | 11001.65 | 9638.11 | 9463.47 | 7814.19 | 8589.21 | 9838.12 | 10659.74 | 9610.00 | |
| behenic acid | 2601.03 | 2642.72 | 2520.76 | 2503.33 | 2540.32 | 2484.83 | 2545.79 | 2551.72 | 2608.11 | 2431.45 | 2301.21 | 2495.77 | |
| benzoic acid | 83689.76 | 70230.67 | 82422.03 | 76171.11 | 77331.44 | 69109.11 | 75243.05 | 65177.81 | 71211.21 | 73165.33 | 61541.58 | 64440.71 | |
| beta-alanine | 4185.88 | 4529.28 | 5831.00 | 5764.72 | 3865.62 | 4524.22 | 4319.58 | 4517.06 | 6371.16 | 6286.24 | 3786.16 | 4302.45 | |
| beta-gentiobiose | 676.65 | 687.00 | 550.29 | 551.50 | 614.06 | 646.28 | 427.00 | 699.53 | 420.53 | 574.85 | 531.47 | 537.48 | |
| beta-glutamic acid | 333.38 | 396.33 | 425.18 | 468.33 | 544.32 | 609.44 | 427.32 | 383.94 | 379.32 | 585.94 | 583.16 | 538.10 | |
| beta-glycerolphosphate | 906.53 | 1080.06 | 818.65 | 736.39 | 798.79 | 880.11 | 1376.32 | 1163.53 | 762.89 | 739.73 | 674.84 | 728.61 | |
| beta-sitosterol | 624.76 | 633.22 | 923.88 | 764.28 | 666.00 | 700.61 | 686.05 | 643.38 | 850.37 | 677.45 | 669.68 | 673.68 | |
| butyrolactam | 12875.09 | 14100.28 | 19305.00 | 18606.56 | 9859.68 | 8952.89 | 16751.79 | 14077.00 | 24627.79 | 22424.27 | 9998.95 | 8726.26 | |
| catechol | 817.59 | 400.33 | 860.56 | 599.56 | 924.15 | 614.33 | 680.53 | 504.25 | 652.89 | 506.18 | 781.74 | 538.03 | |
| cellobiose | 381407.97 | 683946.39 | 347760.00 | 343936.50 | 68634.00 | 101477.11 | 436419.74 | 556235.97 | 296667.00 | 241659.15 | 35952.26 | 99833.00 | |
| cerotinic acid | 589.74 | 684.17 | 637.15 | 636.00 | 585.44 | 696.89 | 568.68 | 629.44 | 707.00 | 694.18 | 571.05 | 585.48 | |
| cholesterol | 284734.12 | 351876.56 | 339094.26 | 319836.94 | 364559.62 | 379679.72 | 308184.32 | 340544.91 | 340653.53 | 336005.67 | 365659.53 | 362411.45 | |
| cholesterone | 153.74 | 132.44 | 156.88 | 164.00 | 153.24 | 133.06 | 141.89 | 160.34 | 144.68 | 154.33 | 162.84 | 158.52 | |
| cholic acid | 7436.21 | 9328.83 | 20572.74 | 10031.61 | 2012.21 | 2275.72 | 7614.32 | 7974.91 | 9671.53 | 7566.27 | 2021.74 | 1849.65 | |
| ciliatine | 336.21 | 436.00 | 409.76 | 286.89 | 326.91 | 287.67 | 322.74 | 306.34 | 276.16 | 284.58 | 309.16 | 286.19 | |
| cis-gondoic acid | 250.44 | 267.11 | 258.41 | 251.17 | 194.65 | 198.78 | 265.84 | 268.44 | 285.26 | 271.03 | 200.16 | 184.77 | |
| citramalic acid | 1169.47 | 1351.50 | 808.38 | 746.17 | 904.26 | 804.50 | 1332.74 | 1159.94 | 1003.21 | 775.52 | 749.21 | 688.48 | |
| citric acid | 234684.53 | 151123.44 | 318550.68 | 215846.33 | 185057.26 | 175134.72 | 210714.47 | 99795.75 | 133452.05 | 131097.33 | 191921.00 | 140112.23 | |
| citrulline | 16722.15 | 17900.67 | 19538.47 | 18488.94 | 23957.35 | 21812.39 | 15591.42 | 13904.81 | 17573.05 | 16371.18 | 21312.42 | 20145.06 | |
| conduritol-beta-epoxide | 853.79 | 835.17 | 913.76 | 858.83 | 661.12 | 685.11 | 867.00 | 810.28 | 1138.26 | 856.58 | 563.21 | 706.26 | |
| creatinine | 311475.88 | 365173.94 | 344179.41 | 295359.44 | 300411.88 | 255401.06 | 325125.63 | 323034.78 | 307987.95 | 278892.82 | 288744.89 | 246265.52 | |
| cysteine | 7572.24 | 7673.89 | 6001.38 | 6541.17 | 7606.29 | 7277.67 | 7330.79 | 6346.44 | 5997.74 | 4785.48 | 5609.47 | 6724.00 | |
| cysteine-glycine | 1198.29 | 1355.94 | 1115.26 | 1075.17 | 883.71 | 723.83 | 1307.95 | 1372.66 | 1398.84 | 1090.06 | 741.11 | 833.71 | |
| cystine | 4110.74 | 3926.06 | 5898.53 | 5435.94 | 7492.62 | 7437.28 | 3781.11 | 3950.16 | 5251.11 | 5761.18 | 6012.16 | 7972.06 | |
| cytidine | 3463.76 | 5615.50 | 3353.41 | 3114.06 | 1178.50 | 1326.72 | 3893.58 | 4618.66 | 2913.26 | 2512.91 | 866.37 | 1231.97 | |
| cytosin | 775.41 | 621.56 | 748.18 | 731.61 | 572.53 | 661.50 | 689.89 | 613.47 | 715.26 | 634.70 | 629.79 | 560.48 | |
| dehydroabietic acid | 1107.88 | 1056.39 | 1030.03 | 1042.83 | 1081.76 | 1017.67 | 1093.21 | 1134.41 | 972.68 | 972.27 | 864.84 | 1141.48 | |
| deoxycholic acid | 737.29 | 1077.89 | 1346.24 | 670.56 | 356.56 | 422.94 | 783.63 | 1055.66 | 1390.37 | 957.42 | 355.79 | 381.26 | |
| D-erythro-sphingosine | 342.47 | 436.94 | 338.00 | 379.83 | 385.09 | 362.00 | 376.53 | 351.16 | 353.68 | 368.18 | 342.74 | 307.84 | |
| dihydroxyacetone | 50649.24 | 57609.44 | 51964.62 | 43667.17 | 60928.53 | 45237.06 | 55074.11 | 51309.19 | 50663.42 | 50309.64 | 59442.05 | 44272.29 | |
| docosahexaenoic acid | 1487.44 | 1840.33 | 1640.88 | 1719.44 | 1482.71 | 1532.00 | 1444.42 | 1699.56 | 1395.26 | 1679.58 | 1335.74 | 1689.29 | |
| elaidic acid | 176603.18 | 44802.61 | 38774.09 | 76944.94 | 292822.85 | 182914.28 | 130164.05 | 101073.75 | 73710.42 | 39868.21 | 274142.37 | 149470.16 | |
| epsilon-caprolactam | 1065.09 | 998.39 | 1034.76 | 1140.83 | 1049.06 | 1051.06 | 1562.68 | 918.69 | 1081.63 | 1020.82 | 984.16 | 1260.45 | |
| erythritol | 12782.71 | 15142.17 | 5331.09 | 9059.94 | 26029.06 | 23890.33 | 25247.26 | 17887.22 | 4801.05 | 4900.42 | 24852.37 | 24779.48 | |
| erythrose | 642.56 | 594.33 | 700.56 | 635.22 | 688.65 | 566.94 | 518.42 | 564.53 | 621.42 | 629.45 | 533.42 | 525.90 | |
| ethanolamine | 6233.12 | 6879.33 | 9561.74 | 10271.78 | 7184.09 | 6302.89 | 6855.79 | 7183.09 | 6857.79 | 12497.03 | 6305.63 | 5517.58 | |
| ethanol phosphate | 455.09 | 403.22 | 456.26 | 519.44 | 485.06 | 436.72 | 390.95 | 474.25 | 433.95 | 487.67 | 443.79 | 515.65 | |
| fructose | 258734.50 | 307251.33 | 199618.56 | 199470.39 | 212675.65 | 219788.56 | 220280.21 | 272403.06 | 203579.11 | 234325.82 | 143765.26 | 192669.58 | |
| fructose-1-phosphate | 252.53 | 188.33 | 311.21 | 352.33 | 307.12 | 309.00 | 329.21 | 267.75 | 324.89 | 274.03 | 281.53 | 278.29 | |
| fructose-6-phosphate | 198.56 | 207.00 | 207.12 | 203.00 | 221.65 | 228.22 | 206.32 | 201.72 | 209.74 | 220.85 | 247.05 | 212.00 | |
| fucose | 4502.62 | 6008.83 | 4301.41 | 4730.94 | 4121.97 | 4772.44 | 5468.79 | 5435.28 | 4418.74 | 4382.21 | 3777.42 | 4842.61 | |
| fumaric acid | 2627.41 | 2637.06 | 3034.68 | 2407.17 | 2301.00 | 2108.11 | 3107.53 | 2498.47 | 3209.16 | 2541.30 | 1845.42 | 1967.35 | |
| galactinol | 945.26 | 1206.17 | 731.91 | 719.61 | 753.26 | 836.00 | 1127.68 | 1038.28 | 709.16 | 645.03 | 747.42 | 762.32 | |
| galactose-6-phosphate | 176.47 | 185.44 | 191.00 | 188.11 | 187.32 | 173.72 | 164.89 | 182.25 | 188.53 | 171.55 | 172.89 | 193.39 | |
| gluconic acid | 1607.53 | 2153.89 | 1036.12 | 1002.72 | 1204.53 | 1331.11 | 1754.89 | 1806.47 | 1030.53 | 1036.61 | 1081.21 | 1277.61 | |
| glucose | 1403946.18 | 1750146.17 | 1169115.88 | 1296705.50 | 1476886.21 | 1529500.72 | 1734892.63 | 1642764.16 | 1306415.58 | 1357413.73 | 1344232.63 | 1547492.13 | |
| glucose-1-phosphate | 2091.00 | 1998.56 | 1672.79 | 1703.72 | 1670.88 | 2140.39 | 2670.42 | 2053.50 | 1700.79 | 1852.97 | 1807.95 | 1948.45 | |
| glucose-6-phosphate | 233.06 | 244.44 | 203.88 | 174.11 | 209.91 | 180.39 | 206.05 | 206.03 | 196.63 | 218.61 | 292.58 | 194.68 | |
| glutamic acid | 45490.50 | 54264.78 | 46212.82 | 52187.11 | 68437.82 | 64634.89 | 45098.84 | 47109.25 | 47057.89 | 57830.42 | 66633.11 | 60814.03 | |
| glutamine | 420533.18 | 496415.11 | 346932.94 | 323604.94 | 443768.85 | 407304.61 | 442217.11 | 386184.94 | 300621.37 | 324270.48 | 401809.89 | 379295.35 | |
| glutaric acid | 736.03 | 802.28 | 842.71 | 834.00 | 913.88 | 725.94 | 739.11 | 855.28 | 1104.11 | 978.21 | 808.47 | 811.39 | |
| glyceric acid | 14296.50 | 16270.83 | 14051.62 | 13011.83 | 16080.21 | 12790.89 | 12785.63 | 14001.88 | 11628.42 | 13232.61 | 12433.21 | 11586.74 | |
| glycerol | 192192.47 | 281770.00 | 344088.41 | 411462.17 | 116103.76 | 146944.83 | 253318.63 | 313145.03 | 245403.16 | 554208.06 | 107263.37 | 136549.23 | |
| glycerol-3-galactoside | 1938.76 | 1811.89 | 2028.35 | 3188.39 | 1558.41 | 1554.78 | 1701.89 | 1810.97 | 1822.21 | 3121.00 | 1562.37 | 1577.42 | |
| glycerol-alpha-phosphate | 4031.56 | 4359.89 | 5390.82 | 4603.22 | 4955.97 | 6277.00 | 3278.26 | 3449.97 | 4797.63 | 5411.82 | 3716.95 | 4902.13 | |
| glycine | 368570.24 | 339236.67 | 585795.88 | 565511.33 | 268007.00 | 256164.56 | 402613.74 | 315387.03 | 546157.53 | 458944.76 | 283156.42 | 264280.61 | |
| glycocyamine | 1596.71 | 1840.83 | 1642.97 | 1356.33 | 1440.03 | 1352.89 | 1884.84 | 1562.38 | 1578.26 | 1382.33 | 1424.68 | 1285.71 | |
| glycolic acid | 12024.97 | 13721.67 | 12112.47 | 12355.33 | 12546.06 | 11602.94 | 14474.37 | 14065.09 | 14834.63 | 12722.03 | 10371.42 | 10888.10 | |
| glycyl-proline | 391.00 | 467.83 | 444.50 | 445.39 | 386.12 | 343.50 | 406.26 | 639.28 | 425.21 | 449.94 | 554.95 | 406.48 | |
| glycyl tyrosine | 429.65 | 630.67 | 557.41 | 694.94 | 755.59 | 676.28 | 500.79 | 562.72 | 747.74 | 655.24 | 721.37 | 687.84 | |
| guanine | 178.91 | 164.67 | 183.38 | 166.06 | 171.82 | 180.56 | 175.21 | 157.88 | 183.37 | 175.36 | 170.21 | 173.71 | |
| guanosine | 293.21 | 283.06 | 332.38 | 329.72 | 313.24 | 319.44 | 270.58 | 343.75 | 303.95 | 362.03 | 350.47 | 308.97 | |
| heptadecanoic acid | 32498.65 | 46747.06 | 41170.00 | 41857.72 | 21597.00 | 24903.22 | 41600.11 | 51760.47 | 46765.37 | 41509.06 | 21262.58 | 25390.71 | |
| hippuric acid | 107542.41 | 55535.17 | 110740.26 | 62728.44 | 97239.68 | 73599.67 | 81535.05 | 58747.00 | 65585.32 | 54983.91 | 74539.26 | 62131.58 | |
| histidine | 70624.00 | 79929.33 | 71649.00 | 70571.22 | 80953.53 | 72665.56 | 77484.00 | 69559.16 | 70625.16 | 68787.64 | 82270.37 | 72311.13 | |
| homoserine | 597.00 | 595.44 | 767.56 | 572.61 | 576.29 | 620.06 | 513.00 | 543.84 | 613.16 | 541.42 | 526.26 | 575.19 | |
| hydrocinnamic acid | 35430.76 | 16655.94 | 30573.03 | 19217.61 | 29671.94 | 27867.94 | 22098.74 | 15051.81 | 25082.16 | 32653.82 | 29713.21 | 21796.77 | |
| hydroxycarbamate | 8018.53 | 9054.72 | 8760.71 | 8839.39 | 9016.85 | 9402.11 | 8051.79 | 8061.97 | 8977.89 | 8926.30 | 8115.79 | 8233.68 | |
| hypoxanthine | 497.85 | 422.44 | 594.29 | 488.61 | 486.82 | 478.94 | 453.37 | 331.78 | 391.47 | 415.79 | 477.47 | 355.35 | |
| ile-ile | 6529.68 | 6770.50 | 5489.18 | 6867.83 | 7559.12 | 6716.44 | 4990.00 | 7012.16 | 7192.37 | 6136.55 | 5009.74 | 5676.48 | |
| indole-3-acetate | 1216.56 | 1164.28 | 1787.32 | 1395.61 | 1605.53 | 1559.94 | 1091.89 | 999.34 | 1439.84 | 1252.45 | 1371.05 | 1488.32 | |
| indole-3-lactate | 2417.53 | 2256.72 | 2303.35 | 1757.61 | 1760.94 | 1496.06 | 2698.05 | 2381.31 | 2243.84 | 2014.15 | 1552.68 | 1357.45 | |
| indole-3-propionic acid | 5194.24 | 2079.67 | 3417.76 | 2106.83 | 5562.15 | 3885.67 | 2431.21 | 1804.41 | 1760.05 | 1727.82 | 3026.74 | 2537.32 | |
| indoxyl sulfate | 757.91 | 1016.50 | 696.29 | 604.17 | 858.76 | 655.83 | 1200.26 | 1049.41 | 766.95 | 731.58 | 668.47 | 672.52 | |
| inosine | 616.35 | 668.00 | 666.94 | 864.72 | 961.62 | 742.00 | 572.21 | 853.69 | 597.05 | 1041.55 | 1164.53 | 595.68 | |
| inositol-4-monophosphate | 401.29 | 375.61 | 406.21 | 339.06 | 471.47 | 354.44 | 378.05 | 373.72 | 533.16 | 457.88 | 350.37 | 337.58 | |
| isocitric acid | 4785.82 | 4132.83 | 6200.74 | 4716.33 | 3873.18 | 3695.89 | 5046.26 | 3008.34 | 3387.37 | 3239.48 | 4219.00 | 3008.45 | |
| isoheptadecanoic acid | 9747.82 | 14731.28 | 11943.97 | 13535.22 | 6064.79 | 6989.94 | 12178.32 | 16330.66 | 13514.11 | 13120.82 | 6309.47 | 7377.13 | |
| isoleucine | 444510.74 | 410209.06 | 634570.06 | 602402.17 | 609850.85 | 595007.72 | 425301.79 | 391055.38 | 543074.53 | 504693.88 | 536582.53 | 565552.48 | |
| isolinoleic acid | 515.71 | 603.17 | 618.97 | 573.94 | 612.24 | 584.89 | 578.26 | 599.97 | 600.32 | 565.91 | 606.42 | 594.52 | |
| isopentadecanoic acid | 124144.12 | 284389.17 | 19464.88 | 23825.11 | 23599.65 | 21273.83 | 278997.63 | 32759.97 | 18682.37 | 19201.73 | 22118.16 | 70370.16 | |
| isoribose | 723.53 | 807.11 | 809.15 | 693.56 | 734.79 | 703.17 | 860.84 | 698.91 | 912.89 | 738.09 | 806.95 | 732.19 | |
| isothreonic acid | 5222.50 | 5737.83 | 5416.00 | 4480.89 | 5119.65 | 5038.61 | 6199.21 | 5723.47 | 4643.37 | 4525.12 | 4469.11 | 4528.55 | |
| itaconic acid | 6024.32 | 7185.50 | 6330.65 | 6672.06 | 6982.47 | 5103.61 | 6061.21 | 6052.69 | 6105.68 | 5613.67 | 5299.11 | 5631.06 | |
| kynurenine | 2833.85 | 2064.06 | 3113.32 | 2773.17 | 3201.56 | 3626.33 | 2736.74 | 1951.44 | 2296.47 | 2022.94 | 3604.00 | 3331.68 | |
| lactamide | 831.18 | 1017.44 | 648.47 | 632.39 | 977.26 | 804.11 | 1357.63 | 966.31 | 928.68 | 713.12 | 901.16 | 681.42 | |
| lactic acid | 704314.06 | 792031.67 | 390522.18 | 356569.39 | 771181.32 | 488138.44 | 1191754.68 | 844320.44 | 543006.84 | 408422.61 | 771635.84 | 426929.55 | |
| lactitol | 2066.59 | 4139.06 | 2153.12 | 1963.83 | 610.94 | 689.44 | 2390.32 | 3433.59 | 1978.84 | 1457.36 | 435.63 | 633.61 | |
| lactobionic acid | 497.79 | 661.56 | 605.71 | 537.50 | 592.38 | 454.28 | 618.53 | 595.31 | 662.26 | 512.88 | 594.53 | 497.65 | |
| lactose | 534012.71 | 1012183.17 | 498601.97 | 475569.72 | 89058.35 | 131725.67 | 615646.84 | 811131.84 | 396950.53 | 330963.91 | 37483.89 | 108128.16 | |
| lanosterol | 176.82 | 160.22 | 168.47 | 157.22 | 155.06 | 172.83 | 167.74 | 169.25 | 160.79 | 154.70 | 138.74 | 168.19 | |
| lauric acid | 30695.35 | 30600.61 | 31949.97 | 30618.56 | 26597.79 | 28219.28 | 32155.26 | 29660.56 | 29305.11 | 28721.03 | 24304.84 | 27116.29 | |
| leucine | 714863.68 | 716456.22 | 992549.71 | 853159.67 | 871585.59 | 821128.61 | 700826.26 | 668225.28 | 856489.05 | 784585.42 | 777157.42 | 751019.42 | |
| lignoceric acid | 860.06 | 927.22 | 783.97 | 899.78 | 692.32 | 700.78 | 968.63 | 1009.56 | 992.11 | 779.15 | 614.26 | 665.26 | |
| linoleic acid | 6805.85 | 8267.50 | 9008.76 | 8871.33 | 4559.38 | 5677.06 | 7527.53 | 8751.31 | 9062.53 | 8615.39 | 4641.16 | 5364.97 | |
| lithocholic acid | 240.00 | 249.28 | 243.21 | 265.33 | 247.47 | 260.78 | 225.37 | 272.09 | 256.84 | 260.33 | 272.21 | 223.29 | |
| lysine | 11682.74 | 10922.28 | 16415.71 | 14298.78 | 19744.35 | 16174.22 | 10547.63 | 9923.31 | 15446.42 | 13348.03 | 16624.21 | 15083.19 | |
| lyxitol | 6260.35 | 6414.28 | 6835.03 | 5896.72 | 6834.06 | 6540.33 | 7773.68 | 6826.19 | 5689.53 | 5574.88 | 6698.68 | 6204.71 | |
| lyxose | 1948.12 | 2358.44 | 1875.15 | 2556.17 | 2207.71 | 2575.72 | 2293.26 | 2163.16 | 2359.68 | 1881.97 | 1718.79 | 1896.42 | |
| maleimide | 3878.50 | 4100.61 | 4502.76 | 4021.94 | 4482.53 | 4524.78 | 3417.32 | 4372.50 | 4064.53 | 4397.64 | 4126.58 | 4492.68 | |
| malic acid | 3469.97 | 3634.61 | 4135.71 | 3821.33 | 3365.18 | 3307.89 | 4306.00 | 3389.62 | 4394.26 | 3632.45 | 3009.32 | 3469.19 | |
| malonic acid | 384.29 | 328.22 | 352.68 | 330.33 | 359.29 | 374.78 | 404.42 | 324.28 | 326.95 | 323.09 | 367.89 | 316.23 | |
| maltose | 7944.82 | 7516.56 | 4996.82 | 16665.67 | 2173.50 | 2179.11 | 4344.74 | 11402.97 | 3381.47 | 5516.88 | 1809.53 | 2266.84 | |
| maltotriose | 191.91 | 179.83 | 176.91 | 221.33 | 165.76 | 169.61 | 195.21 | 190.19 | 196.16 | 175.91 | 173.11 | 186.90 | |
| mannose | 138439.94 | 177155.17 | 96562.15 | 143628.44 | 176779.91 | 204593.89 | 160036.37 | 187820.25 | 162683.53 | 174321.52 | 160737.95 | 212059.74 | |
| mannose-6-phosphate | 184.94 | 172.67 | 189.94 | 162.78 | 161.15 | 171.61 | 181.79 | 179.84 | 165.37 | 193.09 | 172.16 | 187.10 | |
| melibiose | 211.97 | 206.67 | 228.82 | 226.78 | 182.44 | 162.33 | 214.26 | 249.19 | 249.32 | 219.61 | 196.79 | 182.39 | |
| methanolphosphate | 4634.50 | 5944.44 | 5577.85 | 5632.28 | 6318.59 | 6356.22 | 4879.16 | 5169.53 | 6874.32 | 6521.21 | 5982.32 | 6513.65 | |
| methionine | 48299.38 | 52432.11 | 45327.74 | 40279.22 | 49735.18 | 46676.94 | 51518.84 | 45618.53 | 41265.21 | 34978.30 | 48170.89 | 42009.55 | |
| methionine sulfoxide | 17045.59 | 18685.28 | 12788.71 | 14086.94 | 13468.65 | 14730.00 | 14044.42 | 16014.88 | 14362.58 | 14751.61 | 12075.63 | 13480.65 | |
| methylmaleic acid | 262.21 | 259.78 | 295.59 | 271.22 | 291.06 | 269.39 | 282.37 | 269.59 | 295.00 | 269.55 | 250.63 | 276.77 | |
| Mevalonic acid | 842.18 | 519.33 | 776.50 | 968.78 | 745.29 | 1007.33 | 1005.21 | 793.75 | 650.53 | 954.88 | 871.68 | 1076.32 | |
| myo-inositol | 46783.00 | 67848.61 | 38663.41 | 39739.22 | 52962.29 | 47775.61 | 67043.79 | 72063.94 | 52501.84 | 47397.27 | 61008.63 | 44900.42 | |
| myristic acid | 14749.06 | 19315.39 | 17622.65 | 16175.06 | 6427.12 | 8262.44 | 20613.47 | 18816.91 | 20459.47 | 13077.91 | 7589.42 | 7475.48 | |
| N-acetylaspartic acid | 588.76 | 720.83 | 1242.15 | 607.50 | 829.91 | 568.11 | 878.53 | 646.28 | 745.89 | 700.21 | 468.11 | 562.29 | |
| N-acetyl-D-galactosamine | 660.82 | 863.78 | 617.56 | 678.22 | 654.41 | 658.33 | 885.05 | 793.19 | 625.37 | 530.30 | 575.53 | 528.42 | |
| N-acetylglycine | 2715.29 | 5614.89 | 6648.12 | 7747.72 | 1590.38 | 1900.50 | 4700.84 | 7172.75 | 17028.63 | 11334.09 | 1675.42 | 1922.35 | |
| N-acetylmannosamine | 679.62 | 935.67 | 639.44 | 659.06 | 791.50 | 818.78 | 927.37 | 796.59 | 652.11 | 674.79 | 751.42 | 733.10 | |
| N-acetylornithine | 5310.94 | 6653.06 | 5025.97 | 5169.44 | 5596.85 | 5428.78 | 6289.05 | 6031.22 | 5110.26 | 5248.76 | 5566.63 | 5756.48 | |
| N-carbamoylaspartate | 340.88 | 286.50 | 303.53 | 375.78 | 305.94 | 278.11 | 272.32 | 302.19 | 243.89 | 362.36 | 300.95 | 307.55 | |
| n-epsilon-trimethyllysine | 691.85 | 699.00 | 851.44 | 625.72 | 681.18 | 698.89 | 609.16 | 634.53 | 685.63 | 627.00 | 627.74 | 687.48 | |
| nicotinamide | 2273.94 | 1150.50 | 4820.59 | 5177.00 | 3744.62 | 2639.33 | 2108.42 | 1093.22 | 11108.42 | 6063.85 | 3465.42 | 2914.94 | |
| nicotinic acid | 1018.38 | 1101.44 | 1050.44 | 669.50 | 1154.59 | 637.50 | 1312.84 | 560.69 | 730.53 | 1072.06 | 905.79 | 859.74 | |
| nonadecanoic acid | 2301.15 | 3024.17 | 2614.53 | 2620.50 | 1959.00 | 2191.78 | 2555.53 | 3153.00 | 2798.21 | 2862.79 | 2113.16 | 2267.10 | |
| norvaline | 6309.76 | 6265.28 | 6138.94 | 6160.39 | 6775.00 | 5425.06 | 6783.05 | 5921.88 | 7388.26 | 6744.58 | 6423.63 | 5271.87 | |
| O-acetylserine | 313.32 | 506.22 | 454.35 | 813.33 | 624.21 | 738.61 | 361.26 | 522.03 | 424.32 | 572.21 | 408.58 | 631.00 | |
| octadecanol | 1375.12 | 1264.50 | 1554.85 | 1394.67 | 1328.41 | 2389.06 | 1403.42 | 1302.94 | 1300.58 | 1351.91 | 1320.95 | 1320.35 | |
| octadecylglycerol | 54320.59 | 210782.72 | 30839.76 | 35869.56 | 8084.44 | 11069.61 | 57952.63 | 118851.69 | 45197.11 | 34445.24 | 5243.53 | 16318.61 | |
| oleamide | 1459.74 | 1029.44 | 1147.74 | 1169.50 | 1491.29 | 1042.17 | 844.58 | 1182.25 | 1053.11 | 1133.91 | 2375.68 | 1107.42 | |
| oleic acid | 3219.09 | 6376.78 | 5366.74 | 5008.17 | 2217.26 | 2696.61 | 3425.58 | 16526.06 | 5495.05 | 4680.33 | 2303.47 | 2430.13 | |
| O-phosphoserine | 215.94 | 214.22 | 215.35 | 221.72 | 212.35 | 198.22 | 217.53 | 218.50 | 219.84 | 204.21 | 198.16 | 209.97 | |
| ornithine | 87753.03 | 85091.89 | 100936.82 | 94805.17 | 185928.26 | 148038.22 | 76596.26 | 68679.69 | 87710.32 | 86189.58 | 153047.79 | 129255.90 | |
| orotic acid | 321.41 | 368.94 | 433.44 | 383.17 | 276.50 | 234.78 | 367.95 | 343.59 | 371.26 | 368.97 | 279.21 | 252.48 | |
| oxalic acid | 2941.06 | 6332.28 | 3734.62 | 6673.17 | 6067.74 | 2067.61 | 6057.84 | 7329.44 | 9792.05 | 13209.70 | 2212.37 | 2095.32 | |
| oxoproline | 433479.82 | 548448.06 | 352978.94 | 348866.44 | 456409.65 | 455466.72 | 450132.00 | 488989.06 | 357923.68 | 384604.30 | 399360.79 | 407850.48 | |
| palmitic acid | 158604.85 | 198828.72 | 203791.15 | 200743.28 | 95679.26 | 114885.67 | 206361.00 | 211052.84 | 224344.95 | 181670.33 | 99158.63 | 114448.23 | |
| palmitoleic acid | 4484.06 | 5976.67 | 7156.82 | 6133.22 | 1179.44 | 1463.33 | 7247.58 | 6521.19 | 8647.89 | 4690.33 | 1757.00 | 1463.10 | |
| pantothenic acid | 346.68 | 365.00 | 336.50 | 302.83 | 372.88 | 397.06 | 392.47 | 380.19 | 359.37 | 363.27 | 316.21 | 383.87 | |
| parabanic acid | 1504.35 | 1674.67 | 1671.26 | 1807.50 | 1963.62 | 1772.06 | 1468.21 | 1807.06 | 1624.68 | 1672.09 | 1726.84 | 1726.39 | |
| pentadecanoic acid | 49649.29 | 48716.44 | 47705.50 | 49521.33 | 46051.50 | 40439.56 | 65410.74 | 56004.47 | 50620.68 | 45571.03 | 36564.05 | 44054.71 | |
| pentitol | 272.56 | 857.78 | 416.53 | 534.67 | 413.00 | 265.22 | 190.79 | 602.50 | 539.00 | 890.42 | 313.37 | 321.97 | |
| phenaceturic acid | 40601.79 | 42131.89 | 25643.24 | 26543.83 | 34575.97 | 49586.39 | 56497.63 | 45642.12 | 33463.63 | 32903.64 | 29909.42 | 57697.26 | |
| phenylacetic acid | 3516.62 | 3304.61 | 3203.12 | 3179.17 | 4332.62 | 2587.11 | 3145.05 | 2431.53 | 3295.42 | 4506.00 | 4311.74 | 2157.48 | |
| phenylalanine | 86735.18 | 87571.72 | 106371.53 | 92593.67 | 113515.41 | 114090.39 | 85420.74 | 83678.56 | 124044.05 | 101466.64 | 102085.32 | 110595.19 | |
| phenylethylamine | 756.76 | 803.28 | 646.56 | 478.56 | 1460.59 | 1110.22 | 770.37 | 783.56 | 471.00 | 579.06 | 1221.32 | 1063.77 | |
| phosphate | 65916.21 | 109529.33 | 83587.76 | 86579.11 | 95700.26 | 101372.83 | 79371.21 | 81702.56 | 93770.74 | 99173.24 | 85489.26 | 91986.48 | |
| phosphoenolpyruvate | 431.74 | 573.50 | 376.03 | 412.28 | 498.56 | 402.61 | 543.58 | 418.41 | 423.26 | 435.45 | 518.89 | 401.03 | |
| phosphoethanolamine | 620.76 | 622.61 | 928.32 | 886.56 | 844.62 | 932.50 | 811.95 | 658.16 | 1087.53 | 958.30 | 1069.32 | 737.87 | |
| p-hydroxylphenyllactic acid | 9412.35 | 6390.61 | 7848.59 | 14707.39 | 25021.21 | 17731.56 | 10618.26 | 11575.19 | 8671.53 | 16018.82 | 12906.74 | 27249.74 | |
| phytanic acid | 1374.91 | 1084.17 | 1338.88 | 1210.56 | 1077.38 | 984.44 | 1349.26 | 1176.38 | 1285.58 | 961.67 | 1095.16 | 967.16 | |
| pimelic acid | 1963.41 | 1920.67 | 1880.26 | 2022.44 | 2165.56 | 2046.89 | 1845.68 | 1747.47 | 2100.32 | 1869.15 | 1848.74 | 1903.26 | |
| pipecolinic acid | 2093.15 | 2008.28 | 4609.29 | 3902.39 | 2724.76 | 2596.89 | 1693.68 | 1886.97 | 4819.11 | 3971.09 | 2407.74 | 2337.29 | |
| piperidone | 405.68 | 358.06 | 369.71 | 382.61 | 367.06 | 395.72 | 451.63 | 338.28 | 1526.95 | 804.73 | 340.63 | 405.87 | |
| proline | 156535.44 | 181175.72 | 212497.53 | 215886.44 | 188676.91 | 178350.67 | 138279.37 | 155808.91 | 199109.84 | 190697.18 | 169079.53 | 161975.23 | |
| pseudo uridine | 18279.12 | 17996.78 | 19665.03 | 15068.72 | 14807.59 | 15084.94 | 20853.47 | 16941.31 | 18402.26 | 15047.24 | 13831.32 | 13565.35 | |
| p-tolyl glucuronide | 679.06 | 4735.89 | 633.38 | 3583.28 | 1758.44 | 2815.94 | 931.11 | 3780.69 | 1149.16 | 2924.58 | 1967.84 | 2333.19 | |
| putrescine | 6223.53 | 6251.44 | 6559.18 | 3328.83 | 7027.74 | 4076.28 | 8297.95 | 2745.38 | 3995.63 | 5104.00 | 5950.89 | 4962.10 | |
| pyrophosphate | 4234.24 | 4396.33 | 4502.91 | 4420.83 | 4429.44 | 3690.11 | 4305.74 | 4356.88 | 4492.58 | 4260.82 | 4341.05 | 4309.65 | |
| pyrrole-2-carboxylic acid | 577.00 | 555.67 | 703.97 | 668.11 | 666.24 | 694.67 | 583.47 | 679.28 | 669.11 | 624.76 | 520.53 | 607.74 | |
| pyruvic acid | 25093.94 | 20534.89 | 16910.03 | 13353.17 | 21607.88 | 14394.61 | 36662.11 | 23018.56 | 17950.53 | 11034.76 | 22645.32 | 13507.61 | |
| quinolinic acid | 254.03 | 234.72 | 255.41 | 233.56 | 274.35 | 230.17 | 251.53 | 231.44 | 269.53 | 266.76 | 277.11 | 268.68 | |
| ribitol | 4600.18 | 7325.83 | 2115.65 | 1864.22 | 2422.50 | 2628.89 | 13827.32 | 10063.97 | 2057.00 | 1915.24 | 2375.42 | 2418.26 | |
| ribonic acid | 1743.41 | 1626.72 | 2030.32 | 1347.33 | 1342.50 | 1697.44 | 1610.68 | 1283.50 | 1440.74 | 1549.79 | 1162.74 | 1406.81 | |
| ribose | 8147.18 | 9929.50 | 7502.44 | 7691.33 | 8679.32 | 8563.22 | 9034.26 | 10027.44 | 7270.63 | 8773.58 | 9332.95 | 10166.32 | |
| ribose-5-phosphate | 222.47 | 254.94 | 252.97 | 226.22 | 248.59 | 260.22 | 283.95 | 267.88 | 233.74 | 242.97 | 250.89 | 218.16 | |
| ribulose-5-phosphate | 200.12 | 186.06 | 177.62 | 206.06 | 184.44 | 174.56 | 203.68 | 196.25 | 212.42 | 206.58 | 207.16 | 197.55 | |
| saccharic acid | 467.85 | 438.11 | 513.82 | 473.33 | 448.97 | 406.39 | 546.05 | 473.56 | 492.00 | 445.64 | 405.26 | 387.45 | |
| sarcosine | 70181.12 | 73445.61 | 62632.62 | 65556.89 | 75667.50 | 72096.72 | 63835.21 | 68494.69 | 77298.26 | 77104.42 | 73885.05 | 72414.58 | |
| serine | 326855.85 | 273527.00 | 394831.56 | 308428.50 | 287457.26 | 265179.22 | 285524.11 | 208322.72 | 323105.68 | 297751.61 | 250766.53 | 233756.81 | |
| serotonin | 1252.68 | 1818.06 | 1848.50 | 2876.22 | 2914.97 | 1659.28 | 2097.89 | 2913.97 | 2313.79 | 5276.82 | 6079.47 | 2511.65 | |
| shikimic acid | 2906.62 | 2676.44 | 2224.56 | 3004.33 | 3050.79 | 1770.00 | 3142.11 | 1937.28 | 1546.21 | 3015.30 | 3036.26 | 2791.94 | |
| sophorose | 759.12 | 1234.56 | 798.62 | 831.06 | 859.32 | 678.00 | 845.21 | 989.97 | 651.37 | 725.30 | 829.42 | 746.87 | |
| sorbitol | 7944.71 | 9339.72 | 5493.62 | 6171.00 | 7822.06 | 6353.39 | 13511.16 | 13508.06 | 5880.68 | 6068.55 | 9031.95 | 6519.87 | |
| spermidine | 2943.53 | 3356.61 | 4672.35 | 3892.83 | 1959.35 | 2500.89 | 3758.26 | 4039.91 | 4683.95 | 3826.09 | 2225.79 | 2234.48 | |
| squalene | 1472.38 | 1494.94 | 1447.91 | 1688.17 | 1728.44 | 1410.39 | 1570.47 | 1489.69 | 2112.21 | 1579.03 | 1604.53 | 1562.45 | |
| stearic acid | 1314430.35 | 1705568.39 | 1514412.56 | 1630550.94 | 992908.65 | 1204552.44 | 1569948.05 | 1786907.19 | 1687503.05 | 1599016.61 | 992733.05 | 1222278.23 | |
| succinate semialdehyde | 1446.03 | 1808.33 | 1873.26 | 1888.72 | 1642.32 | 1900.44 | 1903.84 | 1851.22 | 1949.26 | 1849.79 | 1677.16 | 1872.00 | |
| succinic acid | 3728.06 | 4107.94 | 4121.09 | 4062.11 | 3718.74 | 3745.00 | 4045.47 | 3830.94 | 5174.63 | 4325.00 | 3196.89 | 3868.84 | |
| sucrose | 508.32 | 457.72 | 384.71 | 1123.17 | 479.94 | 452.67 | 433.05 | 586.88 | 454.00 | 426.00 | 419.00 | 453.13 | |
| tagatose | 4632.76 | 5709.56 | 3258.68 | 3277.61 | 3094.97 | 3147.17 | 3552.42 | 3707.28 | 3361.53 | 4008.27 | 2133.16 | 2323.71 | |
| taurine | 186.12 | 208.72 | 177.06 | 172.61 | 180.26 | 173.83 | 227.63 | 240.94 | 285.00 | 158.09 | 165.05 | 163.10 | |
| threitol | 2640.35 | 2482.11 | 2428.06 | 1903.89 | 2054.82 | 2163.11 | 2653.53 | 2392.41 | 1924.42 | 1655.70 | 1814.89 | 1844.23 | |
| threonic acid | 4639.59 | 4598.94 | 4841.82 | 4280.17 | 5071.94 | 5806.06 | 5741.47 | 4297.12 | 4310.68 | 3744.33 | 4240.95 | 4046.42 | |
| threonine | 54660.91 | 45060.67 | 69572.91 | 50653.00 | 66265.94 | 52767.78 | 51094.89 | 40310.34 | 50500.58 | 44562.70 | 57897.89 | 49209.87 | |
| thymidine | 2394.59 | 2512.44 | 2552.12 | 2322.61 | 1676.18 | 2299.56 | 2638.53 | 2263.09 | 2095.74 | 2199.15 | 1871.05 | 1962.29 | |
| thymine | 876.50 | 809.56 | 791.50 | 732.11 | 505.41 | 698.28 | 901.74 | 807.19 | 707.00 | 586.24 | 502.11 | 593.35 | |
| tocopherol alpha- | 9690.94 | 12710.33 | 12798.82 | 10111.17 | 17326.41 | 18460.50 | 9660.32 | 11308.84 | 11992.89 | 10344.36 | 14649.47 | 17464.90 | |
| trans-4-hydroxyproline | 44520.97 | 54018.72 | 49965.74 | 58944.22 | 39351.26 | 50792.28 | 43708.68 | 50110.25 | 38748.16 | 48318.67 | 35185.58 | 49544.29 | |
| trehalose | 4001.65 | 4256.39 | 3262.94 | 6374.39 | 1551.44 | 1388.56 | 3094.47 | 7297.50 | 2523.42 | 2342.39 | 1063.26 | 1399.26 | |
| tryptophan | 102598.82 | 64543.28 | 153908.26 | 128441.78 | 157570.91 | 138198.28 | 93815.42 | 64011.44 | 137485.32 | 120096.58 | 139028.37 | 140932.94 | |
| tryptophol | 27604.26 | 31156.89 | 23285.35 | 25845.00 | 28378.88 | 29605.56 | 31414.53 | 30905.50 | 26063.21 | 26178.30 | 26325.16 | 29627.35 | |
| tyrosine | 153328.15 | 158609.33 | 174445.53 | 148404.28 | 231480.79 | 213481.78 | 158308.95 | 156756.12 | 151124.74 | 141548.76 | 211862.47 | 208824.77 | |
| tyrosol | 367.41 | 482.67 | 357.65 | 422.06 | 342.62 | 329.83 | 351.05 | 359.06 | 336.95 | 346.27 | 340.95 | 373.61 | |
| UDP GlcNAc | 215.38 | 230.00 | 222.53 | 220.78 | 246.12 | 223.39 | 241.26 | 229.75 | 220.63 | 229.85 | 233.58 | 243.42 | |
| undecanoic acid | 19630.50 | 24625.33 | 26853.85 | 21815.61 | 18880.62 | 18127.33 | 22122.95 | 21556.44 | 22369.00 | 17968.73 | 21226.37 | 15776.29 | |
| uracil | 1224.21 | 1248.56 | 1274.09 | 1027.72 | 904.41 | 994.44 | 1197.95 | 1071.78 | 1117.32 | 915.09 | 873.11 | 925.77 | |
| urea | 2070885.03 | 2018465.94 | 2020238.74 | 1999791.22 | 2119210.24 | 1999581.28 | 2070448.05 | 2062442.38 | 1941608.89 | 2013417.73 | 1847651.32 | 2026048.35 | |
| uric acid | 9953.35 | 10866.11 | 11948.41 | 10362.44 | 8733.91 | 9623.06 | 11476.95 | 11459.66 | 12294.58 | 11646.18 | 7233.79 | 8526.52 | |
| uridine | 1200.06 | 1196.94 | 1840.88 | 1428.22 | 894.97 | 857.11 | 1116.68 | 1188.25 | 1463.42 | 1232.06 | 893.32 | 924.23 | |
| urocanic acid | 333.32 | 349.11 | 320.71 | 312.83 | 332.85 | 321.11 | 372.05 | 318.97 | 373.00 | 326.33 | 342.68 | 320.77 | |
| valine | 743019.68 | 667494.89 | 1123620.18 | 1037606.17 | 1040951.91 | 947993.72 | 660993.42 | 616650.81 | 934440.63 | 889035.24 | 893260.21 | 879997.65 | |
| xanthine | 201.53 | 233.72 | 237.12 | 242.72 | 330.03 | 235.11 | 230.63 | 234.12 | 231.21 | 271.48 | 305.37 | 247.32 | |
| xanthosine | 271.18 | 242.33 | 266.85 | 277.72 | 271.06 | 225.83 | 275.05 | 293.75 | 241.32 | 258.24 | 211.68 | 230.94 | |
| xylitol | 9428.94 | 12113.83 | 14274.79 | 18966.94 | 8408.62 | 9374.94 | 11925.16 | 12065.22 | 17957.89 | 20116.76 | 8241.21 | 8694.26 | |
| xylose | 13259.91 | 14342.11 | 11896.03 | 10942.83 | 8180.35 | 9605.56 | 14121.16 | 13349.66 | 11265.63 | 9990.88 | 7591.95 | 8697.87 | |
| xylulose | 1680.53 | 1746.44 | 2054.18 | 1633.56 | 1819.21 | 1863.33 | 1786.42 | 1889.03 | 1854.16 | 1867.15 | 1670.11 | 1933.55 |
Factors:
| F1 | Group:Con | Time:Calving | Parity:Mult |
| F2 | Group:Con | Time:Calving | Parity:Prim |
| F3 | Group:Con | Time:Diagnosis | Parity:Mult |
| F4 | Group:Con | Time:Diagnosis | Parity:Prim |
| F5 | Group:Con | Time:Prepartum | Parity:Mult |
| F6 | Group:Con | Time:Prepartum | Parity:Prim |
| F7 | Group:Met | Time:Calving | Parity:Mult |
| F8 | Group:Met | Time:Calving | Parity:Prim |
| F9 | Group:Met | Time:Diagnosis | Parity:Mult |
| F10 | Group:Met | Time:Diagnosis | Parity:Prim |
| F11 | Group:Met | Time:Prepartum | Parity:Mult |
| F12 | Group:Met | Time:Prepartum | Parity:Prim |
