Data for ST001356
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 | F7 | F8 | F9 | F10 | F11 | F12 | F13 | F14 | F15 | F16 | F17 | F18 | F19 | F20 | F21 | F22 | F23 | F24 | F25 | F26 | F27 | F28 | F29 | F30 | F31 | F32 | F33 | F34 | F35 | F36 | F37 | F38 | F39 | F40 | F41 | F42 | F43 | F44 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 7-dehydrocholesterol | 38689.96 | 33629.05 | 9124.29 | 12896.19 | 38367.14 | 84907.33 | 122696.38 | 40999.60 | 43902.29 | 14617.71 | 6481.63 | 33800.71 | 151992.67 | 122332.76 | 41643.37 | 44890.76 | 8831.71 | 3179.15 | 32317.81 | 65188.38 | 69532.57 | 86305.62 | 38314.19 | 7477.08 | 9129.91 | 10239.33 | 35762.95 | 28513.81 | 90940.10 | 38308.29 | 2862.66 | 19862.17 | 6500.76 | 13154.38 | 54926.86 | 116392.10 | 36847.82 | 26765.14 | 12999.20 | 16874.64 | 80111.52 | 38160.19 | 75956.19 | 85967.71 | |
| Adenosyl Homocysteine | 1016634.48 | 1464995.56 | 982608.17 | 852860.29 | 687027.80 | 1022103.24 | 863312.01 | 926000.58 | 1273549.81 | 1349600.78 | - | 677222.20 | 1416210.93 | 1129798.00 | 1033263.83 | 1135578.56 | 866132.06 | - | 750931.29 | 981290.84 | 655697.46 | 947245.09 | 911775.23 | 426147.15 | 753999.08 | - | 406320.82 | 451533.36 | 476956.39 | 975839.92 | 761981.33 | 804318.15 | - | 484022.87 | 802435.46 | 869010.21 | 343292.27 | 769290.67 | 567029.61 | 600706.83 | 781189.29 | 387909.21 | 713379.78 | 454163.55 | |
| Adenosyl Methionine | 3209439.69 | 2976384.03 | 3652368.79 | 3350563.62 | 678344.66 | 2582761.09 | 2838417.23 | 4103116.49 | 4679534.65 | 3825041.38 | 3397478.52 | 1091296.15 | 3890568.78 | 2945869.66 | 6178472.47 | 6050093.95 | 4504746.12 | 2849293.05 | 1647347.19 | 1399932.08 | 2383253.77 | 3088368.03 | 2487974.07 | 2611456.06 | 3484105.64 | 2373293.09 | 1032365.53 | 1514637.47 | 2077913.83 | 5113162.76 | 4114673.33 | 3812212.58 | 2240077.81 | 1365287.41 | 1470501.03 | 3094168.09 | 2225128.72 | 2404492.54 | 2408436.45 | 3053239.86 | 3239812.60 | 1414145.94 | 1032813.99 | 2301528.37 | |
| Arachidonic Acid | 504560.69 | 545867.33 | 650726.29 | 595498.76 | 915012.00 | 1093646.67 | 803958.00 | 583472.82 | 705731.37 | 825688.00 | - | 818219.29 | 842288.57 | 844594.00 | 669285.06 | 703107.62 | 969255.14 | - | 970706.57 | 988455.81 | 746691.52 | 1046556.19 | 618374.10 | 651852.35 | 1194368.10 | - | 1046111.05 | 1166434.00 | 761923.62 | 643528.86 | 864650.80 | 596979.62 | - | 1769691.05 | 658358.67 | 940249.52 | 267007.46 | 506926.76 | 469926.03 | 572876.41 | 441523.33 | 813464.42 | 887570.10 | 593851.14 | |
| Caffeine | 145058.19 | 150956.15 | 131989.71 | 302398.38 | 156628.06 | 226474.19 | 215144.95 | 166229.39 | 335620.38 | 203609.90 | 246906.57 | 81063.03 | 117470.00 | 84356.30 | 551481.61 | 81063.03 | 207721.90 | 181171.81 | 81063.03 | 81063.03 | 134184.10 | 749035.43 | 138831.54 | 307454.42 | 186805.33 | 204770.10 | 81063.03 | 107865.83 | 214477.14 | 236187.16 | 325824.88 | 165673.43 | 177240.10 | 195778.95 | 98480.50 | 203283.90 | 136447.22 | 2277202.29 | 512506.30 | 391719.82 | 900010.67 | 594125.37 | 81063.03 | 157791.43 | |
| Chitobiose | 37301.48 | 33119.43 | 30784.38 | 43944.00 | 19938.76 | 40657.14 | 24522.10 | 20624.37 | 13828.12 | 28580.29 | 25597.24 | 14542.29 | 17095.24 | 23689.43 | 9706.78 | 21183.33 | 25593.52 | 24278.29 | 14759.14 | 21817.14 | 14536.57 | 15080.76 | 14275.71 | 9277.95 | 21112.67 | 19196.57 | 8900.86 | 16088.86 | 12256.67 | 18965.62 | 13352.72 | 23697.87 | 26289.43 | 20795.52 | 13028.48 | 22227.24 | 19612.40 | 14530.76 | 12488.95 | 16924.22 | 12404.19 | 13820.20 | 22599.33 | 10861.00 | |
| DHA | 3805969.46 | 4670683.81 | 12065833.14 | 8929413.90 | 11710718.95 | 9545880.86 | 5077832.67 | 3963562.88 | 4828104.80 | 11973268.95 | - | 9617832.71 | 5588372.67 | 5138500.19 | 4313887.92 | 4520040.57 | 15915122.00 | - | 14824191.14 | 8396479.14 | 6246764.67 | 7913621.05 | 4707875.05 | 14248170.34 | 18628671.24 | - | 14253268.19 | 16233853.43 | 5990902.38 | 4152161.33 | 14409478.21 | 10090145.36 | - | 27676359.81 | 7411290.76 | 6802332.76 | 2022070.92 | 4420564.38 | 7634986.95 | 9547653.28 | 4933688.00 | 12274748.02 | 9145243.71 | 4869654.43 | |
| Dimethyl glycine | 2654622.86 | 2561796.72 | 2267217.73 | 2626968.17 | 5066797.17 | 6001304.51 | 4984236.57 | 1424352.33 | 2458999.96 | 3260972.91 | - | 4278076.59 | 7334132.92 | 4119754.28 | 1987851.05 | 2285269.30 | 2526573.72 | - | 5033649.82 | 7952645.39 | 5077996.22 | 4752670.12 | 3430104.66 | 2238697.80 | 2719164.91 | - | 4762080.53 | 5491743.62 | 4844632.93 | 2332597.53 | 2270683.11 | 2342785.91 | - | 3748098.16 | 5811838.98 | 6683758.39 | 1224376.54 | 2413214.20 | 2298817.16 | 2549659.97 | 3687513.53 | 5248413.24 | 7681602.21 | 3201301.94 | |
| EPA | 2602730.37 | 2692269.52 | 3496409.62 | 3079274.86 | 4600900.19 | 4249659.52 | 3404099.52 | 2907598.00 | 3804138.14 | 4293606.67 | - | 3755891.43 | 3460743.33 | 3509962.86 | 3288940.62 | 3230713.52 | 5116203.71 | - | 4827260.86 | 4148988.57 | 3374755.14 | 4550038.10 | 2913975.14 | 3716932.52 | 5340224.76 | - | 4843245.33 | 5054634.38 | 3390672.57 | 2845669.52 | 4670826.80 | 3297859.13 | - | 6520754.00 | 3128841.71 | 3731633.71 | 1332154.53 | 2589733.43 | 2987463.81 | 3131512.57 | 2590897.33 | 4453565.14 | 4209263.71 | 2552648.57 | |
| Ergosterol | 72858.70 | 68413.52 | 21672.00 | 21693.05 | 62810.38 | 26904.13 | 103131.30 | 67263.29 | 87553.71 | 30865.33 | 8719.21 | 53781.86 | 75179.47 | 87305.59 | 66836.38 | 77070.76 | 19648.83 | 5020.16 | 45708.29 | 70191.97 | 104951.33 | 63863.59 | 68985.14 | 17987.73 | 13977.71 | 11961.59 | 26692.16 | 38192.07 | 34267.18 | 74375.71 | 10632.15 | 20196.22 | 7893.21 | 25910.29 | 71463.33 | 94815.40 | 81327.38 | 54268.95 | 26170.99 | 31141.97 | 94641.05 | 45740.96 | 100866.95 | 105386.43 | |
| Glutathione | 172813.90 | 170971.66 | 104474.95 | 118678.99 | 75709.30 | 125497.92 | 109094.80 | 149228.10 | 202008.69 | 138008.82 | - | 71204.37 | 120975.39 | 163367.29 | 169269.47 | 145295.05 | 93381.26 | - | 96152.63 | 113636.70 | 85940.60 | 80014.73 | 181309.62 | 54393.30 | 62314.62 | - | 59177.70 | 90795.36 | 73183.86 | 158244.91 | 88751.83 | 100554.09 | - | 80649.36 | 87547.97 | 171025.39 | 92536.45 | 133899.50 | 58959.29 | 69966.22 | 69013.70 | 54529.72 | 93746.53 | 66460.52 | |
| Hydroxo B12 | 12407.98 | 19100.38 | 15282.67 | 10173.05 | 4842.67 | 25565.05 | 20476.00 | 14325.08 | 15069.24 | 15667.62 | 23039.43 | 5523.86 | 22544.10 | 18136.29 | 14543.16 | 14466.48 | 18055.52 | 19882.38 | 2032.67 | 3480.29 | 19416.19 | 21351.43 | 16775.14 | 13535.80 | 21425.62 | 14536.86 | 2560.57 | 2552.00 | 27298.29 | 14331.52 | 19770.69 | 13210.44 | 20199.33 | 4890.38 | 4389.62 | 21762.76 | 11305.75 | 11847.43 | 12230.06 | 13544.19 | 20014.86 | 2338.24 | 6611.43 | 21405.57 | |
| IAA | 616090.38 | 630392.50 | 539146.42 | 549563.59 | 819178.92 | 866870.05 | 591705.55 | 570484.96 | 441332.65 | 815860.49 | - | 835508.93 | 556280.61 | 1028138.26 | 464530.74 | 757911.05 | 641320.12 | - | 549592.45 | 1105822.47 | 367676.35 | 482954.72 | 388131.56 | 154331.24 | 558096.35 | - | 839403.16 | 920368.99 | 416528.30 | 503582.14 | 265729.97 | 458136.27 | - | 660851.53 | 576822.36 | 674008.70 | 143041.75 | 557490.82 | 361141.73 | 329466.27 | 512102.39 | 835693.49 | 1142474.09 | 378782.82 | |
| Indole 3 acetamide | 21849.92 | 10530.67 | 56217.08 | 41814.04 | 52388.28 | 128050.05 | 61588.43 | 21476.41 | 16307.94 | 84423.32 | - | 48820.74 | 480037.23 | 67470.09 | 11803.72 | 12947.42 | 57480.35 | - | 59067.12 | 98645.74 | 65055.92 | 64272.22 | 20455.52 | 26964.66 | 52112.48 | - | 48436.25 | 60240.84 | 61885.74 | 14561.63 | 42317.64 | 45804.96 | - | 52525.05 | 67018.79 | 98736.81 | 8382.53 | 13603.03 | 36514.43 | 34780.71 | 51421.81 | 52949.27 | 109063.58 | 40325.27 | |
| Kynurenine | 18515.88 | 18964.91 | 63289.80 | 76618.30 | 15985.77 | 53576.11 | 99852.25 | 80338.97 | 21033.56 | 50065.36 | - | 18138.12 | 45366.18 | 44667.54 | 31338.83 | 34457.81 | 36669.06 | - | 22859.16 | 38422.31 | 38661.58 | 46012.21 | 21818.08 | 29234.35 | 26952.88 | - | 12827.32 | 27079.50 | 51435.96 | 40568.52 | 49260.13 | 33951.98 | - | 23330.49 | 23163.41 | 48620.80 | 25409.58 | 64163.46 | 58245.14 | 60119.56 | 50008.90 | 25362.14 | 25397.34 | 22599.67 | |
| Methyl indole 3 carboxylate | 1329.95 | 7276.91 | 6917.33 | 3012.38 | 4030.82 | 13600.29 | 2074.91 | 3200.73 | 1841.36 | 5888.29 | 5425.43 | 3975.29 | 7907.77 | 4652.10 | 1283.49 | 3153.26 | 7585.90 | 4340.91 | 3500.95 | 9002.86 | 4279.33 | 3743.01 | 1271.03 | 1528.87 | 5241.81 | 4331.43 | 2046.25 | 2180.57 | 4466.72 | 1271.03 | 4053.40 | 5417.03 | 6861.05 | 1345.83 | 3454.53 | 7959.90 | 1136.98 | 2926.69 | 6839.68 | 4380.82 | 1398.63 | 1633.16 | 14522.19 | 2604.80 | |
| Pyridoxal | 695853.96 | 525124.76 | 530401.33 | 374079.14 | 514398.10 | 467239.81 | 577255.05 | 785390.72 | 899965.67 | 592799.05 | 520254.38 | 613438.14 | 413737.62 | 425101.24 | 728011.77 | 460551.43 | 485813.24 | 375497.05 | 600601.81 | 544268.29 | 438761.05 | 326346.76 | 456379.05 | 635669.18 | 525077.62 | 524019.05 | 584913.62 | 645815.71 | 433981.90 | 529429.62 | 703889.51 | 497523.78 | 464703.33 | 748619.24 | 600504.00 | 395915.24 | 762809.97 | 601030.29 | 576673.06 | 613032.72 | 422006.19 | 572795.22 | 585578.57 | 474633.86 | |
| Pyridoxal Phosphate | 804267.32 | 910774.64 | 628233.27 | 542746.37 | 361533.87 | 850465.08 | 665029.18 | 517927.61 | 863753.62 | 850254.95 | - | 330135.30 | 789722.83 | 564488.05 | 882640.98 | 1019727.42 | 634299.85 | - | 526942.14 | 603196.32 | 514779.47 | 590162.05 | 1060713.71 | 407870.57 | 611474.71 | - | 396510.89 | 588185.43 | 518121.95 | 985720.36 | 562646.49 | 697295.43 | - | 462235.06 | 634093.01 | 857125.02 | 409811.54 | 699175.38 | 435862.76 | 585515.14 | 422412.95 | 369183.87 | 640468.41 | 359867.45 | |
| trans Retinal | 50432.78 | 50127.90 | 42762.86 | 42343.33 | 252186.57 | 199298.19 | 348913.24 | 70567.02 | 76592.87 | 48149.14 | 86877.05 | 270389.57 | 371117.24 | 396921.90 | 63555.63 | 66063.52 | 40850.29 | 58774.95 | 230615.81 | 316761.33 | 212074.95 | 247579.81 | 45626.76 | 34720.68 | 35109.33 | 85882.48 | 153832.48 | 167090.76 | 215385.90 | 53368.19 | 40548.46 | 40255.07 | 92155.33 | 102971.33 | 298328.29 | 262228.86 | 70085.27 | 36524.00 | 43344.60 | 50999.34 | 249308.95 | 241545.85 | 380871.81 | 249342.43 | |
| Tryptophan | 8497830.33 | 9203489.26 | 10098700.91 | 15706595.27 | 6891708.72 | 12855640.55 | 8244979.80 | 15995588.73 | 9530925.77 | 11456876.19 | - | 7526341.17 | 6994020.45 | 12159604.94 | 17070898.13 | 14275205.16 | 11844846.93 | - | 10876665.25 | 11009916.59 | 6661944.06 | 10025874.03 | 6897573.70 | 5529395.46 | 8305726.58 | - | 5447614.44 | 13951717.15 | 7405377.10 | 12001890.17 | 7793690.44 | 9166819.43 | - | 10158304.32 | 9003170.25 | 9222600.04 | 5323845.26 | 11172994.48 | 9282592.55 | 8020864.61 | 13383307.96 | 14847499.46 | 12291072.32 | 5031813.24 | |
| Vanillic Acid | 33920.64 | 21916.75 | 44032.80 | 100426.74 | 16144.45 | 54357.25 | 117735.13 | 126031.65 | 79259.06 | 22942.48 | 43092.59 | 19990.54 | 45804.60 | 29435.33 | 12012.86 | 12466.50 | 23519.22 | 49989.70 | 20457.15 | 26410.71 | 58686.42 | 308741.96 | 68222.95 | 51237.23 | 62657.84 | 55592.93 | 22666.25 | 24728.34 | 171908.07 | 39766.47 | 73267.07 | 24827.94 | 44170.12 | 29254.09 | 21150.21 | 44546.26 | 36987.31 | 150083.40 | 225651.83 | 90110.71 | 87228.75 | 91619.08 | 31378.46 | 56681.50 | |
| Vitamin B2 | 477993.73 | 468796.71 | 439438.91 | 499766.41 | 896841.79 | 1486582.38 | 961113.67 | 459696.35 | 477542.85 | 657844.45 | 821688.15 | 949204.53 | 893712.07 | 1069468.55 | 382162.07 | 508299.17 | 689598.54 | 1214643.30 | 1167238.89 | 1333492.62 | 888536.83 | 987704.37 | 255255.34 | 463582.40 | 493008.52 | 991578.16 | 1138382.84 | 1547653.62 | 923325.51 | 454552.81 | 470936.32 | 470413.43 | 1068763.87 | 1157550.19 | 930904.97 | 1221296.79 | 343759.58 | 446115.27 | 422968.57 | 399776.92 | 800703.32 | 1479727.32 | 1563414.12 | 935114.24 | |
| Vitamin B5 | 182536.27 | 78571.43 | 111717.26 | 106627.99 | 32935.84 | 132252.96 | 124909.72 | 125847.62 | 46138.46 | 99674.28 | - | 21877.53 | 123795.70 | 111164.31 | 62007.94 | 97892.01 | 98787.38 | - | 22167.75 | 38517.91 | 99242.04 | 106147.58 | 73956.57 | 68600.56 | 79276.13 | - | 31305.41 | 34476.23 | 139542.00 | 79478.51 | 62395.23 | 74539.07 | - | 29376.27 | 55432.54 | 132992.71 | 102452.65 | 173900.54 | 92585.03 | 112592.21 | 157711.57 | 49151.47 | 31870.95 | 57979.91 | |
| Xanthine | 5109344.65 | 5786260.31 | 4526994.68 | 5607443.06 | 4637506.01 | 8938742.29 | 7256620.29 | 3831230.31 | 4289861.60 | 8141468.01 | - | 5189969.95 | 8546204.11 | 6985375.55 | 4101678.37 | 6116027.10 | 4601228.83 | - | 4910925.25 | 11007178.81 | 3820313.53 | 6828789.11 | 6089286.92 | 2139379.57 | 3423400.54 | - | 4804159.48 | 8800096.03 | 5610772.56 | 5149375.44 | 2627706.32 | 3712302.73 | - | 6374950.79 | 7119725.49 | 9010930.16 | 1534709.03 | 5275024.50 | 3811740.12 | 3313490.39 | 5258126.07 | 5183468.58 | 12404337.70 | 3522984.18 |
Factors:
| F1 | Time:1000 | Station and Cast:S07C001 |
| F2 | Time:1000 | Station and Cast:S17C001 |
| F3 | Time:1000 | Station and Cast:S23C001 |
| F4 | Time:1000 | Station and Cast:S31C001 |
| F5 | Time:1000 | Station and Cast:S53C001 |
| F6 | Time:1000 | Station and Cast:S60C001 |
| F7 | Time:1000 | Station and Cast:S68C001 |
| F8 | Time:1400 | Station and Cast:S08C001 |
| F9 | Time:1400 | Station and Cast:S18C001 |
| F10 | Time:1400 | Station and Cast:S24C001 |
| F11 | Time:1400 | Station and Cast:S32C001 |
| F12 | Time:1400 | Station and Cast:S54C001 |
| F13 | Time:1400 | Station and Cast:S61C001 |
| F14 | Time:1400 | Station and Cast:S69C001 |
| F15 | Time:1800 | Station and Cast:S11C001 |
| F16 | Time:1800 | Station and Cast:S19C001 |
| F17 | Time:1800 | Station and Cast:S26C001 |
| F18 | Time:1800 | Station and Cast:S33C001 |
| F19 | Time:1800 | Station and Cast:S47C001 |
| F20 | Time:1800 | Station and Cast:S55C001 |
| F21 | Time:1800 | Station and Cast:S63C001 |
| F22 | Time:1800 | Station and Cast:S70C001 |
| F23 | Time:200 | Station and Cast:S15C001 |
| F24 | Time:200 | Station and Cast:S21C001 |
| F25 | Time:200 | Station and Cast:S29C001 |
| F26 | Time:200 | Station and Cast:S35C001 |
| F27 | Time:200 | Station and Cast:S51C001 |
| F28 | Time:200 | Station and Cast:S57C001 |
| F29 | Time:200 | Station and Cast:S66C001 |
| F30 | Time:2200 | Station and Cast:S14C001 |
| F31 | Time:2200 | Station and Cast:S20C001 |
| F32 | Time:2200 | Station and Cast:S28C001 |
| F33 | Time:2200 | Station and Cast:S34C001 |
| F34 | Time:2200 | Station and Cast:S49C001 |
| F35 | Time:2200 | Station and Cast:S56C001 |
| F36 | Time:2200 | Station and Cast:S64C001 |
| F37 | Time:600 | Station and Cast:S06C001 |
| F38 | Time:600 | Station and Cast:S16C001 |
| F39 | Time:600 | Station and Cast:S22C001 |
| F40 | Time:600 | Station and Cast:S30C001 |
| F41 | Time:600 | Station and Cast:S37C001 |
| F42 | Time:600 | Station and Cast:S52C001 |
| F43 | Time:600 | Station and Cast:S58C001 |
| F44 | Time:600 | Station and Cast:S67C001 |
