Data for ST003789
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 |
|---|---|---|---|---|---|---|---|
| 1-hydroxy-2-acetamidofluorene isomer | 401044.59 | 328369.79 | 187699.08 | 173365.04 | 136099.59 | 170667.98 | |
| 1-Methylguanine | 146913.37 | 135833.46 | 172020.11 | 157279.59 | 120447.89 | 154827.68 | |
| 1-Methylnicotinamide | 193987.47 | 162830.89 | 224949.02 | 181104.35 | 172811.13 | 247197.51 | |
| 2_3-Butanediol glucoside isomer | 243844.78 | 215731.73 | 365831.35 | 208262.69 | 40276.35 | 160810.10 | |
| 2-Methylbutyroylcarnitine | 615578.81 | 494224.91 | 590577.30 | 609212.47 | 479954.00 | 513858.10 | |
| 3-Hydroxyanthranilic acid | 268694.03 | 260930.80 | 226435.02 | 197428.48 | 145749.53 | 224773.91 | |
| 3-Hydroxyhexadecanoylcarnitine | 37121.69 | 43963.46 | 44404.36 | 31797.31 | 59376.45 | 57648.53 | |
| 3-hydroxyoctadecanoylcarnitine | 60130.30 | 57938.51 | 84361.91 | 73419.49 | 71662.32 | 97050.46 | |
| 3-hydroxyoleoylcarnitine | 61798.04 | 69570.94 | 93914.93 | 52747.94 | 110714.24 | 92580.66 | |
| 3-hydroxypalmitoleoylcarnitine | 39695.70 | 54979.14 | 59308.13 | 41715.72 | 75067.51 | 62498.33 | |
| 3-hydroxytetradecanoylcarnitine | 28769.37 | 40300.53 | 39814.89 | 27470.59 | 46051.12 | 42786.28 | |
| 3-Methoxytyramine | 40924.37 | 43320.64 | 44520.62 | 37458.29 | 43845.55 | 33443.99 | |
| 4-Guanidinobutanoic acid | 726842.51 | 634282.64 | 406340.42 | 494396.58 | 353316.46 | 467463.30 | |
| 4-Hydroxyindole | 1871011.85 | 1032534.74 | 541818.98 | 665331.58 | 893394.31 | 913123.95 | |
| 4-Phenoxypyrimidine isomer | 7006747.12 | 5630338.96 | 6077230.97 | 6366602.82 | 5773007.00 | 5963200.19 | |
| 4-(Trimethylammonio)but-2-enoate | 188381.52 | 182859.86 | 172393.08 | 122083.96 | 117702.21 | 128302.21 | |
| 5-Methylcytidine | 78973.44 | 71803.75 | 99220.51 | 102974.63 | 69823.99 | 104924.37 | |
| 5-Methylcytosine | 84592.64 | 68666.13 | 86136.34 | 77154.73 | 57877.98 | 77575.39 | |
| 5-methylthioadenosine (degradation product?) | 114967.35 | 83028.44 | 101512.43 | 105764.12 | 110358.84 | 90614.90 | |
| 7-ketocholesterol | 136028.54 | 157773.77 | 276407.33 | 225002.02 | 114664.79 | 194541.36 | |
| acetyl carnitine | 139723987.00 | 134541739.43 | 169494914.00 | 134528382.86 | 136509096.00 | 121468333.00 | |
| Acetylcholine | 4818750.41 | 3489169.11 | 3444956.06 | 3082209.32 | 2370740.56 | 2849249.08 | |
| Acetyl-DL-Valine isomer | 534776.93 | 514453.74 | 6380.57 | 5940.13 | 4843.19 | 6196.04 | |
| adenosine | 2892874.59 | 2306437.81 | 2930985.15 | 6393146.85 | 2916697.46 | 1909307.51 | |
| alanine | 5272458.69 | 3711972.75 | 5205849.72 | 4578271.93 | 3535351.31 | 4304875.69 | |
| alpha-Linolenoyl Ethanolamide | 39690.58 | 21469.96 | 51729.88 | 42660.35 | 22580.06 | 54513.21 | |
| Arg Ala | 8072.06 | 9755.01 | 9083.91 | 16363.77 | 9599.10 | 8635.42 | |
| Butyryl-L-carnitine | 2014045.44 | 1550726.71 | 2264600.20 | 3164420.00 | 1430870.59 | 2030362.89 | |
| Carnosine | 178077.36 | 137679.85 | 266449.51 | 271050.96 | 180082.45 | 234963.17 | |
| ceramide (d18:1/22:0) | 29532.69 | 29464.13 | 33226.04 | 24249.50 | 16861.60 | 35651.98 | |
| ceramide (d18:1/24:1) | 118783.39 | 111852.09 | 171777.59 | 96092.05 | 67454.13 | 137852.16 | |
| citrulline | 7061567.62 | 4619345.71 | 5428318.62 | 5153653.61 | 3266606.11 | 4735494.69 | |
| creatine | 174569610.00 | 125426238.86 | 152922992.00 | 140339301.71 | 99730177.00 | 120891753.00 | |
| Creatine phosphate | 40610.30 | 22456.50 | 44153.82 | 45695.56 | 52865.77 | 30539.92 | |
| Creatinine | 7380674.56 | 6561939.79 | 7653235.00 | 6846881.64 | 4936771.41 | 5766443.31 | |
| cytosine | 709886.90 | 597333.14 | 770736.97 | 711341.55 | 554568.22 | 715306.37 | |
| DAG(36:3) | 74493.96 | 67043.43 | 78496.11 | 59207.12 | 39227.69 | 71591.68 | |
| DAG(36:4) | 223310.26 | 173671.19 | 149808.23 | 100185.32 | 68200.31 | 123767.36 | |
| DAG(36:5) | 81795.18 | 70754.46 | 35589.18 | 25033.34 | 16742.47 | 28262.80 | |
| DAG(38:5) | 35461.25 | 33929.15 | 66142.34 | 51164.53 | 31657.49 | 55117.85 | |
| DAG(38:6) | 80304.92 | 62436.66 | 68393.22 | 50858.28 | 31974.96 | 57402.47 | |
| DAG(40:7) | 49221.75 | 37129.56 | 13630.12 | 7719.60 | 4939.04 | 7127.13 | |
| DAG(40:8) | 85244.04 | 74551.71 | 13505.19 | 7496.61 | 8318.86 | 10303.23 | |
| decadienoylcarnitine | 69248.33 | 66351.60 | 36796.36 | 31649.07 | 32798.51 | 31170.04 | |
| Decanoyl-L-carnitine | 115177.18 | 124726.26 | 191466.58 | 162424.92 | 205095.94 | 169596.37 | |
| decenoylcarnitine | 249684.61 | 260863.29 | 400002.36 | 314587.90 | 381407.42 | 357887.65 | |
| Deoxycytidine | 244179.92 | 204133.71 | 258714.23 | 239157.69 | 188251.08 | 244523.60 | |
| Diaminopimelic acid | 61730.75 | 49673.79 | 35775.07 | 28313.77 | 22056.62 | 32537.46 | |
| Dimethylglycine | 1399970.27 | 975586.71 | 1709759.13 | 889082.29 | 928323.32 | 1443897.98 | |
| DL-Pipecolic acid | 456476.77 | 345116.04 | 351873.29 | 309150.25 | 212154.23 | 245079.40 | |
| dodecanoylcarnitine | 164878.32 | 193553.78 | 286384.88 | 210958.15 | 274677.17 | 245459.14 | |
| dodecenoylcarnitine | 136459.52 | 138129.99 | 175094.91 | 141329.96 | 197208.34 | 181617.43 | |
| Ecgonine isomer | 242451.37 | 200989.15 | 106140.48 | 87452.24 | 79874.48 | 78887.49 | |
| ethyl serine isomer | 661693.05 | 483315.87 | 589158.35 | 545962.60 | 361945.32 | 468594.91 | |
| Formimino-L-glutamic acid | 112873.83 | 87471.08 | 87357.90 | 75390.67 | 53830.15 | 76892.43 | |
| Formylglutathione | 32018.46 | 14748.25 | 42432.09 | 35686.68 | 20548.92 | 27059.24 | |
| Fructoselysine | 29318.42 | 15714.42 | 121025.65 | 52160.39 | 54558.25 | 25935.17 | |
| gamma-Butyrobetaine | 4818798.84 | 3489250.00 | 3444965.72 | 3082221.50 | 2370777.81 | 2849282.70 | |
| Gln-Glu | 375665.29 | 274206.45 | 250624.46 | 243473.42 | 241568.83 | 291004.03 | |
| Glu-Ala | 97225.57 | 74202.56 | 80553.63 | 70273.05 | 67961.60 | 77606.68 | |
| glutamine isomer | 37283.59 | 24454.50 | 23105.42 | 20910.92 | 19749.50 | 21860.08 | |
| Glutarylcarnitine | 91044.69 | 73339.91 | 132818.60 | 137651.56 | 104677.35 | 106778.13 | |
| Glutaurine | 15569.79 | 10810.01 | 16259.36 | 15090.28 | 12071.49 | 15877.90 | |
| Glycerophosphocholine | 4151127.22 | 2104836.77 | 5772658.88 | 4543398.93 | 2655848.60 | 3561150.69 | |
| Guanidinosuccinic acid | 38274.99 | 26764.82 | 34186.93 | 37358.60 | 24534.23 | 27670.57 | |
| Heptadecanoyl carnitine | 5313.61 | 31935.01 | 9260.42 | 20652.09 | 5399.95 | 8555.46 | |
| Heptaethylene glycol isomer | 4145375.97 | 4273376.46 | 6174662.78 | 3059790.98 | 956352.42 | 2502033.28 | |
| hexadecadienoyl carnitine C16:2 isomer 2 | 170678.63 | 175389.43 | 208301.47 | 119444.80 | 202235.42 | 176392.35 | |
| Hexaethylene glycol | 10597603.00 | 13446945.32 | 14529823.25 | 8238960.21 | 2356526.98 | 6398474.31 | |
| hexanoyl carnitine | 287646.05 | 309950.99 | 543474.27 | 404119.57 | 444471.71 | 454449.41 | |
| Homocarnosine | 43487.95 | 35584.38 | 55751.32 | 55017.02 | 37502.88 | 45740.62 | |
| Homocitrulline | 54970.71 | 45081.69 | 161247.25 | 136835.73 | 42855.80 | 84301.02 | |
| Hydroxyaspergillic acid isomer | 126779.77 | 122692.02 | 177364.96 | 142431.59 | 125568.51 | 146107.76 | |
| Hydroxybutyrylcarnitine | 814826.75 | 902642.82 | 1136138.27 | 767006.24 | 1051068.59 | 852924.27 | |
| Hydroxygaleon isomer | 34848.28 | 61090.40 | 41749.28 | 103922.56 | 34306.88 | 33596.37 | |
| hypoxanthine | 1649749.94 | 2175690.07 | 2389938.98 | 2227722.25 | 1430086.59 | 1601092.92 | |
| Imidazoleacetic acid | 90793.06 | 67260.07 | 62140.50 | 62178.17 | 42949.45 | 56838.86 | |
| Imidazole propionate | 538015.78 | 580717.85 | 530269.46 | 433437.60 | 312040.31 | 609260.16 | |
| Indole-3-acetaldoxime N-oxide | 10063169.06 | 6021871.82 | 7961340.81 | 8005933.14 | 5441232.00 | 6781827.97 | |
| Indole-3-acetamide | 1484257.76 | 1298181.32 | 2013069.17 | 1595289.78 | 839611.27 | 1433027.62 | |
| Indoleacetaldehyde isomer | 34703.34 | 28587.79 | 31969.76 | 32634.97 | 39887.40 | 31138.38 | |
| Isobutyryl carnitine | 2012768.65 | 1549591.35 | 2263446.67 | 3163277.96 | 1430475.01 | 2029632.34 | |
| L-Carnitine | 372832936.00 | 302153081.14 | 353696008.00 | 346698107.43 | 262442928.00 | 286447844.00 | |
| Leu-Ala isomer | 170274.24 | 144477.95 | 155738.76 | 125181.33 | 100713.91 | 121970.26 | |
| Leu-Gly | 162013.79 | 133668.53 | 107629.91 | 110341.02 | 76016.47 | 84036.08 | |
| linolenylcarnitine | 20187.76 | 18440.97 | 22822.91 | 13943.05 | 20333.42 | 18857.73 | |
| Linoleoyl carnitine C18:2 | 342157.29 | 387479.81 | 450944.93 | 261057.12 | 431608.72 | 401191.98 | |
| linoleoyl carnitine C18:2 isomer | 98220.63 | 92930.53 | 127210.95 | 94607.40 | 130101.13 | 123796.11 | |
| LPE(22:6) isomer | 2312630.03 | 2006188.14 | 2132258.69 | 2042753.98 | 2127046.31 | 2189716.58 | |
| L-Pipecolic acid | 524173.29 | 330717.80 | 754790.80 | 737000.17 | 416658.30 | 638644.43 | |
| Lys-Gly | 115465.14 | 112187.75 | 164847.09 | 155884.36 | 104288.32 | 133882.47 | |
| Lyso-PAF C-18 | 321957.35 | 284884.64 | 324943.34 | 255215.43 | 229714.96 | 281474.46 | |
| LysoPC(14:0) | 2464223.52 | 1865891.18 | 2962817.81 | 2850571.75 | 2290887.39 | 2555353.45 | |
| LysoPC(16:0) | 16003929.62 | 10826840.93 | 17874550.75 | 20942164.29 | 9815445.25 | 15339684.00 | |
| LysoPC(16:1) | 247554.05 | 162935.14 | 423885.40 | 544806.76 | 208343.76 | 380108.78 | |
| LysoPC(18:0) | 11279282.06 | 8830743.93 | 14022051.06 | 14446175.57 | 6986342.88 | 11902142.62 | |
| LysoPC(18:1) | 74089786.00 | 57997418.86 | 112526903.00 | 108360768.00 | 83985594.00 | 108873003.00 | |
| LysoPC(18:2) | 13775722.25 | 9064758.64 | 11947830.00 | 13774766.57 | 6871523.38 | 11166769.56 | |
| LysoPC(20:0) | 1086593.92 | 880992.07 | 997521.88 | 888181.57 | 771820.57 | 992437.45 | |
| LysoPC(20:1) | 156471.78 | 98867.37 | 199994.32 | 191790.50 | 127087.30 | 183770.73 | |
| LysoPC(20:2) | 2196191.62 | 1629844.65 | 1667366.36 | 1643301.41 | 1762884.76 | 1940193.28 | |
| LysoPC(20:3) | 1020651.48 | 687352.70 | 873800.01 | 964046.06 | 531117.13 | 893110.13 | |
| LysoPC(20:4) | 4703038.53 | 3027597.64 | 10529153.00 | 11119548.04 | 5260499.62 | 8900300.62 | |
| LysoPC(22:0) | 390650.38 | 321551.63 | 281980.85 | 298289.98 | 280907.01 | 372459.12 | |
| LysoPC(22:1) | 160718.75 | 128948.20 | 196303.88 | 145487.44 | 132262.12 | 176157.50 | |
| LysoPC(22:4) | 268453.20 | 211690.26 | 1103366.70 | 941370.34 | 741076.93 | 1091653.42 | |
| LysoPC(22:5) | 2141273.84 | 1568531.96 | 6459738.94 | 6641707.14 | 4844584.50 | 7623030.00 | |
| LysoPC(22:6) isomer 1 | 3688878.44 | 2487369.02 | 3245350.89 | 3462266.91 | 1731413.80 | 2641053.05 | |
| LysoPC(22:6) isomer 2 | 44083839.75 | 34368504.29 | 36866165.50 | 32134275.43 | 28058683.25 | 30724179.50 | |
| LysoPC(24:0) | 476394.55 | 394692.49 | 499294.80 | 430559.24 | 378720.51 | 484974.04 | |
| LysoPC(P-16:0) | 407649.69 | 321982.85 | 372056.33 | 348308.63 | 314171.81 | 322715.66 | |
| LysoPC(P-18:0) | 670798.10 | 532799.41 | 887310.21 | 730033.20 | 617344.18 | 751289.13 | |
| LysoPC(P-18:1) | 407640.86 | 375520.92 | 370191.90 | 371268.71 | 353506.55 | 401979.35 | |
| lysoPE(16:0) | 23944.42 | 18288.25 | 20248.21 | 20893.68 | 20506.64 | 19819.44 | |
| LysoPE(18:0) | 478659.64 | 379879.41 | 424289.59 | 445167.02 | 312990.78 | 397529.92 | |
| LysoPE(18:1) | 246813.12 | 166380.84 | 264263.16 | 281554.02 | 200589.90 | 280879.49 | |
| LysoPE(18:2) | 3068788.38 | 2247263.41 | 2024657.59 | 2225253.34 | 1710099.99 | 2335109.98 | |
| LysoPE(18:3) | 88473.26 | 41210.74 | 17342.83 | 18646.76 | 11680.82 | 20259.51 | |
| LysoPE(20:0) | 6322203.31 | 4831819.89 | 4322340.34 | 3924313.89 | 3785863.14 | 4463314.00 | |
| LysoPE(20:4) | 487149.13 | 315233.33 | 696926.28 | 749914.12 | 503634.60 | 739787.52 | |
| LysoPE(22:0) | 153369.46 | 97809.38 | 126791.92 | 129831.35 | 75410.76 | 133725.29 | |
| LysoPE(22:1) | 530065.66 | 400058.59 | 447471.94 | 404766.64 | 399834.73 | 443567.66 | |
| LysoPE(22:5) | 54819.19 | 30118.35 | 291495.08 | 310937.50 | 248936.55 | 369213.08 | |
| LysoPE(22:6) | 569780.54 | 436574.77 | 568022.96 | 538801.35 | 421665.28 | 549813.80 | |
| LysoPE(24:0) | 77381.83 | 46987.40 | 50888.70 | 30986.74 | 31869.45 | 54029.33 | |
| LysoPE(P-16:0) | 135868.97 | 127723.96 | 148351.12 | 134647.26 | 124075.24 | 143600.11 | |
| Malonylcarnitine | 51844.00 | 59841.20 | 86255.28 | 60956.74 | 69436.30 | 59652.06 | |
| Messagenin isomer | 591866.08 | 592016.58 | 835582.25 | 474939.22 | 283023.24 | 710079.44 | |
| Metalaxyl isomer | 55196.29 | 53132.61 | 30507.65 | 30921.93 | 16862.99 | 53396.73 | |
| methacholine | 45448208.25 | 32657734.00 | 18908738.88 | 21614036.86 | 19314780.62 | 16162951.62 | |
| Methionine sulfoxide | 549031.31 | 324243.50 | 473842.30 | 472950.39 | 237523.59 | 345781.23 | |
| Methyl-Histidine | 948601.06 | 679060.78 | 1273774.51 | 1117407.37 | 868759.32 | 953138.00 | |
| Methylimidazoleacetic acid | 537942.56 | 580573.90 | 530097.44 | 433274.65 | 311911.61 | 609184.11 | |
| Myristoylcarnitine C14:0 isomer 2 | 250654.23 | 256500.58 | 467596.55 | 250297.57 | 367840.04 | 425993.94 | |
| N1-Methyl-4-pyridone-3-carboxamide | 611551.10 | 584985.14 | 510569.63 | 450975.73 | 330123.21 | 505802.65 | |
| N5-(4-Methoxybenzyl)glutamine | 242066.95 | 227993.12 | 19215.44 | 24927.46 | 8267.83 | 10543.41 | |
| n5-Iminoethyl-l-ornithine | 2152993.84 | 1557908.34 | 2256707.69 | 2116742.20 | 1372671.38 | 1869120.54 | |
| N-Acetylhistamine | 122431.52 | 91355.54 | 30834.32 | 37576.07 | 24885.56 | 35336.93 | |
| N-acetyl-histidine | 298541.00 | 350475.21 | 251315.39 | 235992.30 | 151030.07 | 212468.08 | |
| N-Acetyl-L-arginine | 333898.35 | 236208.74 | 228778.68 | 230133.65 | 129425.63 | 170263.04 | |
| N-Alpha-acetyllysine | 161268.94 | 133054.68 | 107065.95 | 109466.57 | 75321.83 | 83417.84 | |
| N-carbamoylsarcosine | 462422.82 | 257641.90 | 438835.62 | 406365.26 | 260545.14 | 356045.61 | |
| Neosolaspigenin isomer | 56751.79 | 61411.25 | 50178.40 | 48743.96 | 42780.88 | 51086.20 | |
| Netilmicin isomer | 1984933.83 | 2104164.22 | 2161023.78 | 2287440.29 | 1239925.49 | 2039871.94 | |
| nicotinamide | 556843.14 | 667867.10 | 927170.88 | 1003657.10 | 716116.48 | 588613.73 | |
| N-Methyl-L-isoleucine | 30944.12 | 22868.31 | 808225.35 | 474084.53 | 552619.19 | 360442.15 | |
| NN-dimethylarginine | 530193.28 | 425359.46 | 553248.68 | 511793.00 | 399349.16 | 509564.49 | |
| N-N-N-Trimethyl-Histidine | 645733.59 | 934984.32 | 361354.58 | 396580.63 | 244747.53 | 297380.85 | |
| N-Palmitoyl tyrosine | 44915.87 | 22195.12 | 19157.21 | 19330.42 | 10405.97 | 16182.88 | |
| N-Propionylglycine | 894642.72 | 603499.02 | 804743.70 | 595735.74 | 418982.80 | 659369.19 | |
| O-adipoyl-L-carnitine | 85350.87 | 66512.20 | 134887.67 | 89965.17 | 86717.61 | 93355.05 | |
| O-Benzyl-L-serine isomer | 31686.42 | 28934.71 | 19850.30 | 12378.42 | 10262.12 | 14031.03 | |
| O-(hydroxytetradecadienoyl)-L-carnitine | 84282.16 | 84346.41 | 89044.70 | 63275.06 | 100891.00 | 85355.70 | |
| Oleoylcarnitine isomer 2 | 514891.55 | 532193.59 | 1086752.88 | 607311.79 | 915793.42 | 1037197.23 | |
| Oleoylcarnitine isomer 3 | 188371.76 | 165904.79 | 363627.28 | 256544.78 | 288677.21 | 366880.25 | |
| Oleoyl Ethanolamide | 133340.69 | 139952.67 | 206852.32 | 217327.85 | 172422.16 | 168649.53 | |
| ornithine | 625548.44 | 362275.22 | 341303.73 | 357202.09 | 195316.17 | 314342.17 | |
| O-succinylcarnitine | 85049.88 | 94571.98 | 105657.62 | 79380.30 | 63784.62 | 70591.13 | |
| Oxiracetam isomer | 5017346.00 | 3325629.00 | 3879375.59 | 3677465.93 | 2348804.44 | 3415668.78 | |
| palmitoleoylcarnitine C16:1 isomer 2 | 102820.23 | 114749.06 | 315023.89 | 160915.41 | 254422.45 | 294518.53 | |
| Palmitoyl carnitine C16 | 583097.23 | 514657.40 | 899355.25 | 581666.61 | 666085.69 | 831480.67 | |
| PC(14:0/18:2) | 1748158.01 | 1536017.39 | 2264451.25 | 1993741.50 | 1790206.06 | 2217420.70 | |
| PC(15:0/22:5) | 408105.16 | 328403.88 | 283991.63 | 257555.80 | 253183.80 | 279643.23 | |
| PC(16:0/14:0) | 1117465.56 | 1049503.10 | 1660762.99 | 1481151.71 | 1252567.41 | 1654702.28 | |
| PC(16:0/15:0) | 536841.06 | 435386.42 | 406240.41 | 355970.61 | 365990.65 | 449051.88 | |
| PC(16:0/16:0) | 14193113.50 | 14036218.71 | 21311654.00 | 17657929.71 | 16242492.38 | 19687760.38 | |
| PC(16:0/16:1) | 4232147.56 | 3975667.50 | 9229453.75 | 9043678.43 | 6728154.47 | 8905739.12 | |
| PC(16:0/18:2) | 336338582.00 | 295890891.43 | 314443910.00 | 272207849.14 | 260391734.00 | 306206118.00 | |
| PC(16:0/19:1) | 693890.92 | 576807.86 | 668439.51 | 650903.42 | 629999.28 | 803354.11 | |
| PC(16:0/20:3) | 29471199.25 | 21092836.43 | 18752466.88 | 18690055.86 | 14686821.19 | 24576950.88 | |
| PC(16:0/20:4) | 69184874.50 | 64239689.14 | 122850485.00 | 106134693.71 | 95769567.00 | 110848153.00 | |
| PC(16:0/22:6) | 47303355.75 | 38722302.29 | 40301215.25 | 36685750.57 | 31278636.75 | 43719694.00 | |
| PC(16:1/18:2) | 4700598.88 | 3724394.25 | 5525975.09 | 5247008.39 | 3751161.19 | 6060632.81 | |
| PC(16:1/20:5) | 209320.66 | 146205.28 | 155774.36 | 165669.42 | 124466.71 | 171569.94 | |
| PC(17:0/18:2) | 6257020.62 | 5530923.43 | 3127896.88 | 2939731.86 | 2970919.12 | 3498289.94 | |
| PC(17:0/22:6) | 1103744.96 | 966218.68 | 522902.75 | 436245.82 | 541276.79 | 511297.60 | |
| PC(17:1/16:0) | 1085039.21 | 967257.28 | 1079640.09 | 1080547.52 | 1011287.87 | 1212717.77 | |
| PC(18:0/18:2) | 101880181.00 | 112040134.86 | 107647588.00 | 103876394.29 | 75117969.50 | 107530768.00 | |
| PC(18:0/20:2) | 757010.29 | 588806.56 | 646991.64 | 602513.35 | 590605.08 | 745290.14 | |
| PC(18:1/20:4) | 24112.88 | 21597.32 | 48611.67 | 42129.93 | 27018.42 | 50650.83 | |
| PC(18:1/22:6) | 7623000.00 | 6780564.79 | 6454836.69 | 5484410.50 | 5459130.50 | 5898343.44 | |
| PC(18:2/15:0) | 2507230.86 | 2101409.21 | 1146824.23 | 1053859.60 | 1168207.91 | 1296520.24 | |
| PC(18:2/16:0) | 336343972.00 | 295893136.00 | 314456850.00 | 272215936.00 | 260395450.00 | 306215902.00 | |
| PC(18:2/17:1) | 1203754.16 | 953183.86 | 551498.05 | 486706.23 | 529585.12 | 585684.14 | |
| PC(18:2/19:0) | 1551662.98 | 1383669.80 | 1097320.39 | 936529.00 | 909560.40 | 1321259.25 | |
| PC(18:2/22:6) | 1444421.55 | 1286041.17 | 1607769.97 | 1410059.34 | 1055824.92 | 1278226.64 | |
| PC(18:3/16:1) | 318874.21 | 275534.35 | 525448.48 | 470467.08 | 391985.41 | 454529.06 | |
| PC(20:0/22:6) | 143895.29 | 116607.63 | 112884.19 | 95395.73 | 85579.88 | 113325.13 | |
| PC(20:1/22:6) | 233555.78 | 202979.71 | 170934.39 | 148076.15 | 171873.48 | 203367.73 | |
| PC(20:4/16:0) | 78713.32 | 67814.57 | 172117.97 | 123699.56 | 96490.87 | 156300.92 | |
| PC(20:4/18:0) | 24979797.12 | 20260641.14 | 48057846.00 | 44810143.14 | 28195351.00 | 52014172.00 | |
| PC(20:4/20:0) | 328421.82 | 283840.61 | 634453.16 | 518853.35 | 477673.14 | 608597.25 | |
| PC(20:4/22:6) | 245070.21 | 211973.68 | 441261.65 | 332861.18 | 264971.49 | 304219.87 | |
| PC(20:5/16:0) | 8878192.81 | 7749777.93 | 2668111.09 | 2535985.73 | 2170752.28 | 2553824.84 | |
| PC(21:3/16:0) | 767583.31 | 653872.53 | 346567.92 | 350858.22 | 360859.71 | 418973.41 | |
| PC(22:6/16:1) | 1370755.71 | 998342.86 | 1041323.38 | 1041477.94 | 901355.66 | 1209923.74 | |
| PC(22:6/18:0) | 11664262.50 | 10655210.93 | 10311152.56 | 9114105.07 | 6810380.81 | 11841838.69 | |
| PC(22:6/19:0) | 165835.65 | 151470.86 | 82670.30 | 70461.38 | 76785.88 | 99486.55 | |
| PC(22:6/20:2) | 1050244.59 | 965277.96 | 277576.09 | 240728.55 | 202070.83 | 562086.37 | |
| PC(22:6/20:3) | 107739.42 | 103798.00 | 213037.73 | 175401.68 | 139838.07 | 202521.01 | |
| PC(28:0) | 58101.69 | 60021.88 | 56887.81 | 68446.71 | 64828.48 | 69708.87 | |
| PC (30:0) | 62752.93 | 64606.49 | 60982.81 | 60003.29 | 48787.98 | 68153.30 | |
| PC(30:1) | 80550.80 | 62179.98 | 181099.54 | 182948.77 | 119265.60 | 175455.59 | |
| PC(36:5) | 27160.12 | 22643.99 | 26020.96 | 20571.25 | 17069.83 | 26822.02 | |
| PC(39:4) | 376229.20 | 317522.18 | 466299.02 | 445640.69 | 399159.19 | 493283.64 | |
| PC(P-34:2) | 313404.37 | 308325.09 | 163949.82 | 151858.57 | 148148.52 | 212274.36 | |
| PC(P-36:2) | 326379.22 | 298806.04 | 201700.93 | 177647.09 | 153232.61 | 185437.87 | |
| PC(P-36:3) | 1367477.24 | 1331167.28 | 2022245.89 | 1639955.93 | 1435728.11 | 1673769.83 | |
| PC(P-38:3) | 407747.98 | 386843.50 | 704196.22 | 559853.71 | 501940.85 | 595210.38 | |
| PC(P-38:4) | 809635.04 | 619073.31 | 1273175.41 | 1091049.23 | 778010.80 | 1279251.75 | |
| PC(P-38:6) | 452252.21 | 401559.58 | 336278.04 | 276604.12 | 277896.51 | 297558.05 | |
| PC(P-40:6) | 550175.66 | 482743.24 | 498101.57 | 354843.29 | 374432.36 | 399678.04 | |
| PE(16:0/20:4) | 395686.14 | 405528.64 | 423087.46 | 482599.88 | 466059.22 | 451152.42 | |
| PE(16:0/20:5) | 53675.80 | 47927.01 | 20747.34 | 26601.73 | 18871.64 | 22441.56 | |
| PE(16:0/22:6) | 663523.31 | 767702.21 | 522460.69 | 565636.79 | 605514.36 | 583661.96 | |
| PE(18:0/18:0) | 297477.19 | 287398.16 | 225000.67 | 195418.11 | 221744.05 | 257648.32 | |
| PE(18:0/22:6) | 255782.74 | 211097.95 | 142488.39 | 145476.81 | 150522.32 | 149081.89 | |
| PE(18:1/22:6) | 178813.69 | 233858.95 | 116876.15 | 117727.51 | 141827.07 | 125090.35 | |
| PE(18:2/18:1) | 256503.18 | 244322.94 | 138713.41 | 156608.75 | 143298.91 | 162044.96 | |
| PE(18:2/22:2) | 1685006.36 | 1425836.75 | 1819647.53 | 1646911.59 | 1613250.62 | 1840805.00 | |
| PE(20:4/18:0) | 786123.86 | 819578.51 | 775911.66 | 783642.82 | 788838.11 | 833703.99 | |
| PE(20:4/18:1) | 161352.83 | 156810.79 | 248220.85 | 283626.49 | 252108.61 | 215929.61 | |
| PE(20:4/19:0) | 50497285.00 | 38815222.86 | 83201914.00 | 79566298.29 | 59431857.50 | 91038604.00 | |
| PE(22:6/P-18:0) | 262599.31 | 311877.10 | 262083.01 | 223684.84 | 245823.42 | 257699.85 | |
| PE(34:1) | 71094.23 | 57464.02 | 52831.18 | 69877.09 | 50918.69 | 56863.13 | |
| PE(36:3) | 148267.90 | 113706.41 | 78418.01 | 91885.06 | 71509.08 | 115245.84 | |
| PE(38:6) | 467200.34 | 370365.95 | 342820.00 | 408782.42 | 423609.42 | 481232.34 | |
| PE(42:7) | 160206.16 | 132792.87 | 91443.41 | 66274.51 | 79892.65 | 76536.40 | |
| PE(O-18:0/22:6) | 223287.07 | 261085.44 | 225000.95 | 216858.38 | 225574.42 | 218227.76 | |
| PE(P-16:0/20:4) | 161393.05 | 175580.90 | 220772.48 | 204263.20 | 194874.79 | 208575.42 | |
| PE(P-16:0/22:6) | 134727.15 | 130550.49 | 140856.14 | 138998.58 | 162892.26 | 94146.52 | |
| PE(P-18:0/20:4) | 183576.53 | 227067.85 | 305715.17 | 293562.28 | 303971.31 | 304636.61 | |
| PE(P-18:1/22:6) | 92764.91 | 104511.49 | 56304.60 | 50639.41 | 62146.20 | 52102.18 | |
| PE(P-19:1/18:0) | 1020902.08 | 1000976.33 | 688726.86 | 658380.84 | 589422.27 | 675735.68 | |
| PE(P-35:0) | 197791.54 | 210699.93 | 250413.51 | 204654.75 | 208804.21 | 239346.99 | |
| PE(P-38:5) | 225986.70 | 241016.11 | 171028.01 | 170869.80 | 142217.49 | 178849.37 | |
| PG(16:0/18:0) | 105575.39 | 105487.30 | 91031.91 | 77330.92 | 72568.04 | 71113.23 | |
| Phenylalanine isomer | 437289.19 | 337366.26 | 83865.11 | 71409.79 | 53521.22 | 77709.49 | |
| Phosphonoacetaldehyde isomer | 73462.05 | 72544.47 | 83685.56 | 75334.46 | 70243.26 | 89082.17 | |
| pirbuterol isomer | 255428.28 | 256465.62 | 354260.38 | 295754.79 | 260303.88 | 291881.50 | |
| Pro-Leu | 543347.84 | 494488.25 | 784904.56 | 662461.16 | 511121.45 | 646359.79 | |
| proline betaine | 33701145.75 | 32189355.14 | 585337.87 | 441829.05 | 404373.65 | 339325.57 | |
| propenoyl carnitine isomer 1 | 32042.05 | 29224.33 | 19298.22 | 18964.45 | 14550.36 | 15405.91 | |
| Propionyl carnitine C3 | 2513303.45 | 2088478.96 | 1241596.88 | 1359689.20 | 1203561.38 | 1217958.71 | |
| Pro-Thr | 141759.62 | 71143.53 | 254256.81 | 171116.42 | 99178.61 | 89979.62 | |
| PS(30:1) | 9749.57 | 10561.53 | 16741.54 | 11404.95 | 4191.48 | 15597.23 | |
| Pyridoxal | 247346.67 | 163346.29 | 199737.66 | 212196.61 | 149814.33 | 190332.43 | |
| Pyroglutamine | 803908.16 | 682118.92 | 403598.66 | 303313.44 | 273987.15 | 285190.96 | |
| (R)-(+)-2-Pyrrolidone-5-carboxylic acid | 19513.46 | 20097.37 | 22779.37 | 19631.36 | 14064.67 | 16986.78 | |
| riboflavin | 28058.11 | 13583.25 | 14181.14 | 13872.53 | 8956.35 | 11354.00 | |
| Ribothymidine | 40597.11 | 27939.50 | 22588.75 | 18741.46 | 11660.76 | 17599.96 | |
| Saringosterol isomer | 11321356.06 | 10760644.00 | 9534598.31 | 5701582.13 | 4314617.44 | 11076949.81 | |
| SM(d18:1/14:0) | 187509.51 | 207124.46 | 517563.36 | 288555.36 | 280258.14 | 409152.69 | |
| SM(d18:1/16:0) | 19115211.00 | 17394098.29 | 25509331.25 | 20349337.75 | 17264006.62 | 26339654.50 | |
| SM(d18:1/22:0) | 116695.83 | 81108.55 | 76136.49 | 75690.43 | 66975.63 | 108195.79 | |
| SM(d18:1/24:0) | 97757.70 | 109234.90 | 83465.64 | 106063.33 | 94077.53 | 130155.72 | |
| SM(d18:1/24:1) | 888200.27 | 610138.88 | 718998.53 | 681591.21 | 540915.04 | 940062.59 | |
| Sphingosine | 100442.99 | 108855.52 | 141086.29 | 104697.04 | 94147.62 | 108259.52 | |
| Targinine | 82924.23 | 50775.14 | 54254.43 | 44954.13 | 27099.54 | 43343.44 | |
| Taurocyamine | 26444.71 | 20132.90 | 39679.64 | 34589.99 | 21707.63 | 25534.29 | |
| tetradecadienoylcarnitine isomer 2 | 216202.34 | 257856.80 | 264488.66 | 208878.10 | 291535.09 | 229921.99 | |
| thymine | 886082.15 | 726238.96 | 959712.89 | 871977.84 | 579695.83 | 784351.25 | |
| Triethanolamine | 315035.96 | 361791.31 | 145420.40 | 207165.53 | 97797.99 | 218486.86 | |
| Trimethylamine N-oxide | 8397852.44 | 5162671.68 | 13870967.56 | 19871326.86 | 7591549.53 | 13372158.97 | |
| Trimethyllysine | 136209.62 | 136332.38 | 182323.04 | 146300.21 | 108367.32 | 148866.98 | |
| Val-Val isomer | 68030.40 | 61440.15 | 43762.50 | 41652.09 | 31791.30 | 38665.16 |
Factors:
| F1 | Diet:Chow | Treatment:anti-PD-1 |
| F2 | Diet:Chow | Treatment:isotype control |
| F3 | Diet:HC_In0 | Treatment:anti-PD-1 |
| F4 | Diet:HC_In1.9 | Treatment:anti-PD-1 |
| F5 | Diet:HC_In8 | Treatment:anti-PD-1 |
| F6 | Diet:LC_In0 | Treatment:anti-PD-1 |