Data for ST002688
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1-methyladenosine | 15036.00 | 12294.60 | 14929.00 | 15161.25 | 19519.62 | 13580.20 | 22370.20 | 13581.60 | 10860.20 | 11766.20 | 11681.40 | 16065.00 | 18387.00 | |
| 1-methylhistamine | 26409.20 | 80551.00 | 55894.00 | 55898.50 | 19669.88 | 27147.40 | 67715.40 | 41241.40 | 75176.60 | 38663.60 | 67577.00 | 29828.00 | 119232.40 | |
| 1-methylnicotinamide | 301180.60 | 257484.80 | 285261.00 | 284150.25 | 172895.75 | 338546.40 | 277532.20 | 337146.80 | 204222.40 | 293466.20 | 239683.60 | 292420.60 | 331464.60 | |
| 21-deoxycortisol | 5307.00 | 5399.60 | 6714.00 | 5475.50 | 43805.75 | 5471.00 | 24158.00 | 6861.33 | 12345.60 | 6184.80 | 7919.67 | 4554.75 | 14974.20 | |
| 2-aminoisobutyrate | 2628745.00 | 1604606.00 | 2209878.00 | 2206839.50 | 1091451.75 | 3412303.20 | 1775751.20 | 4103838.40 | 1708362.60 | 1883216.80 | 1488112.20 | 2000402.80 | 1809231.00 | |
| 2^-deoxycytidine | 337675.20 | 452282.60 | 424604.00 | 423738.25 | 376320.38 | 376112.60 | 504104.40 | 421337.80 | 426253.00 | 354457.60 | 374754.20 | 375797.80 | 602731.00 | |
| 3-methylhistidine | 32702.80 | 99348.60 | 74808.00 | 75385.75 | 75880.25 | 38134.40 | 106208.00 | 45808.00 | 90855.80 | 37553.80 | 88639.40 | 38752.40 | 178993.80 | |
| 4-aminohippurate | 1946.40 | 458.00 | 1214.00 | 1279.00 | 2980.12 | 1441.20 | 237.80 | 2271.40 | 490.20 | 1863.40 | 333.00 | 1955.00 | 897.60 | |
| 4-guanidinobutanoate | 10693.40 | 12191.80 | 11822.00 | 12236.75 | 49742.38 | 7033.80 | 16988.00 | 10011.00 | 11724.40 | 7949.60 | 9022.60 | 12596.40 | 29856.20 | |
| 4-pyridoxate | 8090.00 | 7011.60 | 6864.00 | 6956.75 | 41669.75 | 6266.80 | 5724.20 | 6910.20 | 5457.80 | 9338.20 | 4598.20 | 7978.40 | 10403.80 | |
| 5-methylcytidine | 97806.80 | 111478.60 | 114738.00 | 111725.00 | 93389.88 | 102201.40 | 125570.40 | 110874.40 | 107091.20 | 106782.00 | 94345.40 | 107048.60 | 154613.80 | |
| 5-methylcytosine | 32915.80 | 20783.20 | 35782.00 | 34802.25 | 11535.62 | 34057.60 | 32246.20 | 42013.80 | 19245.80 | 38794.40 | 23275.00 | 48936.80 | 61900.00 | |
| 7-methylguanine | 10005.00 | 8031.60 | 9755.00 | 9432.00 | 17969.62 | 9041.80 | 9837.00 | 12007.20 | 7549.20 | 10985.00 | 7026.20 | 10492.40 | 13297.00 | |
| acetylcholine | 2244.60 | 3054.80 | 3209.00 | 3307.50 | 2713.88 | 3187.60 | 2052.20 | 4145.00 | 3194.20 | 5315.60 | 1616.40 | 5875.80 | 3793.80 | |
| acisoga | 2865.20 | 3539.20 | 3114.00 | 3041.75 | 7817.38 | 3478.80 | 2700.00 | 4029.40 | 2301.20 | 3224.40 | 1731.80 | 3071.60 | 3781.80 | |
| adenosine | 2357150.60 | 1699495.80 | 2259595.00 | 2282486.25 | 2161996.50 | 3431530.60 | 2275443.80 | 3686298.00 | 2013063.80 | 2622780.60 | 1360236.60 | 3417180.00 | 1978091.20 | |
| ADMA | 2525032.60 | 2100530.80 | 2686888.00 | 2690907.00 | 2138690.12 | 2435950.40 | 4517765.00 | 3138770.20 | 2163881.20 | 2354615.80 | 1708705.20 | 4265530.20 | 3510586.00 | |
| ala-ala | 2382.00 | 1838.00 | 2554.00 | 2465.00 | 2712.38 | 2730.00 | 2376.00 | 2552.40 | 2377.00 | 1243.80 | 4327.80 | 2209.80 | 3094.60 | |
| alanine | 120773.80 | 290620.00 | 248815.00 | 249824.00 | 164163.12 | 139391.40 | 325018.40 | 147630.60 | 305459.40 | 150251.60 | 259069.00 | 182445.20 | 584799.00 | |
| allantoin | 43847.80 | 46873.20 | 47555.00 | 48465.75 | 107208.75 | 46253.40 | 49485.80 | 53329.20 | 42467.60 | 50133.60 | 40747.00 | 49997.60 | 69239.00 | |
| alpha-glycerophosphocholine | 15917235.80 | 31693968.60 | 32951758.00 | 32832818.25 | 14966070.62 | 27326798.80 | 37305609.00 | 23178564.80 | 38039406.60 | 22317137.20 | 30945265.40 | 24401722.20 | 65910946.80 | |
| anserine | 472978.80 | 197481.80 | 552237.00 | 551363.25 | 424990.12 | 246131.80 | 1050762.80 | 490080.00 | 561770.80 | 421160.80 | 112543.00 | 2737169.20 | 178646.40 | |
| arachidoyl ethanolamide | 9919.75 | 11929.20 | 6549.00 | 5591.75 | 17746.25 | 3023.00 | 5748.75 | 4858.50 | 6346.00 | 4869.25 | 5561.33 | 6045.40 | 15924.60 | |
| arginine | 402193.60 | 862678.00 | 757171.00 | 749731.25 | 740602.12 | 494820.40 | 870666.40 | 628969.20 | 652411.40 | 562965.80 | 676074.00 | 562605.60 | 2156764.20 | |
| asparagine | 46025.80 | 75348.00 | 68211.00 | 68414.00 | 59763.00 | 45373.80 | 88042.60 | 50710.20 | 71742.20 | 47396.00 | 65116.60 | 57725.80 | 140287.60 | |
| aspartate | 159676.00 | 105516.80 | 147121.00 | 148015.00 | 40630.75 | 88467.40 | 344065.20 | 92040.40 | 105308.00 | 87288.00 | 86101.00 | 244573.80 | 182980.40 | |
| beta-alanine | 7548227.00 | 12314783.60 | 11154210.00 | 11249590.75 | 6781443.25 | 7687498.80 | 16045882.60 | 8688354.60 | 12207980.20 | 7715131.00 | 9680790.20 | 10287934.80 | 21727582.60 | |
| beta-guanidinopropionate | 10896.60 | 11737.00 | 12886.00 | 12715.25 | 7365.75 | 12001.00 | 18827.20 | 13932.40 | 11793.40 | 11294.20 | 8750.80 | 15399.00 | 17524.00 | |
| betaine | 10916834.40 | 10696990.00 | 12330704.00 | 12234951.75 | 10027291.00 | 10819299.60 | 14603765.80 | 12461380.40 | 10710397.00 | 11554341.00 | 8462424.00 | 14123638.20 | 15142489.00 | |
| biliverdin | 246251.00 | 415340.60 | 391176.00 | 383342.25 | 237157.83 | 212916.60 | 654986.00 | 269216.60 | 326651.80 | 173868.60 | 198581.80 | 308991.80 | 683357.00 | |
| biopterin | 590.25 | 1483.60 | 1271.00 | 1360.75 | 2182.12 | 1154.20 | 1794.80 | 1022.60 | 1143.00 | 1174.20 | 1071.20 | 658.00 | 3660.80 | |
| biotin | 4706.00 | 3878.80 | 4807.00 | 4766.25 | 740.12 | 4664.00 | 3100.80 | 5403.80 | 3339.60 | 5385.40 | 2439.40 | 4296.00 | 5388.60 | |
| butyrobetaine | 295442.80 | 307323.60 | 351202.00 | 348556.25 | 216877.75 | 280597.40 | 445583.80 | 319192.80 | 291373.40 | 276886.00 | 258980.00 | 387522.60 | 647135.80 | |
| C10 carnitine | 27225.00 | 172881.60 | 93000.00 | 92275.00 | 44717.88 | 41728.20 | 130448.80 | 37480.20 | 141363.80 | 34623.40 | 89608.00 | 37904.20 | 225642.20 | |
| C12:1 carnitine | 11838.00 | 11790.80 | 12727.00 | 12994.50 | 15528.25 | 17874.80 | 11898.60 | 15654.80 | 11278.60 | 15183.80 | 6144.60 | 14294.20 | 15841.80 | |
| C12 carnitine | 58517.40 | 92807.40 | 77320.00 | 77157.00 | 65948.88 | 75938.00 | 84359.80 | 69059.60 | 82979.80 | 72838.40 | 53868.00 | 66438.00 | 127967.80 | |
| C14:0 LPC | 27599.00 | 34477.60 | 35753.00 | 36607.25 | 41738.88 | 23550.00 | 40213.40 | 26957.00 | 30159.20 | 34105.40 | 35420.20 | 34573.80 | 78743.00 | |
| C14:0 SM | 4433.33 | 31615.20 | 10899.00 | 10913.25 | 66086.38 | 6265.80 | 24925.80 | 6211.00 | 17947.20 | 4500.60 | 10225.40 | 7604.50 | 79497.00 | |
| C14:1 carnitine | 112268.00 | 126804.20 | 130693.00 | 130159.00 | 121086.25 | 168185.20 | 129480.00 | 151481.60 | 129665.40 | 139024.20 | 82513.40 | 133816.40 | 184583.20 | |
| C14:2 carnitine | 21846.00 | 27208.00 | 27158.00 | 26734.25 | 43828.00 | 31629.60 | 25764.60 | 29720.00 | 24807.60 | 29455.60 | 16276.80 | 28516.60 | 41256.00 | |
| C14 carnitine | 193843.80 | 203453.00 | 213916.00 | 210125.25 | 193366.88 | 263247.80 | 210850.20 | 226887.20 | 220381.80 | 219062.80 | 142120.40 | 212593.60 | 317860.80 | |
| C16:0 Ceramide (d18:1) | 3249631.20 | 2929608.80 | 3117526.00 | 3146210.00 | 3453360.38 | 3443767.80 | 2687288.80 | 3456107.40 | 2657942.20 | 3109619.40 | 2381774.60 | 2875212.00 | 2510489.00 | |
| C16:0 LPC | 7424505.00 | 12230134.20 | 11038122.00 | 11000492.75 | 9207119.50 | 7936037.80 | 13164260.80 | 8673492.60 | 11892684.80 | 9436908.60 | 11780552.20 | 8629779.00 | 20652591.00 | |
| C16:0 LPE | 144221.40 | 183331.60 | 176082.00 | 175500.00 | 123595.75 | 163067.60 | 212862.00 | 161203.60 | 176737.60 | 162224.00 | 162337.20 | 168563.60 | 281588.00 | |
| C16:0 SM | 22928977.40 | 28349058.40 | 27594880.00 | 27577074.00 | 24790783.25 | 31910894.20 | 32309676.00 | 30466560.40 | 30048310.60 | 26728875.60 | 27945795.60 | 23138135.40 | 36821854.80 | |
| C16:1 LPC | 86636.40 | 113707.00 | 111661.00 | 110559.25 | 116739.88 | 70372.20 | 110849.40 | 71940.20 | 85838.60 | 96450.00 | 110243.40 | 102727.60 | 320850.00 | |
| C16:1 LPC plasmalogen | 6188.00 | 15642.40 | 14531.00 | 14388.25 | 46106.12 | 11865.40 | 16877.40 | 11002.20 | 16370.80 | 10652.80 | 14151.00 | 6485.00 | 26710.40 | |
| C16:1 SM | 1654261.00 | 1670512.20 | 1745095.00 | 1719384.00 | 1719781.00 | 2086005.20 | 2059054.20 | 1925214.20 | 1892618.00 | 1812439.20 | 1893817.80 | 1452798.40 | 1994461.40 | |
| C16 carnitine | 715666.60 | 849737.20 | 939568.00 | 933273.00 | 798713.62 | 1075972.40 | 933870.60 | 909068.20 | 1095361.20 | 779306.20 | 716998.60 | 811590.80 | 1470119.40 | |
| C16-OH carnitine | 5197.00 | 4805.20 | 5908.00 | 5334.00 | 5891.38 | 9772.80 | 5975.80 | 7939.20 | 5513.80 | 6663.20 | 2396.40 | 6873.20 | 8905.40 | |
| C18:0 LPC | 7050372.60 | 6871849.60 | 7959759.00 | 8073522.50 | 8166788.38 | 8435844.80 | 8184371.20 | 9584510.60 | 7353681.00 | 9074273.00 | 7577966.40 | 7025919.20 | 9913696.40 | |
| C18:0 LPE A | 361422.00 | 461130.80 | 461930.00 | 468116.75 | 308049.75 | 422846.40 | 567292.40 | 425618.00 | 463647.20 | 386973.60 | 459969.60 | 439573.20 | 715118.60 | |
| C18:0 LPE B | 39560.60 | 69500.20 | 59560.00 | 58617.00 | 72612.75 | 41153.00 | 75061.80 | 42736.80 | 60260.60 | 48615.80 | 65052.00 | 48787.80 | 143202.40 | |
| C18:0 SM | 3792378.40 | 4317544.20 | 4343225.00 | 4269570.75 | 4294036.00 | 4528247.40 | 4263970.00 | 4956067.40 | 4058434.00 | 4916884.40 | 3855314.40 | 5016479.00 | 4981915.20 | |
| C18:1 carnitine | 712838.40 | 815361.60 | 1013552.00 | 992500.50 | 926310.75 | 1255450.40 | 1002232.80 | 1010001.20 | 1239551.00 | 803327.20 | 730833.00 | 844390.80 | 1422757.60 | |
| C18:1 LPC | 580396.20 | 691468.60 | 730541.00 | 739921.25 | 854790.38 | 573555.20 | 728002.60 | 672825.60 | 692159.60 | 808232.00 | 701105.80 | 670935.80 | 1305902.60 | |
| C18:1 LPC plasmalogen A | 39352.60 | 52513.40 | 47198.00 | 48201.00 | 51719.88 | 33554.60 | 65474.00 | 40541.40 | 39080.40 | 40782.40 | 31930.60 | 42557.00 | 108858.80 | |
| C18:1 LPC plasmalogen B | 7445.80 | 14555.60 | 12490.00 | 12389.25 | 17768.38 | 10481.60 | 14156.20 | 11786.20 | 10970.40 | 10584.20 | 9589.00 | 7440.60 | 30482.00 | |
| C18:1 LPE | 56094.80 | 91597.80 | 76977.00 | 77992.75 | 108607.75 | 66477.60 | 80348.40 | 70492.80 | 76003.00 | 89701.80 | 59466.20 | 73223.00 | 117796.60 | |
| C18:1-OH carnitine | 8215.00 | 6866.60 | 8863.00 | 9253.00 | 8178.12 | 16861.00 | 7991.00 | 13001.00 | 7766.40 | 10684.00 | 3031.60 | 11403.40 | 13280.60 | |
| C18:1 SM | 840513.00 | 960259.40 | 919237.00 | 904811.00 | 785932.88 | 970091.20 | 961432.40 | 992168.80 | 905292.00 | 1009333.40 | 869236.00 | 889793.80 | 1211264.20 | |
| C18:2 carnitine | 270066.60 | 312322.40 | 395133.00 | 395060.50 | 499019.00 | 487458.40 | 363694.80 | 376749.60 | 454529.60 | 305537.20 | 274661.60 | 348418.40 | 595444.00 | |
| C18:2 LPC | 1233839.80 | 1252215.00 | 1487439.00 | 1473330.50 | 1823953.50 | 1062056.20 | 1436111.60 | 1329253.00 | 1322434.00 | 1613422.20 | 1610606.20 | 1464820.00 | 2780337.40 | |
| C18:2 LPE | 8747.40 | 9288.40 | 9919.00 | 10269.00 | 15726.38 | 7325.00 | 10372.80 | 8327.60 | 8237.80 | 12770.00 | 10496.80 | 11201.60 | 18085.80 | |
| C18:3 LPC | 411581.40 | 740459.60 | 665402.00 | 659621.25 | 664225.12 | 491016.40 | 683824.40 | 523636.00 | 729378.60 | 589573.20 | 732522.80 | 493251.00 | 1125544.40 | |
| C18:3 LPE | 11963.00 | 14914.40 | 15281.00 | 14973.00 | 10704.50 | 14113.00 | 17498.80 | 13522.00 | 14991.40 | 13418.00 | 13632.20 | 14197.80 | 20406.20 | |
| C18 carnitine | 306963.40 | 383823.40 | 422015.00 | 412140.00 | 392973.00 | 490705.20 | 450509.20 | 434858.40 | 489956.80 | 338503.00 | 382978.20 | 305432.00 | 550009.00 | |
| C20:0 LPE | 141645.60 | 205180.20 | 199161.00 | 201933.50 | 204669.38 | 165056.00 | 232338.80 | 179833.00 | 206869.20 | 176390.60 | 223259.00 | 154813.20 | 326719.00 | |
| C20:0 SM | 887427.80 | 929381.00 | 981391.00 | 948972.75 | 843450.50 | 999826.80 | 870570.40 | 1049347.00 | 787954.60 | 1112611.20 | 823173.60 | 1179221.20 | 1082395.20 | |
| C20:1 LPC | 12032.80 | 11932.40 | 13461.00 | 14573.00 | 44093.88 | 11225.80 | 16209.20 | 11421.20 | 12157.60 | 17535.40 | 15459.60 | 15542.40 | 23893.80 | |
| C20:3 LPC | 2233319.60 | 2033832.80 | 2224892.00 | 2247914.50 | 5955170.38 | 2734302.00 | 2306739.00 | 3369989.40 | 1938577.80 | 3256832.40 | 2306865.00 | 1972011.60 | 2901070.20 | |
| C20:4 carnitine | 80522.20 | 122239.60 | 111871.00 | 111208.00 | 230275.75 | 114682.20 | 96462.00 | 115303.60 | 110507.20 | 107592.20 | 54224.60 | 94082.40 | 192070.20 | |
| C20:4 LPC A | 578103.80 | 695049.60 | 693964.00 | 700425.25 | 1132061.12 | 561408.00 | 725953.80 | 788877.80 | 739327.00 | 774826.20 | 750769.80 | 511421.20 | 957554.60 | |
| C20:4 LPC B | 231645.60 | 305895.20 | 284134.00 | 280576.25 | 528744.38 | 218908.00 | 356489.20 | 254932.20 | 300854.00 | 287904.60 | 342348.20 | 218446.00 | 455484.00 | |
| C20:4 LPE | 123754.80 | 212013.20 | 188966.00 | 190765.50 | 241984.00 | 171674.20 | 192813.00 | 169937.20 | 161399.40 | 185393.40 | 200261.00 | 143213.80 | 338615.60 | |
| C20:5 LPC | 58898.60 | 59384.60 | 73703.00 | 72924.25 | 108734.25 | 54139.20 | 61064.20 | 64275.20 | 60066.40 | 87836.40 | 80913.00 | 68937.20 | 130555.20 | |
| C20 carnitine | 10760.00 | 13857.20 | 14004.00 | 15153.50 | 13052.62 | 14091.40 | 12957.20 | 17880.60 | 13338.80 | 13073.80 | 9700.40 | 11321.20 | 22164.80 | |
| C22:0 SM | 1082228.80 | 1398959.40 | 1316282.00 | 1269972.00 | 1204841.38 | 1208513.20 | 1275145.00 | 1216387.20 | 1214788.40 | 1285272.60 | 1331294.80 | 1400707.60 | 1654531.00 | |
| C22:1 SM | 1519639.60 | 1884250.00 | 1815857.00 | 1750590.75 | 1255695.75 | 1570494.40 | 1915681.20 | 1530051.00 | 1779222.60 | 1777412.40 | 1995257.80 | 1779865.20 | 2652227.40 | |
| C22:6 LPE | 10338.80 | 18022.20 | 14995.00 | 14551.25 | 20946.25 | 10477.60 | 12408.00 | 11288.20 | 7303.60 | 14891.20 | 10881.40 | 14388.80 | 29754.40 | |
| C24:0 LPC | 23041.80 | 19742.00 | 23112.00 | 23400.75 | 26377.75 | 23991.20 | 25442.80 | 23061.80 | 16438.00 | 21236.60 | 14939.60 | 26114.00 | 33787.60 | |
| C24:1 ceramide (d18:1) | 2325643.40 | 2573116.60 | 2537602.00 | 2526159.50 | 4118726.00 | 2103711.20 | 2453450.80 | 2291940.20 | 2624918.40 | 2155887.40 | 2124416.60 | 2422846.20 | 2623189.40 | |
| C2 carnitine | 20502176.60 | 20242750.60 | 20658541.00 | 20362387.75 | 16993721.00 | 21652358.40 | 23786989.40 | 23392706.40 | 17949087.60 | 19218737.60 | 14279906.60 | 20678170.60 | 23927521.80 | |
| C30:0 PC | 2657857.80 | 1880211.60 | 2379746.00 | 2308210.75 | 1389790.12 | 1596911.80 | 4646214.60 | 1797135.80 | 1612747.40 | 1804837.00 | 1383552.80 | 3004819.80 | 3367565.00 | |
| C32:2 PC | 560418.40 | 516068.60 | 589638.00 | 583072.75 | 308972.50 | 481761.40 | 744625.80 | 460041.40 | 449661.00 | 444051.00 | 435764.60 | 657748.40 | 774768.60 | |
| C34:0 PE | 1496053.00 | 1295955.00 | 1482409.00 | 1472864.25 | 1121247.50 | 1228232.00 | 1849208.20 | 1293699.80 | 1127295.00 | 1248808.20 | 1117879.40 | 1852563.00 | 2093934.60 | |
| C34:1 DAG | 102392.80 | 160818.20 | 128439.00 | 128756.00 | 263094.25 | 154572.40 | 206704.20 | 128512.60 | 204746.60 | 101575.20 | 196069.20 | 82401.20 | 128904.20 | |
| C34:2 PE | 2638946.00 | 2097231.20 | 2534809.00 | 2494562.50 | 1752129.38 | 2766936.60 | 2681269.80 | 2571913.80 | 2235444.00 | 2717946.00 | 2708672.00 | 2552413.40 | 2013442.60 | |
| C34:2 PE plasmalogen | 1350067.80 | 1853477.40 | 1624051.00 | 1645779.50 | 1672946.75 | 1285320.20 | 1720428.40 | 1496325.00 | 1872880.00 | 1531407.60 | 1546831.40 | 1305928.00 | 2373834.20 | |
| C34:3 PC | 5027309.80 | 4855587.40 | 5381617.00 | 5380385.25 | 3897767.62 | 5173504.00 | 5357474.60 | 4956644.80 | 4756210.80 | 5074447.00 | 4733094.00 | 5839191.80 | 5884171.80 | |
| C34:3 PC plasmalogen | 349868.60 | 407481.20 | 486093.00 | 482185.25 | 340188.88 | 489649.20 | 458445.60 | 458755.80 | 458235.40 | 438007.40 | 479325.20 | 445115.80 | 800632.60 | |
| C34:3 PE plasmalogen | 477569.80 | 474064.40 | 508527.00 | 505841.00 | 476334.38 | 510658.60 | 467867.80 | 546343.00 | 471086.40 | 577207.40 | 484332.00 | 488677.80 | 632089.60 | |
| C36:2 PC | 92916771.60 | 86561667.20 | 95101650.00 | 93774708.75 | 74405664.00 | 103108052.60 | 93749596.00 | 96453428.00 | 91317533.00 | 103342038.40 | 104165209.00 | 95358661.40 | 100780260.00 | |
| C36:2 PE | 5459869.40 | 5157576.80 | 5564182.00 | 5617728.50 | 4794835.88 | 6039481.80 | 5688258.20 | 5669040.40 | 5420141.60 | 6064655.40 | 6207765.40 | 5826042.20 | 5326063.40 | |
| C36:2 PS plasmalogen | 10867.60 | 8955.60 | 10042.00 | 7278.25 | 16207.00 | 5947.00 | 8814.40 | 5686.00 | 5287.40 | 8287.00 | 3064.60 | 10998.00 | 21332.20 | |
| C36:3 PE plasmalogen | 1666785.00 | 1379024.40 | 1624654.00 | 1614853.25 | 2646350.75 | 1586508.40 | 1244456.40 | 2117789.00 | 1342759.60 | 2701444.60 | 820029.00 | 1697088.20 | 2037011.40 | |
| C36:4 PE | 2724131.40 | 2344481.80 | 2570425.00 | 2591673.50 | 1711215.75 | 2620150.60 | 3164626.00 | 2465476.00 | 2450803.80 | 2580863.00 | 2492223.80 | 2805347.40 | 2472642.80 | |
| C36:5 PC plasmalogen | 7865967.00 | 13332982.60 | 12062264.00 | 11869999.00 | 7773972.75 | 9686517.40 | 12177891.00 | 9544911.40 | 13093170.40 | 8861824.40 | 10974024.20 | 8076583.80 | 21381874.60 | |
| C36:5 PE plasmalogen | 10895742.60 | 11823038.00 | 11414691.00 | 11316347.00 | 8410015.50 | 11965087.00 | 12475681.80 | 11508053.40 | 11883343.80 | 10950958.80 | 11640364.60 | 10346169.20 | 13268098.20 | |
| C38:4 PE | 9801066.60 | 13805094.60 | 12253695.00 | 12179888.25 | 8390053.00 | 9164149.00 | 15550706.80 | 9019182.00 | 14413000.40 | 9107956.40 | 12762456.80 | 10525988.00 | 17151092.80 | |
| C38:5 PE plasmalogen | 10280581.80 | 11790021.80 | 11836566.00 | 11715269.75 | 10687297.50 | 11822836.60 | 12239945.80 | 11780015.80 | 11596401.20 | 11389234.20 | 10938729.20 | 11389533.20 | 15574447.80 | |
| C38:6 PC plasmalogen | 2818645.00 | 4158076.40 | 3918978.00 | 3833969.75 | 2108953.88 | 3031578.80 | 4234114.80 | 2990069.80 | 3781031.20 | 3039009.20 | 3207861.40 | 3281639.60 | 8171826.60 | |
| C38:6 PE | 951743.40 | 672055.40 | 837497.00 | 836267.50 | 613254.00 | 871548.60 | 900927.20 | 908247.80 | 699143.60 | 999765.80 | 755353.80 | 1160649.40 | 761754.20 | |
| C38:6 PE plasmalogen | 5619537.00 | 7508226.80 | 6926248.00 | 6850560.50 | 4810094.88 | 6099228.40 | 7548216.20 | 5947048.60 | 7367314.60 | 6144376.20 | 6707874.20 | 6260508.60 | 9774267.00 | |
| C38:7 PC plasmalogen | 817648.40 | 815006.20 | 919586.00 | 888739.00 | 599567.50 | 724953.40 | 915615.40 | 855480.20 | 785126.00 | 927798.20 | 711934.00 | 1187556.00 | 1430336.60 | |
| C38:7 PE plasmalogen | 2044077.00 | 1728035.80 | 1949944.00 | 1924648.75 | 1403462.25 | 1847427.20 | 2044449.00 | 1964906.20 | 1691222.60 | 2060006.80 | 1796022.00 | 2565244.20 | 2157373.20 | |
| C3 carnitine | 279777.80 | 346068.20 | 339358.00 | 334937.00 | 470809.88 | 217425.40 | 504646.20 | 266051.40 | 339153.20 | 254018.40 | 303407.80 | 285880.40 | 556300.20 | |
| C3-DC carnitine | 221752.40 | 183006.40 | 205192.00 | 200291.75 | 115780.62 | 234212.80 | 192465.80 | 249498.80 | 172524.60 | 228264.60 | 159679.60 | 230980.00 | 254204.20 | |
| C3-DC-CH3 carnitine | 1769.80 | 4085.20 | 2739.00 | 2740.75 | 2893.25 | 1164.60 | 4319.20 | 2066.80 | 2357.20 | 2687.60 | 1653.00 | 4385.60 | 3496.20 | |
| C40:6 PE | 872921.20 | 605385.40 | 789667.00 | 769559.25 | 582211.12 | 709913.80 | 869536.60 | 816576.00 | 614799.80 | 889618.60 | 630353.60 | 1311580.60 | 722065.20 | |
| C40:7 PE plasmalogen | 1764711.60 | 1413167.20 | 1708299.00 | 1684516.00 | 1474565.12 | 1620664.40 | 1774632.60 | 1841923.60 | 1372793.80 | 1873608.60 | 1367814.40 | 2305130.40 | 1765837.00 | |
| C4 carnitine | 675127.60 | 4481528.60 | 3780528.00 | 3777159.00 | 1557043.38 | 584423.00 | 6611076.80 | 558284.40 | 6553595.60 | 665906.60 | 4483457.40 | 1101826.80 | 11103124.60 | |
| C4-OH carnitine | 228835.40 | 324890.60 | 250660.00 | 243920.50 | 191315.12 | 253241.00 | 333217.80 | 249001.80 | 253716.40 | 156435.40 | 183274.20 | 192810.60 | 344694.40 | |
| C5:1 carnitine | 2066.40 | 3458.40 | 2764.00 | 2902.25 | 3409.38 | 1702.20 | 4497.20 | 1962.40 | 3462.40 | 1985.80 | 2476.00 | 2228.80 | 4833.20 | |
| C5 carnitine | 247025.40 | 345392.40 | 296299.00 | 295948.25 | 482188.25 | 108297.40 | 616046.20 | 136820.00 | 309387.20 | 164890.80 | 233642.20 | 265757.80 | 517418.20 | |
| C6 carnitine | 102057.00 | 1284472.20 | 991530.00 | 972526.25 | 271938.12 | 156317.00 | 1304082.20 | 135235.40 | 1466155.00 | 141193.60 | 1114031.20 | 211601.00 | 2267684.40 | |
| C7 carnitine | 1588.80 | 2357.40 | 2408.00 | 2498.00 | 2739.38 | 1868.60 | 3171.00 | 1847.00 | 2227.80 | 1576.80 | 1775.80 | 2024.60 | 4176.60 | |
| C8 carnitine | 24546.20 | 535611.20 | 281379.00 | 275279.25 | 69762.12 | 46303.20 | 415737.40 | 38036.40 | 476699.80 | 32067.60 | 312458.20 | 47979.80 | 848736.80 | |
| carnitine | 16827900.80 | 14692033.40 | 16293230.00 | 16069269.50 | 13752616.00 | 12158041.20 | 19892130.00 | 14292473.60 | 13157885.00 | 16372993.80 | 11857719.00 | 21917813.40 | 20393825.20 | |
| carnosine | 86223.20 | 32027.60 | 87474.00 | 87838.00 | 49560.38 | 41254.40 | 121679.00 | 85561.00 | 62971.00 | 56169.60 | 16258.60 | 485009.60 | 23062.80 | |
| cellobiose | - | 4287.40 | 4378.00 | 4271.00 | 377.75 | - | 7444.00 | 65.00 | 10634.75 | 291.00 | 7363.75 | 3180.00 | 24116.20 | |
| C-glycosyltryptophan | 9635.80 | 7485.00 | 9352.00 | 9198.25 | 5479.38 | 11329.20 | 8090.80 | 12606.40 | 6339.00 | 11282.60 | 5829.40 | 11604.20 | 11434.40 | |
| choline | 1473173.60 | 3481713.80 | 2340300.00 | 2306690.25 | 3786158.00 | 1873934.00 | 2497962.40 | 2039867.20 | 2017398.60 | 2027891.60 | 1752877.60 | 1712978.20 | 4508301.80 | |
| citrulline | 170222.20 | 178879.00 | 191939.00 | 192545.00 | 110983.00 | 171511.00 | 205160.80 | 205114.80 | 178122.80 | 180134.80 | 169485.20 | 190907.40 | 299200.40 | |
| cotinine N-oxide | 4839.00 | 10832.00 | 8489.00 | 8196.75 | 5250.00 | 6794.00 | 8717.00 | 6624.00 | 11686.00 | 7714.80 | 8138.60 | 4454.40 | 14887.20 | |
| creatine | 6273640.60 | 5140823.80 | 6812717.00 | 6778185.25 | 6894040.62 | 6049709.20 | 7017883.00 | 8214508.00 | 5887358.60 | 7167016.40 | 4557044.20 | 9206501.00 | 6675518.20 | |
| creatinine | 658197.80 | 645239.40 | 719495.00 | 726662.75 | 1140141.75 | 702607.20 | 612584.00 | 902317.20 | 552489.20 | 716953.80 | 569608.40 | 987333.40 | 858948.00 | |
| cyclohexylamine | 134403.60 | 103339.80 | 252613.00 | 255584.00 | 3852.62 | 301853.80 | 303800.00 | 433806.20 | 237206.40 | 431443.80 | 352672.40 | 159247.00 | 100541.80 | |
| cystine | 30401.80 | 21610.40 | 28450.00 | 29811.75 | 34934.00 | 34102.60 | 24013.40 | 43901.80 | 21992.60 | 32032.40 | 29345.20 | 34689.60 | 36250.00 | |
| cytidine | 110774.40 | 171679.60 | 133986.00 | 133348.50 | 156234.12 | 96875.60 | 204676.20 | 124132.40 | 125701.80 | 87927.20 | 106321.00 | 101089.40 | 249869.80 | |
| dimethylglycine | 42410.60 | 44590.20 | 46626.00 | 46509.50 | 46401.25 | 45535.80 | 53156.00 | 57255.80 | 45339.80 | 42309.80 | 41061.80 | 42938.40 | 57353.80 | |
| ectoine | 13510.20 | 16406.80 | 19942.00 | 19977.00 | 38416.75 | 29518.40 | 22307.40 | 30442.80 | 17604.20 | 13515.60 | 12673.80 | 16893.00 | 27073.00 | |
| GABA | 1108559.00 | 2387939.60 | 1822089.00 | 1810602.50 | 1031722.25 | 1222303.80 | 2662131.00 | 1237338.20 | 2436177.00 | 1151581.60 | 1906044.20 | 1096800.40 | 2884314.00 | |
| glutamate | 918829.00 | 656634.20 | 830574.00 | 822879.50 | 399349.38 | 791109.40 | 804861.00 | 842299.20 | 591775.00 | 770548.00 | 576444.40 | 1045645.40 | 799238.60 | |
| glutamine | 1276170.00 | 2373214.60 | 1971353.00 | 1956542.25 | 1644946.00 | 1335766.40 | 2729702.60 | 1447481.00 | 2247204.80 | 1325572.80 | 1797354.20 | 1519969.40 | 3657800.80 | |
| glutathione reduced | 662545.60 | 440071.20 | 365366.00 | 341717.50 | 1856045.62 | 733454.80 | 3303998.80 | 674918.60 | 1348616.60 | 259575.00 | 355739.20 | 944193.60 | 407710.60 | |
| glycine | 48024.80 | 56443.20 | 55043.00 | 55071.25 | 53484.88 | 49657.60 | 69232.60 | 55919.60 | 51104.00 | 50169.40 | 46335.40 | 54991.00 | 76159.00 | |
| glycocholate | 40507.20 | 26155.00 | 25883.00 | 25740.75 | 17335.25 | 36266.40 | 4386.00 | 25751.00 | 14376.80 | 40714.40 | 1317.00 | 42035.20 | 30654.00 | |
| guanidinoacetate | 5470.80 | 6156.00 | 5975.00 | 6017.25 | 9128.12 | 4828.20 | 8085.60 | 6181.00 | 5463.20 | 5073.00 | 5028.60 | 5548.40 | 9459.80 | |
| guanosine | 61128.80 | 89656.60 | 78566.00 | 78056.00 | 168854.50 | 98418.00 | 85367.80 | 105514.00 | 70532.40 | 70481.80 | 53544.80 | 83791.00 | 82546.40 | |
| hippurate | 15259.80 | 16036.20 | 12651.00 | 12258.00 | 48141.50 | 9262.60 | 6035.40 | 14477.60 | 11215.80 | 14874.80 | 10360.00 | 21580.60 | 25351.20 | |
| histamine | 11016736.20 | 20684593.80 | 17426369.00 | 17449224.50 | 8719186.75 | 11179977.40 | 17845090.60 | 14952705.20 | 20854681.80 | 14163242.20 | 16648879.80 | 11753657.40 | 27520290.40 | |
| histidine | 104722.60 | 177778.80 | 160419.00 | 161134.00 | 160577.38 | 116492.00 | 172148.80 | 131232.80 | 169606.20 | 130625.80 | 178069.80 | 130553.80 | 345424.80 | |
| hydroxyproline | 30235.20 | 51187.40 | 44785.00 | 44944.25 | 36792.75 | 35359.80 | 66828.20 | 38654.80 | 46174.40 | 30674.80 | 46619.40 | 34153.80 | 74139.40 | |
| hypotaurine | 62199.80 | 119506.80 | 104820.00 | 104644.00 | 40298.38 | 58460.60 | 146973.40 | 73856.20 | 125379.60 | 57650.00 | 84809.80 | 92432.00 | 246059.20 | |
| imidazoleacetate | 18439.40 | 54815.40 | 29618.00 | 29825.25 | 58835.00 | 24407.20 | 35846.80 | 25370.40 | 28983.20 | 29390.40 | 26260.00 | 18198.20 | 37916.20 | |
| imidazole propionate | 16757.80 | 28214.20 | 24612.00 | 24806.00 | 16200.62 | 15025.00 | 32942.20 | 18514.60 | 26572.00 | 18902.40 | 34288.00 | 16502.40 | 37941.00 | |
| inosine | 640967.40 | 1577110.40 | 1027321.00 | 997419.25 | 2969336.75 | 1105323.20 | 1060694.80 | 1250944.40 | 1103014.60 | 815328.80 | 557522.40 | 1016430.20 | 1093390.00 | |
| isoleucine | 53674638.40 | 62719323.80 | 61700679.00 | 61798939.00 | 57478976.50 | 53012224.40 | 68796035.40 | 64776718.80 | 58158647.60 | 54804824.20 | 54889003.80 | 57683617.20 | 115257678.60 | |
| kynurenate | 240133.60 | 104758.80 | 183642.00 | 182161.00 | 285431.50 | 181021.60 | 44918.00 | 352540.60 | 147945.20 | 376502.40 | 113289.20 | 209086.00 | 238044.80 | |
| L-alpha-glutamyl-L-Lysine | 2994.40 | 2482.80 | 3138.00 | 3206.50 | 2942.88 | 3450.00 | 2558.00 | 4598.80 | 2316.00 | 3684.80 | 2393.80 | 2916.40 | 4325.80 | |
| leucine | 82264069.60 | 111224719.60 | 103741808.00 | 102297981.50 | 93234054.00 | 80893220.40 | 115906523.20 | 97667673.80 | 96366066.60 | 85391748.60 | 95091910.60 | 89643542.80 | 204975979.00 | |
| linoleoyl ethanolamide | 145966.00 | 150098.40 | 115090.00 | 107779.00 | 164525.75 | 103065.60 | 108475.20 | 101381.20 | 113650.80 | 111746.60 | 110514.20 | 127538.20 | 156908.20 | |
| lysine | 326240.00 | 407440.80 | 432355.00 | 430880.75 | 460098.50 | 424084.60 | 434548.40 | 608297.20 | 369545.60 | 418093.00 | 410955.80 | 376736.60 | 928407.00 | |
| methionine | 71788.40 | 121368.00 | 112916.00 | 113467.50 | 114965.00 | 73962.60 | 134360.00 | 103178.60 | 116089.60 | 85658.20 | 109891.40 | 88468.00 | 253739.80 | |
| methionine sulfoxide | 1861.40 | 2133.60 | 2366.00 | 2225.00 | 9054.25 | 1562.00 | 4674.40 | 1867.60 | 2026.40 | 2182.00 | 2538.60 | 2093.60 | 4969.60 | |
| methylguanidine | 783.00 | 635.40 | 831.00 | 860.25 | 3759.00 | 837.60 | 714.00 | 1207.40 | 546.60 | 761.60 | 935.40 | 914.00 | 1180.80 | |
| methylimidazoleacetate | 3585.40 | 5810.60 | 6266.00 | 6339.50 | 8363.12 | 5911.80 | 6003.00 | 9120.00 | 5740.00 | 3969.20 | 5239.40 | 4077.00 | 13444.80 | |
| methylthioadenosine | 165120.20 | 407974.00 | 349812.00 | 365280.25 | 284648.25 | 265793.60 | 298888.80 | 246273.20 | 289415.40 | 227555.20 | 247845.60 | 270264.20 | 625018.60 | |
| N1-acetylspermidine | 143723.80 | 187904.20 | 177634.00 | 179472.00 | 104788.38 | 137168.00 | 263787.60 | 121635.40 | 156461.00 | 115080.80 | 152037.40 | 179224.20 | 342789.60 | |
| N1-methyl-2-pyridone-5-carboxamide | 27869.80 | 23852.00 | 25605.00 | 25785.50 | 30138.62 | 24584.40 | 20063.80 | 32152.60 | 19330.20 | 26898.00 | 19692.40 | 31844.20 | 34914.80 | |
| N4-acetylcytidine | 31503.80 | 16388.80 | 28698.00 | 28775.75 | 9354.62 | 36523.40 | 20016.20 | 42067.60 | 14959.60 | 31395.80 | 14693.60 | 36893.80 | 39224.00 | |
| N6-acetyllysine | 4914.80 | 5116.00 | 6350.00 | 6494.75 | 7412.25 | 6002.00 | 9174.80 | 7854.80 | 5549.40 | 5419.60 | 5575.00 | 5766.60 | 9611.40 | |
| N6-methyllysine | 1659.00 | 1676.00 | 1902.00 | 1975.75 | 2417.12 | 1900.80 | 2191.80 | 2220.20 | 1764.20 | 2027.60 | 1851.80 | 2083.40 | 2934.40 | |
| N6,N6-dimethyllysine | 2176.00 | 2183.20 | 2362.00 | 2422.00 | 2944.25 | 2246.20 | 4167.80 | 2687.20 | 1821.00 | 2072.00 | 2124.00 | 2270.00 | 3196.20 | |
| N6,N6,N6-trimethyllysine | 108193.20 | 169037.60 | 164467.00 | 163546.75 | 94090.50 | 102631.40 | 236124.80 | 120762.60 | 144715.20 | 107735.20 | 241264.80 | 117504.60 | 324943.40 | |
| N-acetylaspartate | 34544.00 | 37506.40 | 36287.00 | 36998.25 | 34269.38 | 40689.20 | 25208.80 | 49848.20 | 24092.20 | 59163.00 | 16918.60 | 37817.60 | 51484.60 | |
| N-acetylhistamine | 8973.20 | 27668.20 | 16712.00 | 16498.50 | 12952.50 | 8136.40 | 15531.20 | 10657.00 | 16330.80 | 13951.20 | 14494.40 | 9215.40 | 40704.40 | |
| N-acetylhistidine | 24532.40 | 28073.20 | 30630.00 | 31290.00 | 18669.00 | 28023.00 | 31745.00 | 30879.40 | 29361.40 | 29477.20 | 29402.60 | 28036.40 | 50817.80 | |
| N-acetylleucine | 35953.00 | 58683.60 | 61544.00 | 62086.75 | 18307.62 | 81521.40 | 64868.60 | 80160.00 | 39028.80 | 44101.80 | 79140.00 | 55257.00 | 38581.80 | |
| N-acetylornithine | 22589.00 | 43594.40 | 40278.00 | 39794.50 | 29581.75 | 25711.80 | 53337.60 | 29074.00 | 43060.00 | 30099.80 | 37268.40 | 34050.80 | 88913.60 | |
| N-acetylputrescine | 3131.40 | 2178.60 | 3343.00 | 3265.50 | 3545.00 | 2745.20 | 9281.80 | 3010.60 | 1900.60 | 2592.40 | 1742.00 | 4568.20 | 3032.40 | |
| N-acetylserotonin | 3626.20 | 1229.20 | 4717.00 | 4662.25 | 259.88 | 5939.40 | 6073.40 | 7623.00 | 4752.20 | 5320.20 | 8572.60 | 2421.60 | 1128.00 | |
| N-alpha-acetylarginine | 234923.40 | 346243.20 | 330402.00 | 311413.00 | 296760.62 | 219186.60 | 447328.40 | 241452.00 | 341220.40 | 226264.60 | 351760.80 | 295643.20 | 730492.20 | |
| N-carbamoyl-beta-alanine | 3360.20 | 4057.80 | 3488.00 | 3562.75 | 5567.50 | 3276.40 | 3987.80 | 4958.20 | 3190.20 | 3602.00 | 2711.20 | 2545.60 | 5697.20 | |
| niacinamide | 2254653.20 | 3279987.00 | 2460094.00 | 2492088.25 | 6321310.25 | 1616882.20 | 3724072.60 | 1893119.00 | 2284519.40 | 1585500.40 | 2069767.40 | 2507588.60 | 3539712.00 | |
| nicotinate | 1181.60 | 1542.60 | 1628.00 | 1559.00 | 1841.25 | 1572.00 | 1558.60 | 2159.00 | 1942.00 | 1257.00 | 1278.00 | 1251.20 | 1717.80 | |
| N-lauroylglycine | 5978.60 | 7770.40 | 9083.00 | 8706.25 | 6883.88 | 8027.80 | 8302.20 | 9756.60 | 9578.40 | 6145.40 | 6743.00 | 6040.20 | 7855.20 | |
| N-methylproline | 4658.00 | 7198.20 | 8431.00 | 8528.50 | 8362.50 | 13076.20 | 9996.40 | 13529.80 | 9033.40 | 5124.40 | 5147.40 | 5096.00 | 11051.00 | |
| NMMA | 7884.60 | 11594.40 | 11668.00 | 11542.50 | 13281.00 | 11613.80 | 15112.80 | 19103.60 | 8221.80 | 10727.60 | 9233.00 | 10145.40 | 41837.20 | |
| ornithine | 12254.80 | 23012.20 | 21456.00 | 21410.75 | 22375.12 | 15515.20 | 23603.60 | 16870.80 | 21569.00 | 16018.80 | 23255.20 | 15652.80 | 54864.00 | |
| oxypurinol | 4292303.80 | 12203649.80 | 6217298.00 | 6337135.00 | 22026123.25 | 5761801.00 | 8331726.00 | 5929932.60 | 5745486.60 | 4727977.60 | 5707810.40 | 5325606.00 | 6845238.20 | |
| pantothenate | 2064775.40 | 3895997.40 | 3447220.00 | 3440773.25 | 1864298.12 | 2122657.40 | 5087754.00 | 2088173.00 | 4476533.40 | 1909542.00 | 3506193.60 | 2072073.20 | 6543910.60 | |
| pantothenol | 7048.00 | 7462.20 | 24216.00 | 23899.75 | 4146.12 | 7322.00 | 9852.60 | 7946.80 | 10742.60 | 6074.60 | 8224.40 | 10264.00 | 138769.00 | |
| phenylacetylglycine | 16441.40 | 12404.60 | 14185.00 | 14786.25 | 44813.38 | 19501.20 | 7723.40 | 30153.60 | 8235.40 | 20002.20 | 8960.00 | 19927.40 | 20714.40 | |
| phenylalanine | 35439458.80 | 63874418.80 | 55148892.00 | 54400174.75 | 61040034.00 | 37021822.80 | 71110859.40 | 46600507.00 | 58289637.00 | 38559982.40 | 49968394.40 | 39592009.80 | 123806619.00 | |
| phenylalanine-d8 | 744377.20 | 758791.00 | 729239.00 | 713051.50 | 771546.62 | 730900.80 | 725437.80 | 718477.00 | 691347.00 | 770230.20 | 742390.20 | 742952.20 | 771137.40 | |
| phosphocholine | 229900874.40 | 304635197.40 | 276539089.00 | 277637162.50 | 119149486.38 | 82237250.40 | 756541360.80 | 111384085.40 | 274044483.20 | 73476219.80 | 254886141.20 | 293511803.60 | 606147039.20 | |
| phytosphingosine | 9012.00 | 7940.60 | 10916.00 | 10485.00 | 8826.75 | 8029.40 | 15465.20 | 8961.20 | 6813.00 | 6666.80 | 4708.60 | 10600.00 | 13847.80 | |
| pipecolate | 16986.00 | 19649.00 | 18998.00 | 18928.00 | 22238.12 | 18507.20 | 21960.20 | 19785.40 | 16668.00 | 18332.60 | 19501.00 | 17228.20 | 23336.40 | |
| proline | 587300.20 | 720288.40 | 751247.00 | 748040.50 | 789951.50 | 566544.40 | 915496.40 | 752991.40 | 698220.60 | 630948.80 | 646390.80 | 741458.80 | 1465053.40 | |
| proline-betaine | 359931.80 | 428625.40 | 451280.00 | 444932.25 | 501159.00 | 484248.00 | 495795.40 | 546433.00 | 403351.60 | 398863.40 | 351491.60 | 495634.20 | 618492.60 | |
| putrescine | 28339.20 | 28086.00 | 35938.00 | 36052.25 | 23842.00 | 33278.60 | 52078.80 | 28275.80 | 26731.00 | 26142.00 | 23492.40 | 49947.20 | 39544.60 | |
| pyridoxine | 5691.40 | 4365.60 | 4519.00 | 4409.75 | 6412.12 | 3586.60 | 1972.00 | 3842.60 | 1957.40 | 4416.40 | 3599.40 | 6010.80 | 7026.60 | |
| S-adenosylmethionine | 19432.00 | 25539.40 | 27406.00 | 26945.50 | 14627.38 | 20658.20 | 42628.60 | 20273.40 | 25972.80 | 17694.40 | 25201.80 | 28425.40 | 53446.60 | |
| SDMA | 973738.80 | 1472822.00 | 1350438.00 | 1358672.75 | 1372601.75 | 1195715.00 | 1842955.00 | 1373076.00 | 1294573.20 | 1106102.80 | 1195659.40 | 1102399.20 | 2543507.00 | |
| serine | 22691.00 | 31937.40 | 30056.00 | 30608.75 | 31136.25 | 27373.00 | 30341.20 | 28953.80 | 32742.20 | 27195.60 | 28490.40 | 27657.80 | 46210.20 | |
| serotonin | 173061.80 | 388442.80 | 279709.00 | 267733.25 | 61418.50 | 166578.60 | 302537.80 | 239758.80 | 359856.60 | 211914.40 | 237122.20 | 178261.00 | 586134.40 | |
| S-methyl-L-cysteine-S-oxide | 42257.80 | 59511.20 | 57498.00 | 58532.25 | 41979.50 | 45710.20 | 51111.80 | 54524.20 | 57172.20 | 50099.20 | 67491.80 | 51085.20 | 85655.60 | |
| sphinganine | 40039.80 | 60246.40 | 55501.00 | 55103.75 | 58309.25 | 42606.60 | 67587.60 | 48155.20 | 57050.60 | 39383.80 | 45067.80 | 56657.00 | 92712.00 | |
| sphingosine | 268236.20 | 269110.40 | 280287.00 | 270506.25 | 196184.12 | 212904.60 | 360294.20 | 226891.00 | 234381.40 | 195902.20 | 204074.80 | 291971.60 | 484881.80 | |
| taurine | 10082355.80 | 10889552.00 | 11214949.00 | 11112381.00 | 7701623.62 | 10094232.80 | 12484176.40 | 10234971.00 | 10287066.20 | 9921806.80 | 9656928.40 | 11250230.20 | 14954086.00 | |
| thiamine | 79952.60 | 95814.00 | 93734.00 | 92493.50 | 138803.25 | 94044.40 | 87856.40 | 110895.00 | 78501.40 | 107082.20 | 59758.80 | 82064.80 | 144402.40 | |
| threonine | 64660.20 | 92553.00 | 88294.00 | 87517.50 | 104287.25 | 66881.60 | 90180.60 | 81754.40 | 91624.40 | 69832.00 | 81079.00 | 70134.40 | 147732.00 | |
| trigonelline | 254794.80 | 235946.00 | 248090.00 | 243777.25 | 307365.50 | 222259.80 | 258112.00 | 258636.80 | 195073.60 | 275760.80 | 152181.80 | 313625.60 | 351584.40 | |
| trimethylamine-N-oxide | 25804.60 | 24579.00 | 22908.00 | 22752.00 | 14825.38 | 10258.00 | 25591.40 | 11213.60 | 14745.00 | 25243.80 | 21468.40 | 32661.80 | 42364.40 | |
| tryptophan | 22872579.00 | 33110293.20 | 32479915.00 | 32152540.00 | 39763383.00 | 25309447.80 | 32151422.80 | 29397410.40 | 34279291.20 | 26648028.20 | 31818264.80 | 24241866.60 | 54967698.60 | |
| tyrosine | 7074660.80 | 14228669.80 | 11444548.00 | 11415986.50 | 12248344.38 | 6967121.80 | 13217366.80 | 8693535.00 | 12679568.20 | 7823114.60 | 11452823.60 | 8562955.00 | 27611731.20 | |
| urate | 8459.60 | 16276.40 | 11099.00 | 11005.75 | 43031.00 | 8908.60 | 12825.20 | 11522.80 | 10651.80 | 10583.80 | 9292.80 | 8268.00 | 23139.80 | |
| urocanate | 1022812.40 | 1006722.00 | 864335.00 | 871488.00 | 2048054.38 | 588988.00 | 292764.00 | 659153.40 | 479190.20 | 1160117.40 | 623413.40 | 994440.80 | 1699546.00 | |
| valine | 62307353.20 | 76956186.80 | 77514050.00 | 76723507.25 | 72631051.50 | 61595772.40 | 82642320.40 | 79323797.80 | 72735184.60 | 64673629.60 | 68320368.60 | 68428106.60 | 145241929.40 | |
| valine-d8 | 533787.40 | 545843.80 | 520478.00 | 518151.75 | 572163.12 | 533882.40 | 498564.80 | 536622.00 | 497484.40 | 546772.40 | 531794.00 | 530136.40 | 526233.20 | |
| vitamin A | 62003.60 | 63578.00 | 60865.00 | 60240.50 | 34313.62 | 62851.20 | 54009.60 | 69740.80 | 66928.00 | 61423.40 | 61742.00 | 73302.00 | 92854.00 | |
| xanthine | 14943.80 | 43811.60 | 21710.00 | 22077.50 | 86335.12 | 20271.00 | 29569.60 | 20658.80 | 20860.80 | 16277.00 | 19085.00 | 18336.40 | 25156.20 | |
| xanthosine | 3421.60 | 5154.60 | 4280.00 | 4162.75 | 16612.88 | 2466.00 | 3915.60 | 3634.40 | 3889.60 | 3915.20 | 3503.20 | 2610.00 | 6895.00 |
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 |
