Data for ST000539
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 |
|---|---|---|---|---|---|---|---|
| 10-Hydroxycarbazepine | 184219.48 | 368895.50 | 445526.39 | 175903.25 | 503826.95 | 213351.22 | |
| 1,2,4-Trimethylbenzene | 1620168.33 | 1275486.29 | 2393041.75 | 1698864.67 | 2292983.00 | 1509290.08 | |
| 1,2-dioctanoyl-1-amino-2,3-propanediol | 467984.44 | 512681.55 | 551937.75 | 455540.50 | 547858.38 | 415042.70 | |
| 1(2H)-Isoquinolinone | 935583.06 | 1106508.15 | 951383.10 | 715755.46 | 814382.38 | 954683.54 | |
| 12-OPDA | 323783.76 | 489650.84 | 298612.78 | 617859.19 | 468872.53 | 516074.30 | |
| 1-5-diazabicyclononane | 1067887.15 | 188644.17 | 155884.38 | 168006.25 | 140327.11 | 188816.06 | |
| 1-5-diazabicyclononane 2 | 1067887.15 | 188644.17 | 155884.38 | 168006.25 | 140327.11 | 188816.06 | |
| 1,6-anhydrous-N-Acetylmuramyl-tetrapeptide | 1157272.65 | 1278369.27 | 960432.29 | - | - | - | |
| 1-deoxynojirimycin | 597283.44 | 483442.46 | 407199.74 | 534165.69 | 599575.40 | 558046.97 | |
| 1-deoxyxylonojirimycin | 255754.88 | 280426.05 | 303541.49 | 3810186.08 | 4081321.92 | 4433640.17 | |
| 1-Methylnicotinamide | 149041.02 | 173427.11 | 181903.05 | 50641.68 | 59390.54 | 58653.06 | |
| 1-Nitronaphthalene | 1230297.69 | 2974646.83 | 1591601.21 | 9398651.00 | 276760.83 | 2190691.54 | |
| 2,3,4,5-Tetrahydrodipicolinate | - | - | - | 246848.41 | 133379.37 | 239020.05 | |
| 2,3,4,5-Tetrahydropyridine-2-carboxylate | 1687667.25 | 1992637.54 | 1721163.17 | 1650284.92 | 1544409.67 | 2398264.25 | |
| 2,3-Dimethylmaleate | 1772994.96 | 1595561.54 | 3192121.58 | 1545311.29 | 1644488.00 | 2970164.00 | |
| 2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate | 346888.89 | 418716.89 | 343316.99 | 374922.01 | 411716.44 | 486117.34 | |
| 2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate 2 | 346888.89 | 418716.89 | 343316.99 | 374922.01 | 411716.44 | 486117.34 | |
| 2-Aminobutan-4-olide | 146146.39 | 152280.40 | 202267.04 | 275352.09 | 311311.70 | 471151.46 | |
| 2-Dehydro-3-deoxy-L-rhamnonate | 1290422.33 | 973657.85 | 1117830.90 | 657287.90 | 1130903.56 | 1240354.19 | |
| 2-Methylcholine | 513952.66 | 977985.88 | 2036633.71 | 339073.83 | 1515308.17 | 915733.81 | |
| 2-monooleoylglycerol | 1779063.79 | 480627.25 | 873071.96 | 393436.80 | 1322350.62 | 633421.42 | |
| 2-Phenyl-1,3-propanediol monocarbamate | 194679.48 | 233488.34 | 527536.16 | 706088.46 | 683558.48 | 912178.54 | |
| 3,4-Dehydrothiomorpholine-3-carboxylate | 1143653.21 | 714767.75 | 841195.19 | 475772.65 | 187803.26 | 537651.89 | |
| 3,4-Dehydrothiomorpholine-3-carboxylate 2 | 1143653.21 | 714767.75 | 841195.19 | 475772.65 | 187803.26 | 537651.89 | |
| 3,5,7-Trimethyl-2E,4E,6E,8E-undecatetraene | 20666702.67 | 17326506.00 | 30910327.33 | 22403722.00 | 32920558.67 | 18494588.00 | |
| 3,5-dihydro-5-methylidene-4H-imidazol-4-one | 89366.01 | 407203.23 | 95997.48 | 898621.27 | - | 333606.18 | |
| 3-(ADP)-2-phosphoglycerate | 74194.55 | - | - | 417503.24 | - | 230968.90 | |
| 3-beta-D-Galactosyl-sn-glycerol | 392938.18 | 491131.81 | 471681.75 | - | - | - | |
| 3-Butylidene-7-hydroxyphthalide | 3297525.83 | 893192.65 | 1048186.81 | 3399609.08 | 665559.12 | 968278.46 | |
| 3-Butynoate | 2029899.17 | 2384512.04 | 2033494.96 | 3701685.00 | 3779104.33 | 4040272.08 | |
| 3-Dehydroteasterone | 2338958.25 | 607814.02 | 877087.21 | 726033.58 | 1267984.08 | 688980.88 | |
| 3-(Dimethylamino)propyl benzoate | 200938.02 | 227522.41 | 186978.53 | 999812.56 | - | 210124.92 | |
| 3-Hydroxy-L-kynurenine | 80304.12 | 86291.61 | 104197.32 | 304720.63 | 162317.11 | 479536.47 | |
| 3-Hydroxy-N6,N6,N6-trimethyl-L-lysine | 1076904.35 | 1057667.92 | 1017322.25 | 5784742.83 | 6158082.50 | 5150389.83 | |
| 3-Methoxyanthranilate | 736400.02 | 889715.48 | 900795.73 | 543863.47 | 580081.12 | 613758.67 | |
| 3-methyl-1-heptene | 1065138.04 | 671330.58 | 525173.17 | 1049995.44 | 696217.67 | 598326.71 | |
| 3-Methylcrotonylglycine | 127220.91 | 227240.83 | 306888.46 | 92706.72 | 1502838.58 | 263928.36 | |
| 3-Methyleneoxindole | 2334798.33 | 3494444.50 | 2805851.25 | 12199221.67 | 2420096.42 | 3099663.58 | |
| 3-nitro-2-pentanol | 2218192.75 | 2930806.83 | 1227351.12 | 1912081.08 | 814012.38 | 1509433.62 | |
| 3-Nitrotyrosine | - | - | - | - | - | 191475.48 | |
| 4-(1-methyl-5-hydroxy-2-pyrrolidinyl)-3-oxobutanoate methyl ... | 324521.97 | 404444.92 | 296582.74 | 362792.29 | 226608.88 | 433919.88 | |
| 4,6-Dihydroxyquinoline | - | - | 615715.50 | 106095.47 | 1745570.71 | 877156.77 | |
| 4-8dimethylnonanoylcarnitine | 663164.40 | 655928.33 | 614164.81 | 448307.88 | 436909.95 | 751967.88 | |
| 4-Aminobutanal | 1519982.58 | 1492285.08 | 1450668.38 | 2071656.08 | 1665656.79 | 1878083.17 | |
| 4-Aminobutanoate | 3674759.08 | 3774819.00 | 3903241.50 | 8704086.67 | 8583461.00 | 8633104.17 | |
| 4-Guanidinobutanal | 114688.95 | 125431.77 | 111456.35 | 114489.34 | 122205.19 | 113951.20 | |
| 4-Hydroxy-4-methylglutamate | 340277.09 | 377986.20 | 388633.96 | 713692.79 | 806189.02 | 888814.60 | |
| 4-Hydroxycinnamyl aldehyde | 2805831.25 | 201711.95 | 987907.12 | 262396.22 | 2094652.79 | 2837285.50 | |
| 4-Imidazolone-5-propanoate | 326193.15 | 428050.09 | 425476.64 | 2136495.38 | 2403047.50 | 2332941.17 | |
| 4-PIOL | 581219.18 | 566605.60 | 670427.25 | 539712.70 | 778491.52 | 654486.96 | |
| 4-Trimethylammoniobutanoate | 131784989.33 | 153344453.33 | 156209181.33 | 68889953.33 | 73704746.67 | 70418942.67 | |
| 5,6-Dihydrothymine | 24446360.67 | 28716590.67 | 25844610.67 | 75039533.33 | 71341580.00 | 77328840.00 | |
| 5,6-Dihydrothymine 2 | 24446360.67 | 28716590.67 | 25844610.67 | 75039533.33 | 71341580.00 | 77328840.00 | |
| 5,8,13,13a-Tetrahydrocolumbamine | 444760.39 | 736552.00 | 658278.39 | 498844.68 | 570929.60 | 756310.52 | |
| 5-Aminopentanamide | 65449.87 | 66103.60 | 77542.86 | 105697.40 | 130433.01 | 128573.52 | |
| 5-Guanidino-2-oxopentanoate | 883495.98 | 966885.46 | 929765.33 | 1102153.42 | 1113505.12 | 1112218.44 | |
| 5-guanidino-3-methyl-2-oxo-pentanoate | 1172864.58 | 1221984.48 | 607312.70 | 1591727.46 | 184029.49 | 740637.67 | |
| 5-Hydroxytryptophol | 446218.08 | 551187.98 | 620187.08 | 516829.14 | 999856.29 | 1106239.50 | |
| 5-Methoxytryptophol | 137614.85 | 162765.43 | 152670.16 | 129694.98 | 253377.21 | 311293.46 | |
| 5-Methylcytosine | 315320.40 | 375068.09 | 323254.81 | 217656.60 | 243133.57 | 307567.82 | |
| 5-Methylthioadenosine | 5966158.33 | 7918623.33 | 7111464.17 | 11650848.33 | 5184127.50 | 11513045.67 | |
| 5S-HETE di-endoperoxide | 584686.80 | 894270.83 | 1856706.25 | 826072.98 | 5364571.00 | 866558.06 | |
| (+/-)-5-[(tert-Butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahy... | 180839.84 | 361627.64 | 625757.64 | 543944.52 | 331171.66 | 507787.36 | |
| (+/-)-5-[(tert-Butylamino)-2-hydroxypropoxy]-3,4-dihydro-1(2... | - | 232016.36 | - | 1017537.96 | 399287.06 | 965434.00 | |
| 6-Acetamido-2-oxohexanoate | 475435.27 | 1038863.35 | 235229.24 | 927241.08 | 457447.23 | 1541200.00 | |
| 7,8-benzoflavone | 659206.64 | 1166084.00 | 1168767.71 | 1073780.50 | 1397832.75 | 1218573.54 | |
| 7alpha-Hydroxycholest-4-en-3-one | 2326024.71 | 4432249.25 | 2117854.04 | 1876534.25 | 1693072.92 | 5874386.00 | |
| Acetone cyanohydrin | 194831.22 | 185246.36 | 204322.07 | 422966.52 | 437940.78 | 489837.77 | |
| Acetylagmatine | - | - | - | - | - | - | |
| Acetylcholine | 47469.95 | 61169.33 | 69926.62 | 56991453.33 | 51192337.33 | 52532436.00 | |
| Acetyl phosphate | 272731.84 | 192554.30 | 264496.67 | 267272.58 | 126834.29 | 283694.26 | |
| Ac-Tyr-OEt | 470288.58 | 430645.89 | 488022.67 | 739160.31 | 415020.92 | 527034.59 | |
| a Cysteine adduct | 777277.83 | 451780.58 | 551089.11 | 332518.52 | 196951.39 | 316444.09 | |
| a Cysteine adduct 2 | 777277.83 | 451780.58 | 551089.11 | 332518.52 | 196951.39 | 316444.09 | |
| Adenine | 2890104.92 | 3816674.08 | 3100675.92 | 3834702.75 | 2970945.67 | 4593625.00 | |
| Ala-Ala-Ala | - | - | - | - | - | - | |
| Ala-Asn-Gly | 150236.76 | 116362.10 | - | 149024.23 | 78234.30 | 206473.21 | |
| Ala-Asp-Asp-Gln | - | - | - | 451043.43 | 616911.00 | 484471.30 | |
| Ala-Asp-Cys-Gly | 138087.88 | 210277.07 | 181465.37 | - | 208161.24 | 233401.37 | |
| Ala-Asp-Cys-Ser | 1329664.58 | 1309949.58 | 1216608.46 | 5316218.17 | 5155426.67 | 5690167.33 | |
| Ala-Asp-Gly | 707925.96 | 554908.28 | 581993.10 | 378478.58 | 605437.73 | 618189.56 | |
| Ala-Asp-Gly 2 | 707925.96 | 554908.28 | 581993.10 | 378478.58 | 605437.73 | 618189.56 | |
| Ala-Asp-Pro-Ser | - | - | - | 261912.86 | - | 251634.58 | |
| Ala-Gln-Pro | - | - | - | - | 80116.50 | 172002.82 | |
| Ala-Leu-Lys-Pro | 733424.96 | 749865.96 | 627779.07 | 1162037.92 | 1230595.88 | 1559540.33 | |
| Ala-Leu-Thr-Pro | 118487.78 | 169049.09 | 100254.21 | 297422.63 | 110964.53 | 199560.02 | |
| Ala-Lys-Asn-His | 82686.00 | - | 110252.79 | 589536.57 | 647959.48 | 656807.62 | |
| Ala-Met-Pro-Tyr | - | - | - | 336303.48 | 288563.12 | 400312.96 | |
| Ala-Pro | 320422.43 | 418842.22 | 308620.07 | 406259.79 | 88530.34 | 163787.24 | |
| Ala-Ser-Ser | 401152.70 | 428007.31 | 443962.92 | - | - | - | |
| Alatanin 2 | 839135.31 | 274038.55 | 333113.25 | 658161.44 | 311911.03 | 193620.85 | |
| allopurinol | 1146094.23 | 1424348.38 | 1182945.04 | 1912585.62 | 1879609.12 | 1882246.38 | |
| alpha-Methylstyrene | 568339.08 | 304527.70 | 688225.54 | 337480.39 | 815819.46 | 393978.90 | |
| AMP | 17352710.00 | 25012618.67 | 22609848.67 | 9833773.00 | 7837304.83 | 9674488.67 | |
| Anthranilate | 1856828.08 | 2280232.17 | 1844173.33 | 3094787.67 | 3386069.83 | 3652428.67 | |
| Arg-Asn-Pro-His | 167744.70 | 183253.42 | 192668.48 | 529940.02 | 811292.62 | 640037.31 | |
| Arg-Asp-Asp-Gly | 343389.97 | 318459.69 | 367928.50 | 1536086.83 | 1837217.21 | 2186159.75 | |
| Arg-Leu-Asn-Asp | 986365.88 | 618539.31 | 317076.78 | - | - | - | |
| Arg-Met-Asn-Gln | - | - | - | - | - | - | |
| Arg-Met-Asn-His | - | 155943.41 | 196064.32 | - | - | - | |
| Arg-Met-Val-Asp | - | - | - | - | - | - | |
| Asn-Asn-Asn | 204591.53 | 335407.40 | 320732.09 | 151700.28 | 115033.57 | 395747.52 | |
| Asn-Asn-Pro-His | 293667.55 | 370668.40 | 364130.75 | 457185.71 | - | 233995.89 | |
| Asn-Asp | 42122.07 | 52389.29 | 51660.88 | 195070.85 | 235471.38 | 221918.72 | |
| Asn-Cys-Pro-Ser | - | - | - | 727479.69 | 417011.10 | 964766.31 | |
| Asn-Leu-Asn-Tyr | 33372115.33 | 34761131.33 | 37760102.00 | 1840487.58 | 651927.10 | 751584.38 | |
| Asn-Pro | 4961960.92 | 6654400.00 | 6203370.83 | 380142.49 | 414914.98 | 414684.09 | |
| Asn-Tyr | 134215.44 | - | - | 147462.31 | - | - | |
| Asp-Arg | 50342.57 | 116824.15 | 68027.33 | 1015055.54 | 1388281.54 | 1065932.35 | |
| Asp-Asp-Gly | 346438.89 | 308089.45 | 341462.03 | 9216314.33 | 3864187.75 | 8431552.33 | |
| Asp-Cys-Cys-Ser | 413706.22 | 305649.75 | 364093.45 | 1143944.12 | 2223401.42 | 1230813.31 | |
| Asp-Cys-Gln | 494984.51 | 564313.08 | 559217.59 | 646235.65 | 453815.77 | 563549.70 | |
| Asp-Gly | - | - | - | 642674.88 | 1067371.69 | 921158.02 | |
| Asp-Gly-Arg | 395876.58 | 408944.85 | 372337.08 | 222792.73 | 203853.88 | 194430.55 | |
| Asp-Gly-Arg 2 | 395876.58 | 408944.85 | 372337.08 | 222792.73 | 203853.88 | 194430.55 | |
| Asp-Gly-Pro | 492908.81 | 382569.19 | 373092.56 | 512990.84 | 460676.50 | 566063.90 | |
| Asp-Gly-Pro-Ser | - | - | - | 262754.02 | - | 181168.26 | |
| Aspidofractine | - | - | 96572.70 | - | 561862.73 | 395760.79 | |
| Asp-Leu-Ser-His | - | - | - | - | - | - | |
| Asp-Met-Pro-Pro | - | - | - | 86333.48 | 212273.03 | 325364.08 | |
| Asp-Pro-Ser | 1056151.39 | 1160455.86 | 2219297.29 | 695584.23 | 826041.83 | 1809104.73 | |
| ATP | 38299296.00 | 27989071.33 | 23515475.33 | 36379696.00 | 4704202.17 | 28186082.67 | |
| Behenoylglycine | 794942.79 | 1071392.17 | 947679.79 | 656175.75 | 1378729.67 | 1803229.58 | |
| Bendiocarb | 250008.41 | 296972.85 | 314448.75 | 332209.53 | 468938.35 | 622371.38 | |
| Benzimidazole | - | - | - | - | - | - | |
| beta-Alanyl-L-arginine | 86393.94 | 121463.95 | 99641.79 | 61211.34 | 106743.54 | 188255.04 | |
| beta-Carboline | 724669.77 | 2471203.50 | 1188150.15 | 466862.46 | 569551.49 | 1300156.25 | |
| beta-Citryl-L-glutamic acid | 1630561.92 | 1396824.54 | 1061356.85 | 180945818.67 | 33556828.00 | 161939136.00 | |
| Betaine | 783091797.33 | 833660160.00 | 814347221.33 | 128461261.33 | 132495493.33 | 149998069.33 | |
| Betaine aldehyde | 421824.66 | 459566.12 | 437573.78 | 762308.85 | 843475.27 | 750584.46 | |
| Biotin amide | 2011740.75 | 2422450.92 | 2901616.17 | - | - | - | |
| Bis(2-ethylhexyl)phthalate | 197104170.67 | 112570546.67 | 98298762.67 | 189325968.00 | 126010426.67 | 114508098.67 | |
| Bis(glycerophospho)-glycerol | - | - | - | 2421548.33 | 2117057.08 | 2651612.33 | |
| Boc-Asn | 72001.02 | 92955.88 | 81897.09 | 426978.85 | 246989.33 | 445981.43 | |
| Butenylcarnitine | 141966.89 | 194540.99 | 159233.13 | 131617.66 | 113760.78 | 209340.14 | |
| Calophyllin B | 507222.66 | - | 2230372.33 | - | 16604404.67 | 14854750.67 | |
| Carnosine | - | 62370.81 | 49051.14 | 1858998.79 | 1791955.96 | 1966318.00 | |
| Casein K | 1039010.17 | 793546.92 | 495291.39 | 559414.90 | 107355.36 | 297192.50 | |
| Casein K 2 | 1039010.17 | 793546.92 | 495291.39 | 559414.90 | 107355.36 | 297192.50 | |
| CDP-choline | 447618.14 | 505433.44 | 459641.61 | 19318014.00 | 17004439.00 | 21255865.33 | |
| CDP-ethanolamine | - | - | - | 440732.01 | 457391.16 | 516675.13 | |
| CDP-ribitol | - | - | - | 324243.14 | 304968.34 | 371507.23 | |
| Cerulenin | 3443887.25 | 4085314.42 | 3937517.00 | 999671.73 | 957157.13 | 926582.88 | |
| Chelilutine | 371061.07 | 833347.04 | 834931.83 | 686062.31 | 1288603.25 | 1314727.33 | |
| Choline | 216042336.00 | 251771365.33 | 254695962.67 | 1811247616.00 | 1820293589.33 | 1868306474.67 | |
| Choline phosphate | 24557092.67 | 29408437.33 | 26123408.67 | 200894069.33 | 181861434.67 | 203460917.33 | |
| cis-5-Tetradecenoylcarnitine | 419467.66 | 485539.14 | 448073.95 | 700154.21 | 750399.31 | 594368.77 | |
| CMP | - | - | - | 636184.96 | 453180.86 | 570220.17 | |
| CMP-2-aminoethylphosphonate | 897155.21 | 966728.83 | 1010273.85 | 541182.26 | 570407.26 | 676960.44 | |
| CMP-N-trimethyl-2-aminoethylphosphonate | 8109704.33 | 9063776.67 | 9154060.67 | 1782503.96 | 1659723.54 | 1890491.54 | |
| Codonopsine | 132319.20 | 232914.44 | 106814.73 | 73273.31 | 160937.43 | 141690.51 | |
| Costunolide | 383847.38 | 523189.46 | 221520.67 | 469017.92 | 261109.19 | 466207.99 | |
| Creatine | 1850167125.33 | 1982741333.33 | 1984533888.00 | 2457663061.33 | 2247382357.33 | 2599305472.00 | |
| Creatinine | 33830030.00 | 39280574.67 | 42160877.33 | 35736018.67 | 77268714.67 | 54854122.67 | |
| CTAB | 383612.19 | 502537.86 | 345252.50 | 551199.10 | 525320.57 | 556853.35 | |
| CTP | - | - | - | 403721.66 | - | 277593.77 | |
| Cyclo(deltaAla-L-Val) | 666966.98 | 671503.04 | 835573.25 | 522959.84 | 978888.50 | 731131.46 | |
| cyclo-dopa 5-O-glucoside | - | - | - | 1473034.67 | 1074103.00 | 1619136.17 | |
| Cyclopamine | 10868558.67 | 12006496.00 | 8606764.33 | 193274160.00 | 17864794.67 | 6527900.17 | |
| Cys-Lys-Met-Gln | 299400.49 | 450901.05 | 399404.35 | 458621.38 | - | 273838.19 | |
| Cys-Met-Tyr-Tyr | 882298.25 | 617377.98 | - | 751380.12 | 326513.21 | 219172.29 | |
| Cys-Thr-Cys-Cys | - | - | - | 78296.73 | 235991.23 | 132304.18 | |
| d1-piperidine-dicarboxylate | 208295.87 | 387685.75 | 233447.48 | 434516.71 | 335604.59 | 584336.08 | |
| D-2-Amino-hexano-6-lactam | 3420006.00 | 558696.46 | 539678.95 | 461885.41 | 475492.49 | 466082.24 | |
| Daminozide | 252254.95 | 252109.06 | 1006689.98 | 162908.54 | 9277072.00 | 8022334.00 | |
| Dasytrichone | 4724125.33 | 3230319.08 | 24525556.67 | 2021427.00 | 163026885.33 | 125162037.33 | |
| Deacetoxycephalosporin C | - | - | - | 437745.40 | 642545.85 | 489477.00 | |
| Deoxyvasicinone | 35838.98 | 95224.89 | 36389.15 | 250230.94 | 46080.45 | 133462.17 | |
| Dethiobiotin | 211737.25 | 255628.26 | 284034.90 | 364658.69 | 359656.66 | 377970.08 | |
| D-Galactosamine | 2568074.50 | 2450576.38 | 2841949.17 | 1941403.58 | 2675072.21 | 4352234.67 | |
| D-Galactosamine 2 | 2568074.50 | 2450576.38 | 2841949.17 | 1941403.58 | 2675072.21 | 4352234.67 | |
| D-Glucosamine 6-phosphate | - | - | - | 325209.19 | 273846.21 | 297618.60 | |
| Diacetylhydrazine | 4710187.58 | 4421316.67 | 2195766.04 | 11380415.67 | 574332.81 | 3911894.00 | |
| Diacetylmonoxime | 145925.10 | 151574.21 | 193477.29 | 154582.85 | 235054.56 | 376810.99 | |
| Diethanolamine | 1073145.73 | 292421.58 | 269712.47 | 320866.35 | 290209.68 | 256667.20 | |
| Diethanolamine 2 | 1073145.73 | 292421.58 | 269712.47 | 320866.35 | 290209.68 | 256667.20 | |
| dihydrocapsaicin | 355806.97 | 534180.57 | 145876.11 | 662021.98 | 209033.07 | 842247.69 | |
| Dihydroneopterin phosphate | - | - | - | 169352.81 | 119727.66 | 328724.24 | |
| di-n-Undecylamine | 5674387.17 | 36907897.33 | 4247177.58 | 145669304.00 | 194141072.00 | 155056986.67 | |
| DL-2-Aminooctanoicacid | 67585820.00 | 73855330.67 | 74716962.67 | 5642212.33 | 6070563.83 | 5961294.67 | |
| DL-Methionine sulfone | 70418.10 | 57280.51 | - | 349321.41 | 151150.65 | 297870.36 | |
| DMNT | 1720374.88 | 1236728.67 | 2157677.00 | 1546081.71 | 2570631.25 | 1580108.04 | |
| D-myo-Inositol 1,2-cyclic phosphate | 1859773.25 | 1964112.75 | 2043880.71 | 753192.33 | 477226.22 | 1992391.42 | |
| Dopaminequinone | 524516.26 | 533388.97 | 713479.06 | 491457.79 | 866857.92 | 685504.79 | |
| D-Pipecolicacid | 618595.46 | 727593.33 | 688537.69 | 739237.33 | 780888.21 | 847965.73 | |
| Ectoine | 605435.17 | 997586.52 | 784052.12 | 1370284.71 | 685141.67 | 1058150.52 | |
| Elaidiccarnitine | 51693377.33 | 53449094.67 | 57828192.00 | 5842182.17 | 7119981.00 | 5926823.83 | |
| Epinephrinesulfate | 105264.02 | 92615.96 | 82388.71 | - | - | - | |
| Ergothioneine | 129978181.33 | 144925381.33 | 100519698.67 | 223648.76 | 253783.72 | - | |
| Erythrulose 1-phosphate | 139585.16 | 139348.36 | 237189.01 | 615054.85 | 392233.34 | 928793.54 | |
| [FA (14:2)] 5,8-tetradecadienal | 17755630.67 | 14091946.33 | 25797417.33 | 14250720.67 | 28552184.67 | 16561055.33 | |
| [FA (20:2)] N-(11Z,14Z-eicosadienoyl)-ethanolamine | 830303.31 | 1479338.88 | 1323482.88 | 10692224.00 | 1178408.44 | 658187.83 | |
| [FA (20:5)] 5Z,8Z,11Z,14Z,17Z-eicosapentaenoic acid | 533981.59 | 655006.88 | 381146.29 | 1055802.79 | 689811.31 | 920289.65 | |
| [FA (5:2)] 2,4-pentadienoic acid | 245971.28 | 295855.90 | 277640.16 | - | - | - | |
| [FA (6:0)] O-hexanoyl-R-carnitine | 925648.83 | 909671.02 | 889926.60 | 2977513.17 | 2780175.42 | 2552937.25 | |
| [FA (8:2)] 2,4-octadienal | 760149.29 | 515629.84 | 936523.10 | 710059.88 | 926647.23 | 751767.48 | |
| [FA amino(11:0)] 11-amino-undecanoic acid | 432375.64 | 470132.43 | 486244.02 | 495669.22 | 577022.06 | 602412.52 | |
| [FA hydroxy(9:1)] 4-hydroxy-2-nonenal | 811608.71 | 914162.58 | 1552975.38 | 622210.00 | 1578303.83 | 941195.90 | |
| [FA methyl(4:1)] 3-methyl-2-butenoic acid | 391651.68 | 463735.17 | 448687.63 | 649152.77 | 679947.81 | 716661.33 | |
| [FA methyl,hydroxy,ethyl,dimethyl(22:4)] N-(2R-methyl-3-hydr... | 66921.69 | 162626.23 | 109254.09 | 339030.05 | 65368.30 | 237021.30 | |
| [FA] O-Palmitoyl-R-carnitine | 36316389.33 | 44984018.67 | 43408657.33 | 6608861.50 | 5962870.17 | 6240995.00 | |
| [FA oxo(5:1/5:0/8:0)] (1S,2S)-3-oxo-2-(2Z-pentenyl)-cyclopen... | 968480.67 | 1341938.04 | 840120.25 | 1339295.46 | 942748.46 | 1511880.38 | |
| [FA oxo(6:0)] N-(3-oxo-hexanoyl)-homoserine lactone | 53009.48 | 69563.38 | 77126.86 | 85168.78 | 101693.39 | 131178.48 | |
| Fasoracetam | 507352.12 | 572082.34 | 620578.50 | 376975.68 | 533729.32 | 558706.39 | |
| FMLP | 96250.89 | 120402.52 | 104194.02 | 2135282.33 | 739639.62 | 790596.67 | |
| Folate | 690702.26 | 408810.41 | 408575.02 | 397510.88 | 235495.33 | 434049.05 | |
| Fructoselysine | 1377877.90 | 1332522.77 | 1642474.23 | 1235168.27 | 89563.46 | 1115729.81 | |
| Fructoselysine 2 | 1377877.90 | 1332522.77 | 1642474.23 | 1235168.27 | 89563.46 | 1115729.81 | |
| Fructoselysine 6-phosphate | 55310.89 | - | - | 370281.09 | 372406.18 | 449670.65 | |
| Furfural | 390550.23 | 395538.86 | 634815.88 | 460684.69 | 382317.63 | 490957.48 | |
| [Fv] Desmosdumotin C | 28102374.67 | 905025.17 | 994926.23 | 27537156.00 | 513713.01 | 826339.10 | |
| [Fv] Homoflemingin | 772006.48 | 1191782.08 | 1032782.52 | 590770.42 | 1062599.88 | 815046.83 | |
| [Fv] Ovalitenin A | 1665757.58 | 3327925.25 | 3277737.00 | 859991.46 | 3828810.50 | 3213452.58 | |
| Gamma-Aminobutyryl-lysine | - | - | - | - | 217802.33 | 583506.81 | |
| gamma-Glutamyl-beta-aminopropiononitrile | 2055105.38 | 2442270.54 | 2203696.08 | 1956211.12 | 1949702.25 | 3395145.92 | |
| gamma-Glutamyl-beta-cyanoalanine | 339261.39 | 660963.69 | 1371775.79 | 449868.74 | 1790739.38 | 2571068.25 | |
| gamma-Glutamyl-Se-methylselenocysteine | 83726.86 | 74660.66 | 570120.02 | 156397.85 | 79132.38 | 484779.51 | |
| GDP | 321374.47 | 275188.18 | 259577.22 | 747627.33 | 246704.85 | 624146.40 | |
| Gentianaine | 44712.59 | 46843.34 | 75573.82 | 54327.39 | 142785.43 | 202371.30 | |
| Glabranin | 509115.45 | 1437831.58 | 1668390.08 | - | 1665667.38 | 1546372.29 | |
| Glaucarubolone | 140440.94 | - | 92740.62 | 1166794.69 | 2147414.71 | 1446238.08 | |
| Gln-Leu-Lys-His | - | 70001.27 | 116479.55 | 48824.82 | 1336514.71 | 487655.09 | |
| Glu-Arg | 52541.00 | - | - | - | 73836.59 | 55539.90 | |
| Glu-Arg 2 | 52541.00 | - | - | - | 73836.59 | 55539.90 | |
| Glu-Asp | 74219.01 | 83715.83 | 99169.90 | 3684394.75 | 3337273.50 | 4243647.58 | |
| Glu-Glu-Glu | 134934.05 | 133760.56 | 113094.81 | 282592.17 | 110183.11 | 274932.14 | |
| Glu-Gly | - | - | - | 599895.04 | 624578.94 | 600588.54 | |
| Glu-Lys-Val | 411545.10 | 558515.92 | 454177.26 | 1677719.83 | 1772130.50 | 1649254.04 | |
| Glu-Met-Thr | 368232.95 | 1099715.50 | 1780575.17 | 846829.77 | 3055155.75 | 3239487.67 | |
| Glu-Pro | 409124.60 | 433323.03 | 413227.30 | 1877620.17 | 2123417.71 | 2274924.50 | |
| Glutathione disulfide | 33760892.67 | 33427663.33 | 27721034.00 | 39205208.00 | 14080231.00 | 29702623.33 | |
| Glu-Thr | 1536654.71 | 1606928.58 | 1624977.92 | 1355680.04 | 1211187.62 | 1196519.88 | |
| Glu-Val | 581284.21 | 581542.60 | 522450.73 | 1021704.75 | 1134796.15 | 977041.00 | |
| Glycylprolylhydroxyproline | - | - | - | - | - | - | |
| Gly-Pro-Ser | 346132.96 | 326412.99 | 447137.88 | 392656.08 | 600163.38 | 1061550.42 | |
| GTP | 91172.37 | - | - | 421836.74 | - | 280078.86 | |
| Guanidinoacetate | 522511.55 | 645582.44 | 595697.83 | 759807.69 | 642588.44 | 701795.58 | |
| Gyromitrin | 289079.63 | 336835.97 | 340317.70 | 204083.09 | 251156.82 | 178286.67 | |
| Heptadecanoylcarnitine | 1313936.50 | 1435116.04 | 1453379.21 | 502575.50 | 323182.47 | 398427.54 | |
| Hercynine | 8270577.83 | 8692472.83 | 3020664.46 | 189562.40 | - | 57053.87 | |
| Hercynine 2 | 8270577.83 | 8692472.83 | 3020664.46 | 189562.40 | - | 57053.87 | |
| Hexadecasphinganine | 70867.21 | 92588.27 | 121737.70 | 212340.52 | 230811.78 | 261894.94 | |
| Hexanoylcarnitine | 182283.03 | 206680.61 | 220796.82 | 592870.62 | 541119.48 | 557539.72 | |
| Hexanoylglycine | 1113236.38 | 517151.50 | 562535.82 | 460346.50 | 452131.44 | 625928.75 | |
| Homoarginine | 45995.87 | 47686.66 | 118509.26 | 98754.49 | 324777.44 | 271300.28 | |
| Homocystine | - | - | - | 92130.48 | 154780.12 | 187770.64 | |
| Homostachydrine | 1298958.46 | 1739005.00 | 1579358.42 | 64355.86 | - | 70795.48 | |
| Hydroxybutyrylcarnitine | 3812031.50 | 4347252.83 | 4621410.00 | 1803993.38 | 1793078.92 | 2029473.58 | |
| Hypaphorine | 50715106.67 | 64452709.33 | 52429309.33 | 4351173.83 | 3390221.83 | 3837456.58 | |
| Hypoxanthine | 3641102.08 | 6390759.17 | 4810257.17 | 6515697.83 | 7305582.50 | 4308969.58 | |
| Ile-Met-Met-Thr | 756987.69 | 643736.75 | 760034.67 | 795921.06 | - | 763363.60 | |
| Ile-Pro | 13797041.00 | 16291587.67 | 15279946.33 | 11230507.33 | 11789780.00 | 12615003.00 | |
| Imidazole-4-acetaldehyde | 299914.17 | 277567.37 | 275086.23 | 279432.73 | 258885.42 | 290847.37 | |
| Imidazole-4-acetate | 571853.98 | 736808.96 | 698338.73 | 426176.16 | 457431.16 | 430131.14 | |
| Imidazole lactate | 568081.32 | 636356.02 | 659020.36 | 553221.19 | 479001.94 | 664438.60 | |
| Indole | 885349.77 | 966965.44 | 940686.73 | 687762.46 | 645340.29 | 896834.19 | |
| Indole 2 | 885349.77 | 966965.44 | 940686.73 | 687762.46 | 645340.29 | 896834.19 | |
| Indole-3-acetamide | 623473.77 | 1972508.96 | 1262352.50 | 5614189.17 | - | 1926949.42 | |
| indole-3-acetonitrile oxide | 305321.32 | 582931.09 | 296098.18 | 1882471.54 | 172815.02 | 1219747.75 | |
| Indoleacrylicacid | 6478612.67 | 8574270.50 | 6718402.00 | 464319.69 | 459149.52 | 478391.32 | |
| Indoleamine | 118354.67 | 141537.06 | 152430.53 | 83677.11 | 185841.30 | 73184.59 | |
| Iridodial | 302800.72 | 295812.99 | 773951.88 | 596130.55 | 813470.58 | 381282.00 | |
| Isopyridoxal | 1031178.52 | 1296013.58 | 1056427.35 | 1030448.44 | 1114362.17 | 1190406.58 | |
| Isoquinoline | 227811.86 | 275935.30 | 245626.32 | - | - | - | |
| Isovalerylalanine | 77369.48 | 75738.55 | 74684.39 | 69623.16 | 77974.84 | 125626.25 | |
| (-)-jasmonoyl-L-isoleucine | - | 349721.28 | - | 950505.69 | - | 560838.50 | |
| ketoconazol | - | 540743.06 | - | 1014322.58 | - | 646939.44 | |
| L-1-Pyrroline-3-hydroxy-5-carboxylate | 11302947.00 | 9281293.50 | 11016205.33 | 5246493.67 | 9145841.67 | 9841533.33 | |
| L-1-Pyrroline-3-hydroxy-5-carboxylate 2 | 11302947.00 | 9281293.50 | 11016205.33 | 5246493.67 | 9145841.67 | 9841533.33 | |
| L-2-Amino-6-oxoheptanedioate | 96060.78 | 181398.44 | 150995.83 | 196253.02 | 92737.76 | 159988.53 | |
| Lactosamine | 494703.58 | 708502.04 | 1543354.46 | 431955.91 | 319572.86 | 1570952.75 | |
| L-a-glutamyl-L-Lysine | - | 62969.36 | - | 982232.21 | 1019672.25 | 983840.15 | |
| L-Alanine | 45200572.00 | 44674925.33 | 43828429.33 | 64144026.67 | 60615504.00 | 69186173.33 | |
| L-Arginine | 50430410.67 | 44833321.33 | 45238260.00 | 43807332.00 | 49374974.67 | 51221498.67 | |
| L-Asparagine | 23672464.67 | 22311272.67 | 21843610.00 | 37598041.33 | 38099320.00 | 39441413.33 | |
| L-Carnitine | 330637226.67 | 342164405.33 | 359402752.00 | 152490106.67 | 144513536.00 | 167925514.67 | |
| L-Citrulline | 23186931.33 | 27943068.00 | 28739626.67 | 2679799.08 | 1974776.08 | 1882939.38 | |
| Leu-Ala | 11956696.67 | 14936511.33 | 14442096.67 | 390881.88 | 433214.40 | 442503.79 | |
| Leu-Asn-Ser | 233393.67 | - | 114129.83 | - | - | 409418.06 | |
| Leu-Asp | 197892.51 | 296393.71 | 310970.00 | 818507.02 | 734043.42 | 747720.94 | |
| Leu-Asp-Gln | - | - | 423183.87 | - | 379145.82 | 1063407.53 | |
| Leucyl-leucine | 349179.08 | 228328.79 | 299743.06 | 218784.45 | 337167.04 | 391482.91 | |
| Leu-Gly-Ser | - | - | 320043.12 | - | - | - | |
| Leu-Leu-Pro | 786210.50 | 760782.10 | 679383.92 | 698998.75 | 717966.10 | 749035.85 | |
| Leu-Lys-Asp | 2070529.25 | 2357850.67 | 2373830.75 | 376109.80 | 317167.45 | 327908.95 | |
| Leu-Lys-Pro | 17098773.67 | 17957600.33 | 18495262.67 | 4516442.50 | 5842039.50 | 4816483.83 | |
| Leu-Pro | 24652980.67 | 26982781.33 | 27898086.67 | 15337212.33 | 16378498.00 | 18218313.33 | |
| Leu-Ser | 54590.67 | 97458.51 | 136907.96 | 63150.79 | 321936.26 | 249215.89 | |
| Leu-Thr-Thr | - | - | - | - | 347271.66 | 931394.33 | |
| Leu-Val-Gly | - | - | - | 1213616.00 | 118889.61 | 1116267.85 | |
| L-Glutamate | 79546546.67 | 74329552.00 | 79372245.33 | 86866709.33 | 77049389.33 | 90186754.67 | |
| L-Glutamate methylester | - | 213033.31 | 254718.49 | 256668.53 | 832870.60 | 1182040.83 | |
| L-Glutamine | 314830410.67 | 270523232.00 | 283978197.33 | 637394858.67 | 589673664.00 | 631963338.67 | |
| L-glycyl-L-hydroxyproline | 150314.50 | 169773.63 | 138513.44 | 168288.38 | 259764.68 | 173299.83 | |
| L-Histidine | 79603708.00 | 79548008.67 | 78288208.33 | 59562100.00 | 72574519.33 | 69082927.00 | |
| L-Homocitrulline | 409316.43 | 468568.76 | 393491.36 | - | - | - | |
| L-Homocitrulline 2 | 409316.43 | 468568.76 | 393491.36 | - | - | - | |
| Lichenin | 332285.29 | 367813.70 | 397976.26 | 272972.33 | 334580.10 | 481403.52 | |
| Linamarin | 554532.60 | 551199.82 | 573583.10 | 105210.81 | 83887.70 | 131409.71 | |
| Linatine | 1884229.46 | 1546200.54 | 1306760.44 | 1890036.71 | 156093.89 | 1569362.71 | |
| L-Indospicine | 545442.74 | 687710.73 | 281338.86 | 287597.61 | 51869.03 | 98042.52 | |
| Linoelaidylcarnitine | 31457006.67 | 32215129.33 | 35190659.33 | 3544398.08 | 4517010.17 | 3112752.58 | |
| L-Kynurenine | - | 133657.26 | 253628.39 | 212508.24 | 592507.03 | 455675.08 | |
| L-Leucine | 325745749.33 | 373679242.67 | 348940437.33 | 331436522.67 | 353451850.67 | 401393376.00 | |
| L-Lysine | 45136641.33 | 41169425.33 | 42659485.33 | 52905362.67 | 60447658.67 | 57776276.00 | |
| L-Lysine 1,6-lactam | 859031.12 | 771348.33 | 3576712.42 | 770549.60 | 8113090.83 | 6532279.83 | |
| L-Methionine | 117590429.33 | 148280394.67 | 133924466.67 | 101854957.33 | 75681216.00 | 104188290.67 | |
| L-Methionine S-oxide | 39286730.67 | 50694412.00 | 61690420.00 | 68054521.33 | 120987352.00 | 91915093.33 | |
| Lophophorine | 675005.71 | 801185.54 | 300957.27 | 165510.47 | - | 500702.81 | |
| L-Ornithine | 12008162.33 | 13279099.00 | 11885249.67 | 13519409.00 | 16984973.67 | 14407352.67 | |
| L-Phenylalanine | 165569264.00 | 210341552.00 | 189323973.33 | 128045912.00 | 143455080.00 | 156428661.33 | |
| L-Pipecolate | 3053271.58 | 3250342.67 | 3160583.92 | 1168579.46 | 6154078.83 | 2596333.83 | |
| L-Pipecolate 2 | 3053271.58 | 3250342.67 | 3160583.92 | 1168579.46 | 6154078.83 | 2596333.83 | |
| L-Proline | 729060010.67 | 747689109.33 | 707707648.00 | 685559701.33 | 792134144.00 | 726022464.00 | |
| L-proline amide | 248417.82 | 436120.70 | 597062.66 | 238778.64 | 1061679.29 | 1040762.79 | |
| L-Serine | 23454354.00 | 25552044.67 | 24064803.33 | 39263224.00 | 37216756.00 | 40642384.00 | |
| L-thiazolidine-4-carboxylate | 11913552.67 | 11601017.33 | 6440399.00 | 4465295.58 | 5680217.17 | 10945552.83 | |
| L-Tryptophan | 38078844.00 | 44608273.33 | 40036397.33 | 27763324.67 | 30463167.33 | 36058252.67 | |
| L-Tyrosine | 195116992.00 | 196639109.33 | 193100944.00 | 162000320.00 | 175412170.67 | 179142805.33 | |
| L-Tyrosyl-L-arginine | - | - | - | 370457.38 | 388116.83 | 343111.03 | |
| L-Valine | 272919850.67 | 281689317.33 | 281342885.33 | 213326970.67 | 268162400.00 | 252488944.00 | |
| Lys-Asn-Gly | 46309.57 | - | 54855.52 | 463573.84 | 514201.64 | 420400.49 | |
| Lys-Asp-Gly | 415099.22 | 523839.02 | 569749.70 | 458858.66 | 609822.44 | 542895.42 | |
| Lysergic acid | 188326.20 | 209090.66 | 192782.65 | 94535.48 | 185170.31 | 62949.70 | |
| Lys-Lys-Met-Pro | 185660.34 | 115746.52 | 25298.05 | 196138.49 | 98592.89 | 15720.56 | |
| LysoPC(17:0) | 4262829.25 | 4072393.50 | 4445243.00 | 4729895.00 | 3730642.50 | 4405213.83 | |
| LysoPC(18:0) | 149731717.33 | 136699848.00 | 149321594.67 | 144111560.00 | 131756437.33 | 142575786.67 | |
| LysoPC(18:1(9Z)) | 29742074.00 | 30463386.67 | 29613454.00 | 40053020.00 | 27373779.33 | 33249036.67 | |
| LysoPC(20:1(11Z)) | 650754.39 | 568184.92 | 689494.98 | 566124.51 | 456763.12 | 542226.94 | |
| LysoPC(20:4(5Z,8Z,11Z,14Z)) | 8143633.50 | 7801870.67 | 7387921.83 | 36000089.33 | 17732159.33 | 20655674.67 | |
| LysoPC(22:4(7Z,10Z,13Z,16Z)) | 711438.92 | 581761.90 | 645625.51 | 4229280.92 | 1640388.54 | 2108328.71 | |
| LysoPC(O-18:0) | 1463117.25 | 1519362.62 | 1500915.62 | 1831081.54 | 1656777.46 | 1890049.62 | |
| LysoPE(0:0/18:2(9Z,12Z)) | 1209861.04 | 1211692.92 | 982435.62 | 2727472.83 | 1156225.60 | 1950018.38 | |
| LysoPE(0:0/20:5(5Z,8Z,11Z,14Z,17Z)) | 2077222.96 | 1392659.12 | 1676047.92 | 6273150.83 | 1338728.04 | 1893402.92 | |
| LysoPE(0:0/22:4(7Z,10Z,13Z,16Z)) | 7813492.33 | 5800626.00 | 6589592.00 | 27956939.33 | 12822990.33 | 16027099.67 | |
| LysoPE(0:0/22:5(4Z,7Z,10Z,13Z,16Z)) | 7265651.33 | 4862607.33 | 6255474.17 | 13003955.00 | 6513915.67 | 7893211.17 | |
| LysoPE(0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) | 5243376.83 | 3805241.83 | 5310526.00 | 10258662.00 | 5200711.00 | 5537460.83 | |
| Lys-Pro | - | - | - | - | 1618745.58 | 1118349.77 | |
| Lys-Ser-Ser-Ser | - | - | - | - | - | - | |
| Lys-Trp-Asn | 140862.69 | 218192.36 | 194672.70 | 737191.25 | 584458.31 | 787550.54 | |
| Lys-Val | 8310224.33 | 8910380.50 | 8402994.17 | 30193972.67 | 37137858.67 | 33288120.67 | |
| Lys-Val-Val | 1832219.04 | 1908207.92 | 946205.50 | 655772.88 | 93822.47 | 387041.05 | |
| Maleimide | - | - | 77305.97 | 324212.30 | 307276.74 | 545610.42 | |
| Maltose | - | - | - | 409847.24 | 297379.85 | 429032.59 | |
| Medicagol | 37510716.00 | 23447006.67 | 21193020.00 | 33703217.33 | 24308550.00 | 23868294.00 | |
| metabolite 1 | 6524522.50 | 7083563.33 | 5471208.33 | 8455501.67 | 6772769.33 | 7814587.83 | |
| metabolite 2 | 267253.34 | 210567.98 | 274716.51 | 390648.16 | 201954.22 | 250272.06 | |
| metabolite 3 | 229836.42 | 220240.10 | 1016508.40 | 556400.28 | 431735.15 | 1428997.75 | |
| metabolite 4 | 53319.71 | 125154.52 | 60812.94 | 56330.69 | 75835.34 | 46484.03 | |
| Met-Ala-Gly | 1061800.54 | 1274254.00 | 1830816.17 | - | - | - | |
| Met-Ala-Tyr | - | - | - | - | - | - | |
| Met-Asp-Gly | - | - | 320630.32 | - | 311006.47 | 300529.35 | |
| Met-Gly | - | - | 307731.17 | 437059.85 | 1317071.17 | 854319.52 | |
| methiin | 1810502.67 | 1614590.50 | 1603029.29 | 2124378.17 | 2613817.75 | 2622464.33 | |
| Methyl 2-diazoacetamidohexonate | 4135777.25 | 4567185.42 | 5879686.83 | - | - | - | |
| Methyl cinnamate | 1035702.23 | 206828.91 | 291870.58 | 212879.32 | 715740.68 | 1043202.00 | |
| Met-Met-Gln | - | - | - | 263360.53 | - | 222427.83 | |
| Met-Met-Met | 287037.52 | 346069.65 | 414600.85 | 148678.05 | 1085509.90 | 578651.92 | |
| Met-Met-Val | 55434000.00 | 45255330.67 | 42350596.00 | 57917468.00 | 5223365.25 | 46743568.00 | |
| Met-Thr-Asp | 645993.21 | 859633.15 | 867668.94 | 2556436.83 | 2305573.58 | 2581388.17 | |
| Met-Trp-Trp-Tyr | - | - | 229659.32 | - | - | 248863.46 | |
| mildronate | 465462.32 | 561083.96 | 612888.65 | 2090069.42 | 3043329.67 | 2659745.00 | |
| N1-Methyl-2-pyridone-5-carboxamide | 808500.42 | 919875.62 | 896740.10 | 687051.42 | 747876.54 | 920843.46 | |
| N1-Methyl-4-pyridone-5-carboxamide | - | - | 232400.12 | - | 170921.48 | 337485.16 | |
| N1,N8-diacetylspermidine | 150868.21 | 174758.39 | 98964.18 | 1020103.27 | 855163.21 | 1211748.21 | |
| N-(2,3-Dihydroxybenzoyl)-L-serine | - | - | - | 11966092.33 | 10870083.00 | 11980977.33 | |
| N2-Acetyl-L-lysine | 902150.23 | 1048324.90 | 1158607.25 | 1041910.10 | 1058450.83 | 1135423.17 | |
| N2-(D-1-Carboxyethyl)-L-arginine | 555518.43 | 590440.45 | 644557.30 | 316789.40 | 314562.15 | 414171.41 | |
| N2-(D-1-Carboxyethyl)-L-lysine | 606437.53 | 630793.25 | 562760.77 | 1220658.69 | 922736.29 | 1324601.65 | |
| N2-Succinyl-L-arginine | 174260.08 | 107288.85 | 137599.18 | 85318.38 | 329941.96 | 266366.91 | |
| N2-Succinyl-L-ornithine | 183851.83 | 213503.60 | 190441.49 | 650838.60 | 612752.35 | 701197.98 | |
| N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoate | 508933.95 | 551289.09 | 536569.73 | 377492.80 | 327613.72 | 623038.75 | |
| N-(3-acetamidopropyl)-4-aminobutanal | 65495.97 | 65607.89 | 117668.59 | 154639.39 | 2885650.83 | 879145.90 | |
| N-(3-Oxooctanoyl)homoserine lactone | - | 159172.33 | - | 546965.03 | - | 222736.12 | |
| N4-Acetylaminobutanal | 870499.54 | 882417.60 | 2094492.33 | 796848.90 | 4114564.17 | 1093134.08 | |
| N5-acetyl-N5-hydroxy-L-ornithine | 211047.37 | 295465.09 | 1051309.17 | 150652.80 | 1783367.21 | 2517469.29 | |
| N5-(L-1-Carboxyethyl)-L-ornithine | 282505.74 | 408726.38 | 311757.96 | 207830.79 | 224882.09 | 356698.55 | |
| N6-Acetyl-L-lysine | 3505678.75 | 4749138.67 | 4504997.00 | 3192370.00 | 2883914.33 | 3158880.83 | |
| N6-Acetyl-N6-hydroxy-L-lysine | 510601.23 | 582362.83 | 2089454.71 | 1833646.83 | 3312707.83 | 5337810.42 | |
| N6-Acetyl-N6-hydroxy-L-lysine 2 | 510601.23 | 582362.83 | 2089454.71 | 1833646.83 | 3312707.83 | 5337810.42 | |
| N6-Hydroxy-L-lysine | - | - | - | 55437.80 | 75581.44 | 67601.36 | |
| N6-Methyl-L-lysine | 163009.25 | 172073.38 | 172681.26 | 424053.86 | 562564.67 | 504742.43 | |
| N6,N6-Dimethyladenosine | - | - | - | 170336.33 | - | 140921.72 | |
| N6,N6,N6-Trimethyl-L-lysine | 21394003.33 | 25342022.67 | 23349021.33 | 131777293.33 | 127780693.33 | 126071197.33 | |
| N-Acetyl-ala-ala-ala-methylester | - | - | - | - | - | - | |
| N-Acetyl-aspartyl-glutamate | 258218.48 | 273431.71 | 225345.70 | - | 209738.41 | 300703.40 | |
| N-Acetyl-aspartyl-glutamate 2 | 258218.48 | 273431.71 | 225345.70 | - | 209738.41 | 300703.40 | |
| N-Acetyl-aspartyl-glutamate 3 | 258218.48 | 273431.71 | 225345.70 | - | 209738.41 | 300703.40 | |
| N-acetyl-demethylphophinothricin | 253518.71 | 486340.06 | 420755.66 | 398696.78 | 329939.69 | 435664.51 | |
| N-acetyl -D- glucosaminitol | 875585.81 | 1186743.60 | 1044830.81 | 424888.20 | 506493.65 | 576519.66 | |
| N-acetyl -D- glucosaminitol 2 | 875585.81 | 1186743.60 | 1044830.81 | 424888.20 | 506493.65 | 576519.66 | |
| N-Acetylindoxyl | 47992297.33 | 48854601.33 | 47484060.00 | 26891026.00 | 31440344.67 | 31029672.00 | |
| N-acetyl-(L)-arginine | 459293.53 | 354125.48 | 452144.90 | 580384.65 | 745454.27 | 834549.00 | |
| N-Acetyl-L-citrulline | 436998986.67 | 347821909.33 | 430683605.33 | 203141578.67 | 356160000.00 | 359353600.00 | |
| N-Acetyl-L-glutamate | 193006.89 | 230311.86 | 199147.86 | 780085.56 | 706526.44 | 879120.27 | |
| N-Acetylornithine | 306235.45 | 367113.57 | 384289.14 | 283295.04 | 261830.05 | 457710.29 | |
| N-Acetylputrescine | 15981642.00 | 15836589.33 | 14440581.33 | 58817652.00 | 59610794.67 | 52199118.67 | |
| N-Acetylvanilalanine | - | - | - | - | - | - | |
| NAD+ | 18788638.00 | 17435841.67 | 23230454.67 | 55578497.33 | 45866522.67 | 62255576.00 | |
| NADP+ | 4109000.17 | 3995877.33 | 3382239.08 | 4940531.67 | 2226893.88 | 4589431.67 | |
| N-Benzyloxycarbonylglycine | 1451623.42 | 1672106.29 | 747238.77 | 1682176.25 | 1146289.25 | 1230491.29 | |
| N-Carbamoyl-L-aspartate | 650339.12 | 691916.88 | 659144.96 | 197260.64 | 171100.55 | 255786.99 | |
| N-Carbamyl-L-glutamate | 241858.44 | 275530.52 | 304369.31 | 2193527.54 | 2436367.92 | 2596004.92 | |
| N-Decanoylglycine | 1264055.88 | 1511716.38 | 918640.46 | 657701.75 | 668269.08 | 1547561.29 | |
| N-dimethylethanolamine | 271710.47 | 328423.45 | 335196.39 | 386392.99 | 302867.35 | 320757.93 | |
| Ne,Ne dimethyllysine | 649812.77 | 689222.56 | 645731.48 | 7216789.67 | 6364690.17 | 7330834.17 | |
| Neopterin | 136589.47 | 79348.41 | 91268.02 | 1421169.38 | 1414228.75 | 1627579.33 | |
| N-Ethylglycocyamine | 63026.04 | 168491.46 | 228950.31 | 93431.44 | 91479.48 | 263376.77 | |
| N-Ethylmaleimide | 885148.62 | 1044291.79 | 964548.50 | 1299561.35 | 1484861.08 | 1622322.00 | |
| N-Ethylmaleimide 2 | 885148.62 | 1044291.79 | 964548.50 | 1299561.35 | 1484861.08 | 1622322.00 | |
| N-ethylsuccinimide | 2950963.50 | 3028624.75 | 4310871.92 | 2602455.67 | 5135367.00 | 8605527.00 | |
| N-Formimino-L-glutamate | 217210.05 | 223461.59 | 127301.19 | 305938.81 | 131810.61 | 204898.04 | |
| NG,NG-Dimethyl-L-arginine | 281936.11 | 293803.60 | 260154.96 | 2767890.75 | 2360272.12 | 2327261.25 | |
| N-Heptanoylhomoserine lactone | 238170.02 | 289359.05 | 258137.48 | 439813.90 | 265113.97 | 343672.68 | |
| N-hydroxyvaline | 1022246.49 | 1318992.79 | 1064637.76 | 3590502.75 | 2239033.29 | 3497130.17 | |
| Nicotinamide | 133941669.33 | 143674021.33 | 149947776.00 | 92409626.67 | 118519026.67 | 108994445.33 | |
| nicotinamide riboside | 104195.50 | 102037.05 | 89385.88 | 126111.59 | 107169.43 | 132665.16 | |
| nitrocyclohexane | 260274.43 | 264657.04 | 354780.36 | 313205.90 | 367175.27 | 401361.86 | |
| N,N-Dimethylglycine | 2219567.00 | 2588963.54 | 2505208.54 | 2259910.21 | 2376405.92 | 2519912.83 | |
| N-Nonanoylglycine | 473273.81 | 555068.28 | 582505.76 | 723716.10 | 310423.47 | 379642.55 | |
| N-(octanoyl)-L-homoserine | 3874679.00 | 4078917.08 | 3707002.33 | 2400567.42 | 2206310.71 | 2608789.50 | |
| nornorcapsaicin | 1604507.17 | 1839168.88 | 1081123.92 | 755703.58 | 836194.56 | 2075415.42 | |
| N-palmitoyl phenylalanine | 615396.67 | 541653.17 | 577758.40 | 282756.42 | 617225.94 | 759102.54 | |
| N(pi)-Methyl-L-histidine | 1999058.88 | 2084982.62 | 2146349.17 | 1960960.17 | 2172872.54 | 2201036.83 | |
| N-stearoyl histidine | 69602.15 | - | - | 498351.32 | 185210.22 | 364364.04 | |
| N-stearoyl tyrosine | 3242713.00 | 3574788.50 | 4396066.17 | 193198.06 | 182406.80 | - | |
| N-succinyl-L-citrulline | 1312426.27 | 1209277.71 | 4216216.33 | 354509.55 | 4717731.00 | 13298291.33 | |
| O-Acetylcarnitine | 422339584.00 | 480446112.00 | 448149045.33 | 780032213.33 | 767380800.00 | 877408469.33 | |
| O-Acetylcarnitine 2 | 422339584.00 | 480446112.00 | 448149045.33 | 780032213.33 | 767380800.00 | 877408469.33 | |
| O-Acetylneuraminic acid | 1112911.56 | 943303.21 | 1378409.21 | 1168094.92 | 898674.04 | 1375693.38 | |
| O-Butanoylcarnitine | 10351205.67 | 12438873.67 | 11816687.33 | 4762256.17 | 4069034.00 | 4281244.25 | |
| Octylamine | 4154066.75 | 11152918.33 | 8994000.17 | 2629690.42 | 18068755.67 | 9382736.67 | |
| O-Phospho-L-serine | - | - | - | 350454.56 | 261210.95 | 338117.97 | |
| O-Propanoylcarnitine | 53171540.00 | 67774248.00 | 71478082.67 | 18203217.33 | 19876490.67 | 20801132.00 | |
| O-Succinyl-L-homoserine | 1059239.10 | 1308809.90 | 1599180.75 | 5364777.33 | 2289912.04 | 8272965.33 | |
| O-Succinyl-L-homoserine 2 | 1059239.10 | 1308809.90 | 1599180.75 | 5364777.33 | 2289912.04 | 8272965.33 | |
| Ovothiol disulfide | 369062.68 | 523357.92 | 358034.78 | - | - | - | |
| p-aminobenzoyl glutamate | 143836.66 | 104566.61 | - | 278598.45 | 92431.55 | 248130.15 | |
| [PC (14:0/18:1)] 1-tetradecanoyl-2-(11Z-octadecenoyl)-sn-gly... | 11899890.67 | 12358321.67 | 13827824.67 | 11793652.33 | 12255095.33 | 12833492.33 | |
| [PC (14:0/18:2)] 1-tetradecanoyl-2-(9Z,12Z-octadecadienoyl)-... | 1339865.17 | 1271073.08 | 1496812.29 | 1568862.21 | 1823747.62 | 1593093.21 | |
| [PC (14:0)] 1-tetradecanoyl-sn-glycero-3-phosphocholine | 1518640.21 | 1641801.17 | 1590936.17 | 1480135.92 | 1169175.08 | 1486932.92 | |
| PC(14:1(9Z)/15:0) | 1230832.96 | 1127680.88 | 1290259.25 | 293181.41 | 264680.38 | 287307.22 | |
| [PC (15:0/15:0)] 1,2-dipentadecanoyl-sn-glycero-3-phosphocho... | 3333751.83 | 3529124.33 | 3820896.58 | 3040534.92 | 2730313.75 | 3435492.17 | |
| [PC (15:0)] 1-pentadecanoyl-sn-glycero-3-phosphocholine | 1652091.08 | 2357297.83 | 2244603.92 | 1718358.90 | 1537668.92 | 2383713.83 | |
| [PC (16:0/16:0)] 1-hexadecanoyl-2-hexadecanoyl-sn-glycero-3-... | 16769938.33 | 18354269.67 | 16018234.67 | 42200798.67 | 37184297.33 | 44650644.00 | |
| [PC (16:0/18:1)] 1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glyc... | 160815840.00 | 179497813.33 | 164385690.67 | 177376085.33 | 172217450.67 | 188085744.00 | |
| [PC (16:0/18:2)] 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-s... | 154537888.00 | 163868512.00 | 161381845.33 | 79488760.00 | 79535629.33 | 78046466.67 | |
| [PC (16:0/18:3)] 1-hexadecanoyl-2-(9Z,12Z,15Z-octadecatrieno... | 5362578.17 | 5308905.83 | 6162743.17 | 4980565.50 | 5011893.50 | 4347946.00 | |
| [PC (16:0)] 1-hexadecanoyl-sn-glycero-3-phosphocholine | 247809664.00 | 240580165.33 | 255544698.67 | 240335317.33 | 222897872.00 | 247057813.33 | |
| [PC (16:0/20:4)] 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetra... | 55990969.33 | 55211616.00 | 61959273.33 | 108110213.33 | 115645336.00 | 93660882.67 | |
| [PC (16:0/22:6)] 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-doc... | 14188520.33 | 14300126.33 | 17077978.67 | 11483484.67 | 11826284.00 | 10784315.00 | |
| [PC (16:0/3:0)] 1-hexadecanoyl-2-(2E-propionyl)-sn-glycero-3... | - | 313789.75 | 671660.69 | 338654.25 | 3782868.75 | 1300688.35 | |
| PC(16:0/5:0(CHO)) | 2613757.92 | 5153684.83 | 2683425.08 | 9964474.67 | 5837936.00 | 14021566.00 | |
| PC(16:0/5:0(COOH)) | 1540166.50 | 2982481.33 | 2342533.83 | 1910434.67 | 3102472.25 | 6558534.17 | |
| PC(16:0/P-18:1(11Z)) | 2655096.58 | 2814334.50 | 2558318.08 | 1824644.38 | 2399025.71 | 2553776.79 | |
| [PC (16:1)] 1-(1Z-hexadecenyl)-sn-glycero-3-phosphocholine | 2063962.58 | 2060757.25 | 2169576.83 | 697285.71 | 1517623.67 | 1101241.50 | |
| [PC (16:2)] 1-hexadecyl-sn-glycero-3-phosphocholine | 4327638.75 | 4143742.58 | 4474576.17 | 5328665.17 | 4063139.67 | 4832554.17 | |
| [PC (18:0/22:4)] 1-octadecanoyl-2-(7Z,10Z,13Z,16Z-docosatetr... | 1488815.25 | 1643976.29 | 1816280.83 | 2109371.96 | 1881228.46 | 1616151.46 | |
| [PC (18:0/22:5)] 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosap... | 3236860.50 | 3542575.92 | 4209672.42 | 3400423.58 | 3228973.83 | 2771387.92 | |
| PC(18:0/P-18:1(11Z)) | 898775.19 | 1044483.00 | - | 4665196.50 | 4875998.75 | 5430789.17 | |
| [PC (18:1)] 1-(11Z-octadecenyl)-sn-glycero-3-phosphocholine | 1770831.04 | 1924256.62 | 2026310.29 | 1993791.79 | 2085122.96 | 2123768.50 | |
| [PC (18:1/18:1)] 1-(9Z-octadecenoyl)-2-(9Z-octadecenoyl)-sn-... | 61063086.67 | 63393838.67 | 62118697.33 | 24609457.33 | 24668484.67 | 22680533.33 | |
| [PC (18:1/20:3)] 1-(9Z-octadecenoyl)-2-(5Z,8Z,11Z-eicosatrie... | 27923100.67 | 28109263.33 | 31526464.00 | 37583678.67 | 38446150.67 | 32454136.67 | |
| [PC (18:1/22:5)] 1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-... | 5270734.67 | 5379639.00 | 5989414.00 | 3571111.00 | 3241570.25 | 2961422.50 | |
| [PC (18:2)] 1-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoc... | 17792412.33 | 17991360.00 | 18476062.00 | 15461793.00 | 15441852.67 | 14147632.67 | |
| [PC (19:3)] 1-(10Z,13Z,16Z-nonadecatrienoyl)-sn-glycero-3-ph... | 543906.75 | 194807.61 | - | 11519672.67 | 5032609.17 | 6731528.50 | |
| PC(22:2(13Z,16Z)/P-18:1(11Z)) | 797941.00 | 794634.56 | 930273.60 | 1808955.62 | 1757575.62 | 1559437.12 | |
| PC(22:4(7Z,10Z,13Z,16Z)/P-18:0) | 1296456.23 | 1186415.79 | 1291588.00 | 3277330.25 | 3699166.17 | 2782245.92 | |
| PC(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z)) | 979174.12 | 1031332.65 | 1106727.17 | 3071242.17 | 3729862.25 | 2956955.00 | |
| [PC (22:6)] 1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-gly... | 1331537.04 | 881827.73 | 1275402.96 | 2387147.25 | 1508799.62 | 1348527.75 | |
| [PC acetyl(16:1)] 1-(9Z-hexadecenoyl)-2-acetyl-sn-glycero-3-... | 859523.35 | 981985.48 | 451914.49 | 2736682.67 | 597429.54 | 1078107.04 | |
| [PE (16:0/16:0)] 1,2-dihexadecanoyl-sn-glycero-3-phosphoetha... | 1000330.15 | 1146696.67 | 1083035.40 | 284068.81 | 245341.81 | 298647.73 | |
| [PE (16:0/18:2)] 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-s... | 2578799.58 | 2348691.50 | 2632366.17 | 1680196.17 | 1291958.50 | 1488130.00 | |
| [PE (16:0/18:3)] 1-hexadecanoyl-2-(9Z,12Z,15Z-octadecatrieno... | 830337.94 | 826500.75 | 956733.52 | 320654.72 | 286422.48 | 252952.62 | |
| [PE (16:0/20:4)] 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetra... | 7180861.00 | 6922654.17 | 7721948.67 | 9710431.17 | 9993116.33 | 7985019.17 | |
| [PE (16:0/22:6)] 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-doc... | 3123976.83 | 3308922.67 | 3669528.08 | 4391301.92 | 3738761.75 | 3744948.50 | |
| [PE (18:0)] 1-octadecanoyl-sn-glycero-3-phosphoethanolamine | 1635696.58 | 1661428.50 | 1612014.96 | 2312557.04 | 1563266.42 | 2232192.12 | |
| [PE (18:1)] 1-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanola... | 3231718.08 | 3765104.92 | 2568611.92 | 10229029.00 | 4801010.83 | 7553084.00 | |
| [PE (18:1/20:4)] 1-(1Z-octadecenyl)-2-(5Z,8Z,11Z,14Z-eicosat... | 8852782.83 | 8113764.00 | 10149901.67 | 3393867.92 | 6266329.33 | 4061701.08 | |
| PE(18:3(6Z,9Z,12Z)/P-18:1(11Z)) | 3882634.33 | 3872238.42 | 4066258.08 | 1456785.00 | 2528007.25 | 1616233.79 | |
| [PE (20:4)] 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-... | 23983716.67 | 17529465.33 | 19349545.33 | 84656522.67 | 43719892.00 | 49684221.33 | |
| PE(20:4(5Z,8Z,11Z,14Z)/P-18:1(11Z)) | 5400426.17 | 5577913.17 | 6535137.17 | 2137864.75 | 4624683.25 | 2139562.50 | |
| PE(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z)) | 3118857.42 | 3077308.17 | 3813214.33 | 1057156.98 | 1846265.12 | 1186522.42 | |
| Perillyl alcohol | 6938135.83 | 5403857.50 | 9575049.33 | 6317801.00 | 11635456.33 | 6716900.83 | |
| Phe-Gly | 1197286.98 | 994494.12 | 566485.56 | 351218.21 | - | 180547.51 | |
| Phenylethylmalonamide | 1764899.67 | 1801642.71 | 946775.44 | 562557.89 | - | 363333.51 | |
| Phe-Pro | 482168.17 | 752070.29 | 816153.71 | - | 90697.86 | 73360.22 | |
| Phe-Trp | 2811905.54 | 3638224.50 | 3643885.04 | 4470891.00 | 9694547.67 | 11106182.67 | |
| Phosphocreatine | 453767.76 | 460736.68 | 429522.21 | 21051081.33 | 13713163.00 | 19408668.67 | |
| Phosphonoacetaldehyde | 308387.75 | 408267.10 | 422302.94 | 828609.44 | 753820.62 | 886762.54 | |
| Picolinamide | 9080154.33 | 10096839.67 | 9130536.33 | 21618767.33 | 20807472.67 | 24527344.67 | |
| Piperidine | 240114.56 | 240947.17 | 244717.05 | 297536.43 | 246471.18 | 230689.79 | |
| Pro-Arg-His | 555294.95 | 616077.81 | 576445.62 | 581131.33 | 598688.92 | 618578.51 | |
| Pro-Arg-His 2 | 555294.95 | 616077.81 | 576445.62 | 581131.33 | 598688.92 | 618578.51 | |
| Pro-Pro | 96523.26 | 238089.95 | 100355.88 | 552099.52 | 197821.97 | 370240.31 | |
| Pro-Ser-Ser | 1404792.33 | 1370348.04 | 1414829.04 | 297037.07 | 340577.75 | 535626.60 | |
| Protoporphyrin | - | - | - | 1570998.62 | 569562.43 | 1045640.85 | |
| PS(12:0/15:0) | 3150178.33 | 3988317.00 | 3102525.17 | 1586993.58 | 1536781.21 | 3395831.58 | |
| PS(18:0/18:1(9Z)) | 2494412.17 | 5172229.67 | 1821831.12 | 3508036.67 | 2247873.67 | 5222419.50 | |
| [PS (18:0/20:4)] 1-octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetra... | 42438176.00 | 40299118.67 | 46914113.33 | 40210056.00 | 42611792.00 | 36743833.33 | |
| PS(18:0/22:5(7Z,10Z,13Z,16Z,19Z)) | 10885415.67 | 9474997.33 | 11844802.67 | 5822665.83 | 6073702.50 | 5089293.17 | |
| PS(22:1(11Z)/0:0) | 1022335.25 | 1766648.71 | 975167.10 | 1932504.42 | 881306.48 | 2297428.29 | |
| PS(36:2) | 1409058.17 | 2950198.92 | 1455268.83 | 4246359.50 | 1175871.71 | 1756980.46 | |
| PS(38:2) | 1311810.12 | 2111060.46 | 1067786.25 | 2097923.92 | 1576390.25 | 3001154.42 | |
| PS(38:5) | 5978132.33 | 5508306.00 | 6338590.00 | 6865290.00 | 7033480.33 | 5646082.67 | |
| PS(40:4) | 4710231.50 | 4666638.00 | 5504869.67 | 4200513.75 | 4045333.75 | 3673865.67 | |
| psicoselysine | 367620.89 | 440596.44 | 508305.95 | 628109.20 | 263113.87 | 934024.69 | |
| PS(O-16:0/22:2(13Z,16Z)) | 2678478.25 | 2871692.58 | 1580737.12 | 3139682.67 | 1166047.58 | 1698178.50 | |
| PS(O-18:0/20:3(8Z,11Z,14Z)) | 2498063.17 | 3258263.33 | 1778213.17 | 4886434.00 | 2376381.83 | 3322189.08 | |
| PS(O-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) | - | 937968.28 | - | 4219738.08 | 868971.62 | 1855162.58 | |
| PS(O-18:0/22:4(7Z,10Z,13Z,16Z)) | 1517134.00 | 1216204.25 | 987736.35 | 2978287.58 | 2291521.71 | 2787379.08 | |
| PS(O-20:0/20:5(5Z,8Z,11Z,14Z,17Z)) | 1200154.88 | 1234540.47 | 961555.62 | 3182661.17 | 1585216.42 | 1821020.08 | |
| Pyridoxal | 28621441.33 | 31348418.00 | 39848628.00 | 14501408.67 | 50308700.00 | 28224928.00 | |
| Pyridoxamine | 1098742.17 | 1193066.17 | 1352790.62 | 953970.21 | 2233893.67 | 1360697.12 | |
| Pyridoxine | 937053.90 | 928696.10 | 745968.27 | 2512427.00 | 2299624.00 | 2798959.83 | |
| Quinolin-2-ol | - | 244637.44 | - | 319694.41 | - | 161601.02 | |
| Retronecine | 474085.65 | 594563.27 | 612484.24 | 62157.36 | 75582.40 | 73095.67 | |
| Riboflavin | 129281.67 | 155303.66 | 133554.01 | 133674.93 | 93367.72 | 249422.32 | |
| Ricinine | 267556.70 | 265530.72 | 248111.78 | 156346.57 | 174279.48 | 241290.03 | |
| S-Adenosyl-L-homocysteine | 521033.38 | 1117154.54 | 1120096.56 | 740796.25 | 392478.69 | 295064.53 | |
| S-Adenosyl-L-methionine | 745094.35 | 821218.81 | 949066.85 | 1208034.00 | 2625800.42 | 1615255.96 | |
| (-)-Salsolinol | 71729.27 | 59620.61 | 60749.46 | 65996.88 | 76704.85 | 84869.79 | |
| Sanguinarine | 141531.06 | 200672.28 | 398166.82 | 170718.26 | 709686.83 | 274146.69 | |
| S-Butyl-DL-homocysteine-[S,R]-sulfoximine | - | 78524.03 | - | 110288.15 | 144576.67 | 188380.32 | |
| (S)-Coclaurine | 141714.53 | 141386.27 | 152633.24 | 138796.34 | 154418.74 | 123794.59 | |
| Slaframine | 6942626.00 | 6913063.17 | 6831598.50 | 4221908.58 | 4351382.17 | 4684994.25 | |
| Slaframine 2 | 6942626.00 | 6913063.17 | 6831598.50 | 4221908.58 | 4351382.17 | 4684994.25 | |
| SM(d16:1/18:1) | 8476010.17 | 7525710.17 | 8762908.00 | 6905909.17 | 7020933.67 | 7351813.00 | |
| SM(d16:1/22:1) | 709076.85 | 688079.54 | 575855.26 | 440095.74 | 472501.66 | 650235.85 | |
| SM(d18:0/24:1(15Z)(OH)) | 735307.19 | 768756.06 | 368430.33 | 2859378.58 | 781476.69 | 1243663.67 | |
| SM(d18:1/14:0) | 5724074.50 | 5530834.08 | 6787306.83 | 4471377.50 | 4229181.25 | 4681671.08 | |
| SM(d18:1/17:0) | 219217.24 | 230316.33 | 210274.47 | 115928.17 | 94590.86 | 152058.20 | |
| SM(d18:1/18:0) | 578687.72 | 574303.88 | 397895.36 | 454064.97 | 420416.68 | 552867.15 | |
| SM(d18:1/18:1(9Z)) | 2872500.54 | 2625700.25 | 3089545.25 | 2303984.08 | 2257056.46 | 2488209.50 | |
| SM(d18:1/22:0) | 651212.33 | 709902.33 | 624999.49 | 573864.95 | 369769.63 | 505151.96 | |
| SM(d18:1/22:1(13Z)) | 292745.72 | 348114.77 | 223079.12 | 206355.46 | 190719.99 | 237506.91 | |
| SM(d18:1/24:1(15Z)) | 5877422.17 | 5572992.33 | 4624165.75 | 4534798.83 | 3449399.08 | 4906573.33 | |
| sn-glycero-3-Phosphocholine | 84087205.33 | 95159410.67 | 96001786.67 | 20853239.33 | 15134452.67 | 20237500.00 | |
| sn-glycero-3-Phosphoethanolamine | 810512.81 | 1007618.23 | 853034.75 | 594931.00 | 304857.56 | 508508.78 | |
| (S)-Norcoclaurine | - | - | - | 467773.18 | 770679.75 | 857443.35 | |
| [SP (16:0)] N-(hexadecanoyl)-sphing-4-enine | 1058775.65 | 1094838.67 | 1194436.54 | 3133229.92 | 3289714.08 | 2965582.00 | |
| [SP (16:0)] N-(hexadecanoyl)-sphing-4-enine-1-phosphocholine | 27855098.67 | 24641322.67 | 25620464.67 | 32006605.33 | 29740070.00 | 36012519.33 | |
| [SP (2:0)] sphinga-4E,14Z-dienine | 586352.31 | 827078.81 | 749611.33 | 794670.04 | 392886.26 | 382780.74 | |
| [SP] 3-dehydrosphinganine | 85236.41 | 92976.90 | 109630.60 | 2369678.92 | 2530228.25 | 2563692.50 | |
| [SP amino,tetramethyl(4:0/18:0/3:0)] 2S-amino-5,9,13,17-tetr... | 762036.46 | 684323.98 | 606500.65 | 680982.88 | 787861.65 | 1255640.79 | |
| [SP hydrox] 6-hydroxysphing-4E-enine | 511711.16 | 564359.29 | 669493.61 | 486400.84 | 363885.18 | 486955.11 | |
| [SP] Sphing-4-enine-1-phosphate | - | - | - | 9927731.00 | 11232398.67 | 10832985.00 | |
| [SP] Sphinganine-1-phosphate | - | - | - | 2239065.38 | 1977438.17 | 2176476.96 | |
| S-Succinylglutathione | 566195.54 | 777531.73 | 229762.91 | 1324778.58 | 619727.60 | 1133478.71 | |
| [ST (2:0)] 5alpha-cholesta-8,24-dien-3beta-ol | 526997.76 | 711193.48 | 433215.98 | 494354.57 | 491149.10 | 1101282.04 | |
| [ST (20:5)] cholest-5-en-3beta-yl (5Z,8Z,11Z,14Z,17Z-eicosap... | 347715.89 | 257060.66 | - | 345916.78 | 289562.58 | - | |
| [ST (3:0)] (5Z,7E)-(1S,3R)-24-nor-9,10-seco-5,7,10(19)-chola... | 349731.79 | 183815.58 | 251341.86 | 1047652.65 | 875627.73 | 660974.84 | |
| [ST (3:0)] (5Z,7E)-(1S,3R,24R)-22-oxa-9,10-seco-5,7,10(19)-c... | 2286946.12 | 1420718.38 | 1536940.58 | 983755.69 | 1472531.29 | 992452.23 | |
| [ST (3:0)] cholest-5Z,7Z,24-trien-3beta-ol | 661982.54 | 1476322.25 | 480200.00 | 729188.46 | 742691.81 | 1428583.79 | |
| [ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene | 2551072.33 | 2505693.75 | 3010501.75 | 2552884.50 | 2464552.75 | 2796540.33 | |
| [ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene 2 | 2551072.33 | 2505693.75 | 3010501.75 | 2552884.50 | 2464552.75 | 2796540.33 | |
| Stachydrine | 311114816.00 | 382755626.67 | 378925365.33 | 1782766.79 | 1870094.92 | 1742278.38 | |
| Stearoylcarnitine | 13364277.00 | 15639983.67 | 16785329.67 | 1737859.54 | 1713461.88 | 1651297.08 | |
| [ST hydroxy(5:0)] 3-hydroxy-estra-1,3,5(10),6,8-pentaen-17-o... | - | - | - | 186609.41 | 206784.97 | 343030.66 | |
| Suberylglycine | - | - | - | - | - | 81056.67 | |
| Succinyl proline | 99994.98 | 198485.70 | 125055.01 | 81691.78 | 156008.99 | 141153.35 | |
| Tazettine | 1894969.71 | 220760.25 | 761703.58 | - | 1625250.58 | 2370934.42 | |
| Tenuazonic acid | 151322.67 | 176141.07 | 201882.33 | 760693.90 | 177540.42 | 267326.92 | |
| Tetradecanoylcarnitine | 2121251.92 | 2331639.33 | 2551922.33 | 1051374.83 | 1263865.12 | 950320.31 | |
| Tetrapentylammonium | 1200437.50 | 716032.42 | 889237.71 | 26741745.33 | 36882420.00 | 29936260.00 | |
| Thalicsessine | 22332891.33 | 21672926.67 | 17767696.00 | 40439790.67 | 44747156.00 | 63362092.00 | |
| Thiamin | 13601401.00 | 12788918.33 | 11905983.00 | 16277546.33 | 19528770.00 | 18684386.00 | |
| Thiomorpholine 3-carboxylate | 205941.44 | 384350.85 | 761537.46 | 1866156.08 | 763481.17 | 857552.88 | |
| Thiomorpholine 3-carboxylate 2 | 205941.44 | 384350.85 | 761537.46 | 1866156.08 | 763481.17 | 857552.88 | |
| Thr-Ala | 8716532.67 | 9323717.50 | 9260414.33 | 55441698.67 | 55862446.67 | 64590942.67 | |
| Thr-Ala-Asp | 1350587.75 | 1297620.67 | 1229231.21 | 478577.27 | 336142.57 | 342187.94 | |
| Thr-Cys | 542075.73 | 635675.06 | 411814.00 | 2013414.67 | 2064919.88 | 2351868.17 | |
| Thr-Cys 2 | 542075.73 | 635675.06 | 411814.00 | 2013414.67 | 2064919.88 | 2351868.17 | |
| trans-Hexadec-2-enoylcarnitine | 3436045.50 | 3814990.33 | 3998452.00 | 995966.50 | 1216921.96 | 928640.81 | |
| Tributyl phosphate | 2495385.67 | 2727431.00 | 3988754.75 | 1849970.12 | 2593866.33 | 2356167.42 | |
| Tris(butoxyethyl)phosphate | 2573002.92 | 2384385.25 | 2278104.62 | 1764074.25 | 2764763.17 | 2177114.46 | |
| Trp-Trp-Tyr-Tyr | 4412148.08 | 4335108.67 | 4296278.08 | 13177097.00 | 11134313.33 | 18096550.67 | |
| Tyr-OEt | - | 253858.32 | - | 563652.71 | 236287.70 | 487516.04 | |
| UDP | 291927.91 | 345125.85 | 345808.32 | 1891739.12 | 1756183.79 | 2052879.25 | |
| Urethane | 91008.82 | 95464.96 | 77448.70 | 157942.87 | 864865.52 | 395598.91 | |
| Urethane 2 | 91008.82 | 95464.96 | 77448.70 | 157942.87 | 864865.52 | 395598.91 | |
| Urocanate | 511338.26 | 1540131.21 | 477109.01 | 569833.85 | 470014.61 | 983837.00 | |
| Val-Asn-Asp | 755324.69 | 540852.42 | 596100.62 | 1155320.25 | 967683.65 | 1127513.25 | |
| Valeroidine | 70688.77 | 90181.18 | 76992.42 | 313523.15 | 154069.14 | 223835.24 | |
| Val-Gly | 1856902.33 | 3518066.25 | 3614185.83 | 852314.85 | 761152.56 | 1167038.21 | |
| Val-Pro-Arg | 239895.31 | 325198.43 | 238720.67 | 110601.66 | 123436.69 | 292616.33 | |
| Val-Ser | 619763.76 | 653598.75 | 1281606.00 | 321867.10 | 2235218.67 | 2903994.08 | |
| Verticine | 654447.73 | 816900.33 | 870085.50 | 415072.19 | 888937.79 | 1022495.83 | |
| (Z)-4-Hydroxyphenylacetaldehyde-oxime | 224590.04 | 252546.70 | 240232.49 | 363289.22 | 240972.27 | 249062.20 | |
| ZAPA | 181978.89 | 102529.32 | 208951.40 | 266093.60 | 352666.26 | 439820.24 |
Factors:
| F1 | Cell type:Mature erythrocyte | Glucose labelling:C13 glucose | timepoint:1 hour |
| F2 | Cell type:Mature erythrocyte | Glucose labelling:C13 glucose | timepoint:20 hours |
| F3 | Cell type:Mature erythrocyte | Glucose labelling:unlabelled | timepoint:20 hours |
| F4 | Cell type:Reticulocyte | Glucose labelling:C13 glucose | timepoint:1 hour |
| F5 | Cell type:Reticulocyte | Glucose labelling:C13 glucose | timepoint:20 hours |
| F6 | Cell type:Reticulocyte | Glucose labelling:unlabelled | timepoint:20 hours |
