Data for ST000403
| Metabolite structure | All data | F1 | F2 | F3 | F4 | F5 | F6 |
|---|---|---|---|---|---|---|---|
| 10-Hydroxycarbazepine | 306137.56 | 350453.12 | 247938.00 | 188743.09 | - | - | |
| 1,2,4-Trimethylbenzene | 924814.00 | 1921459.67 | 1742902.67 | 782791.33 | 381793.67 | 1238706.33 | |
| 1,2-dioctanoyl-1-amino-2,3-propanediol | - | - | - | 159334.17 | - | 167503.87 | |
| 1(2H)-Isoquinolinone | 1079646.00 | 857260.40 | 933621.85 | 804714.94 | 775905.35 | 990470.58 | |
| 12-OPDA | 283402.73 | 350810.78 | 1228476.69 | 511505.01 | 757329.98 | 603358.54 | |
| 1-5-diazabicyclononane | 127829.00 | 152838.00 | 136619.67 | 158826.33 | 1080781.33 | 152930.00 | |
| 1-5-diazabicyclononane_2 | 373433.82 | 429107.40 | 390406.73 | 1686439.17 | 2088964.58 | 1758549.88 | |
| 1,6-anhydrous-N-Acetylmuramyl-tetrapeptide | 693066.33 | 841391.69 | 222259.09 | - | - | - | |
| 1-deoxynojirimycin | 527690.00 | 379654.00 | 361912.67 | 472988.67 | 713162.00 | 424015.00 | |
| 1-deoxyxylonojirimycin | 207008.30 | 251679.09 | 198926.94 | 3582817.00 | 4077305.42 | 3824493.67 | |
| 1-Methylnicotinamide | 122174.10 | 110152.45 | 126981.14 | 55833.94 | 51318.12 | 57440.61 | |
| 1-Nitronaphthalene | 906745.31 | 2205255.83 | 7170233.33 | 7671834.67 | 6090690.83 | 5688592.50 | |
| 2,3,4,5-Tetrahydrodipicolinate | - | - | - | 265306.94 | 273427.34 | 282040.42 | |
| 2,3,4,5-Tetrahydropyridine-2-carboxylate | 1668838.62 | 1880741.33 | 1595448.29 | 1702610.00 | 1556283.38 | 1795173.04 | |
| 2,3-Dimethylmaleate | 2299489.00 | 1111714.00 | 4299828.33 | 2088967.67 | 1476581.33 | 4137906.67 | |
| 2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate | 324970.27 | 188546.53 | 637038.42 | 522028.35 | 465143.66 | 1114266.35 | |
| 2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate_2 | 399149.76 | 360275.77 | 444712.42 | 431897.54 | 423493.99 | 582323.33 | |
| 2-Aminobutan-4-olide | 211101.74 | 148116.95 | 299355.50 | 309399.18 | 298266.36 | 331677.65 | |
| 2-Dehydro-3-deoxy-L-rhamnonate | 1431922.33 | 651440.33 | 2008156.33 | 955891.67 | 607159.67 | 1689102.33 | |
| 2-Methylcholine | 385639.47 | 727656.75 | 412120.27 | 271154.71 | 405707.73 | 271698.30 | |
| 2-monooleoylglycerol | 769039.33 | 834765.33 | 762437.67 | 280158.67 | 367579.33 | 463512.33 | |
| 2-Phenyl-1,3-propanediol monocarbamate | 400166.17 | 226841.13 | 608221.41 | 700681.94 | 645097.75 | 571497.81 | |
| 3,4-Dehydrothiomorpholine-3-carboxylate | 1831869.67 | 721086.67 | 1086174.33 | 589082.33 | 322235.33 | 549810.00 | |
| 3,4-Dehydrothiomorpholine-3-carboxylate_2 | 969609.67 | 377706.00 | 633323.33 | 322042.33 | 167267.33 | 300695.33 | |
| 3,5,7-Trimethyl-2E,4E,6E,8E-undecatetraene | 13519994.67 | 25359290.67 | 19460956.67 | 9815233.67 | 5760434.00 | 13714353.67 | |
| 3,5-dihydro-5-methylidene-4H-imidazol-4-one | 132231.19 | 286681.20 | 891006.19 | 723243.56 | 480839.67 | 641323.69 | |
| 3-(ADP)-2-phosphoglycerate | 178998.67 | - | 100734.33 | 360773.67 | 236579.33 | 339063.33 | |
| 3-beta-D-Galactosyl-sn-glycerol | 453979.93 | 498230.18 | 640454.19 | - | - | - | |
| 3-Butylidene-7-hydroxyphthalide | 3302518.00 | 863395.00 | 1076234.00 | 2764299.00 | 2633432.33 | 1911070.67 | |
| 3-Butynoate | 790008.75 | 785552.65 | 725074.54 | 3514835.75 | 3234254.58 | 2963541.50 | |
| 3-Dehydroteasterone | 709939.00 | 549276.67 | 543439.33 | 3068250.00 | 408490.00 | 619331.67 | |
| 3-(Dimethylamino)propyl benzoate | 491783.97 | 586932.88 | 519156.21 | 962019.25 | 492131.94 | 952917.69 | |
| 3-Hydroxy-L-kynurenine | - | 58018.55 | 208290.69 | 349905.34 | 387430.99 | 700437.92 | |
| 3-Hydroxy-N6,N6,N6-trimethyl-L-lysine | 427547.33 | 421380.67 | 454224.33 | 4395071.00 | 5237814.33 | 5205309.33 | |
| 3-Methoxyanthranilate | 725002.60 | 781044.79 | 797989.94 | 630823.90 | 543134.16 | 629126.50 | |
| 3-methyl-1-heptene | 844872.00 | 604173.33 | 622102.00 | 1068393.00 | 1080941.00 | 840822.67 | |
| 3-Methylcrotonylglycine | 102212.46 | 149607.58 | 131254.22 | 95623.23 | 105146.56 | 104457.16 | |
| 3-Methyleneoxindole | 1796508.67 | 3012912.00 | 8244717.67 | 10005987.00 | 7098211.67 | 7640053.17 | |
| 3-nitro-2-pentanol | 1970562.62 | 2666390.17 | 1536597.25 | 2476396.58 | 2035000.88 | 2649281.08 | |
| 3-Nitrotyrosine | - | - | 143030.20 | - | - | - | |
| 4-(1-methyl-5-hydroxy-2-pyrrolidinyl)-3-oxobutanoate methyl ... | 360336.15 | 269747.72 | 528120.85 | 372829.17 | 293772.93 | 357158.09 | |
| 4,6-Dihydroxyquinoline | 129790.24 | 62609.90 | 583055.06 | 90525.11 | 246161.89 | 153456.00 | |
| 4-8dimethylnonanoylcarnitine | 825609.00 | 567989.00 | 1076757.00 | 450595.33 | 552742.00 | 630547.67 | |
| 4-Aminobutanal | 1690305.33 | 1128126.67 | 1720534.33 | 1923369.33 | 1874591.00 | 1848889.67 | |
| 4-Aminobutanoate | 3663126.58 | 3874217.00 | 3791640.67 | 7992831.83 | 8449612.67 | 8589603.67 | |
| 4-Guanidinobutanal | 116536.22 | 99616.85 | 127167.72 | 114093.69 | 101827.48 | 122011.00 | |
| 4-Hydroxy-4-methylglutamate | 536589.95 | 554503.20 | 487325.73 | 625142.67 | 605735.94 | 736795.62 | |
| 4-Hydroxycinnamyl aldehyde | 165994.50 | 5435625.67 | 431811.67 | - | - | 1167987.33 | |
| 4-Imidazolone-5-propanoate | 335367.94 | 293411.20 | 310357.40 | 1860258.54 | 1952535.17 | 1870201.50 | |
| 4-PIOL | 511608.67 | 624413.67 | 486362.33 | 481730.67 | 493455.67 | 489251.33 | |
| 4-Trimethylammoniobutanoate | 134152136.00 | 134100589.33 | 119576730.67 | 104415674.67 | 113933517.33 | 92107573.33 | |
| 4α-hydroxymethyl-4β-methyl-5α-cholesta-8,24-dien-3β-ol | 5085466.83 | 4334743.92 | 5615716.83 | 10134368.00 | 7697564.00 | 7815407.33 | |
| 5,6-Dihydrothymine | 20602113.33 | 22372449.33 | 25140702.67 | 42747273.33 | 47429482.67 | 44927576.00 | |
| 5,6-Dihydrothymine_2 | 45216.17 | 30784.09 | 45111.34 | 46913.24 | 71191.19 | 49477.53 | |
| 5,8,13,13a-Tetrahydrocolumbamine | 725019.73 | 490724.53 | 539528.80 | 534235.44 | 463581.86 | 628534.81 | |
| 5-Aminopentanamide | 67657.76 | 70238.78 | 76717.59 | 119860.66 | 128293.83 | 146474.19 | |
| 5-Guanidino-2-oxopentanoate | 855146.06 | 807287.42 | 957975.38 | 815734.92 | 729964.69 | 887191.56 | |
| 5-guanidino-3-methyl-2-oxo-pentanoate | 1628327.79 | 700349.73 | 1009037.96 | 2532314.83 | 1218176.92 | 1888238.83 | |
| 5-Hydroxytryptophol | 463850.82 | 509248.31 | 791765.52 | 623885.94 | 642125.56 | 736481.27 | |
| 5-Methoxytryptophol | 100795.33 | 160443.93 | 216713.82 | 165944.67 | 192309.66 | 205950.12 | |
| 5-Methylcytosine | 316821.04 | 273931.94 | 324771.49 | 285670.35 | 242090.75 | 297040.94 | |
| 5-Methylthioadenosine | 5296573.17 | 6689996.67 | 5358746.50 | 18554320.67 | 14623269.00 | 17075931.67 | |
| 5S-HETE di-endoperoxide | 958244.71 | 685679.56 | 916082.15 | - | 517798.47 | 950647.94 | |
| (+/-)-5-[(tert-Butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahy... | 151941.42 | 296863.16 | 767689.08 | 517548.99 | 551443.17 | 482462.02 | |
| (+/-)-5-[(tert-Butylamino)-2-hydroxypropoxy]-3,4-dihydro-1(2... | - | - | 346714.68 | 1067548.75 | 1118697.77 | 1117811.60 | |
| 6-Acetamido-2-oxohexanoate | 702744.50 | 570648.20 | 1320177.21 | 1114704.65 | 1030064.54 | 2003309.04 | |
| 7,8-benzoflavone | 1150724.71 | 1005537.60 | 1282336.04 | 1551941.29 | 1445228.19 | 1398840.25 | |
| 7,8-H2pterin-6-ylmethyl-l-(4-aminophenyl)-1-deoxy-5-[1-α -D... | 237064.33 | 158050.67 | 114693.67 | 524744.67 | 483915.33 | 432531.00 | |
| 7alpha-Hydroxycholest-4-en-3-one | 811725.31 | 4122064.00 | 8340276.67 | 2660928.88 | 4069167.25 | 4515628.67 | |
| Acetone cyanohydrin | 190861.67 | 217236.33 | 238423.67 | 440893.33 | 476721.33 | 445082.33 | |
| Acetylagmatine | - | - | 72630.50 | - | - | - | |
| Acetylcholine | - | - | - | 16038496.33 | 16819524.67 | 16307941.00 | |
| Acetyl phosphate | 162840.67 | 102885.67 | 271568.67 | 226540.33 | 143444.00 | 293095.00 | |
| Ac-Tyr-OEt | 238857.00 | 458481.00 | 330373.33 | 664463.33 | 683583.33 | 929566.00 | |
| a Cysteine adduct | 1025061.33 | 372253.67 | 1150013.00 | 374330.00 | 199240.67 | 368624.67 | |
| a Cysteine adduct_2 | 30047048.67 | 13771805.33 | 37699029.33 | 8270609.67 | 3588621.67 | 8888265.00 | |
| Adenine | 2771120.25 | 4067525.50 | 2474492.75 | 4515252.00 | 3726782.42 | 4650688.08 | |
| Ala-Ala-Ala | - | - | 137052.11 | - | - | - | |
| Ala-Asn-Gly | 359840.67 | 75307.00 | 521381.67 | 311811.67 | 215739.67 | 392687.67 | |
| Ala-Asp-Asp-Gln | - | - | - | 436413.65 | 655254.17 | 612282.25 | |
| Ala-Asp-Cys-Gly | 153553.64 | 481493.88 | - | 298482.60 | - | 456509.30 | |
| Ala-Asp-Cys-Ser | 963886.67 | 970710.00 | 916361.67 | 3430957.33 | 3663561.67 | 3543682.67 | |
| Ala-Asp-Gly | 72959.35 | 64770.95 | 51688.39 | 399351.18 | 366867.17 | 379644.78 | |
| Ala-Asp-Gly_2 | 953025.00 | 437845.67 | 1057294.00 | 544397.33 | 342290.00 | 476780.67 | |
| Ala-Asp-Pro-Ser | - | - | - | 397215.83 | 386228.20 | 767643.33 | |
| Ala-Gln-Pro | - | - | 310510.41 | - | - | - | |
| Ala-Leu-Lys-Pro | 454483.34 | 465340.84 | 532042.26 | 1449238.67 | 1240633.29 | 1329276.92 | |
| Ala-Leu-Thr-Pro | 170044.50 | 194700.54 | 336069.59 | 323341.14 | 330454.84 | 333711.71 | |
| Ala-Lys-Asn-His | - | - | 85090.50 | 420098.00 | 505200.00 | 434668.67 | |
| Ala-Met-Pro-Tyr | - | - | - | 283581.83 | 232529.96 | 257515.68 | |
| Ala-Pro | 274720.65 | 321764.77 | 299842.08 | 349393.15 | 345990.60 | 394112.52 | |
| Ala-Ser-Ser | 515275.67 | 546173.52 | 444302.96 | - | - | - | |
| Alatanin 2 | 865840.33 | 173957.67 | 274280.00 | 676119.33 | 353567.33 | 579247.33 | |
| allopurinol | 874639.94 | 1128259.71 | 901096.33 | 1813917.50 | 1862224.25 | 1777299.00 | |
| alpha-Methylstyrene | 269723.00 | 463047.67 | 493138.00 | 265051.00 | 254898.00 | 359785.67 | |
| AMP | 17654700.00 | 28115521.33 | 14705265.00 | 9622214.67 | 13074692.33 | 11301480.33 | |
| Anthranilate | 9118419.83 | 10216415.17 | 8829846.67 | 2958540.17 | 3130559.67 | 3256683.42 | |
| Arg-Asn-Pro-His | 171055.66 | 188790.23 | 156984.82 | 631568.56 | 702390.71 | 710844.67 | |
| Arg-Asp-Asp-Gly | 198897.33 | 240394.00 | 183614.33 | 1768262.33 | 1895026.33 | 1743422.67 | |
| Arg-Leu-Asn-Asp | 1445414.67 | 583111.00 | 1043631.00 | 331225.00 | - | - | |
| Arg-Met-Asn-Gln | - | - | 61127.60 | - | - | - | |
| Arg-Met-Asn-His | 196699.55 | 229035.98 | 579739.47 | - | - | - | |
| Arg-Met-Val-Asp | 69146.92 | - | 161538.78 | - | - | 113811.28 | |
| Asn-Asn-Asn | 284697.57 | 275273.09 | 221597.21 | 209022.11 | 145223.70 | 319894.48 | |
| Asn-Asn-Pro-His | 378539.01 | 199300.79 | 646671.46 | 366540.53 | 361966.94 | 755877.83 | |
| Asn-Asp | 99098.00 | 76948.33 | 44172.33 | 209335.67 | 239413.00 | 209536.33 | |
| Asn-Cys-Pro-Ser | - | - | - | 810951.25 | 690273.96 | 930119.48 | |
| Asn-Leu-Asn-Tyr | 15227784.33 | 12897569.00 | 13053216.33 | 2496653.17 | 1463430.46 | 361405.04 | |
| Asn-Pro | 5786073.67 | 9129062.67 | 5333733.42 | 363322.68 | 378326.52 | 376516.46 | |
| Asn-Tyr | 263914.33 | - | 648559.00 | 177062.00 | - | 414226.33 | |
| Asp-Arg | 42986.82 | - | 62368.99 | 1108083.46 | 1283001.17 | 1173688.81 | |
| Asp-Asp-Gly | 378499.00 | 319547.67 | 394870.00 | 7577492.67 | 7750385.00 | 8292393.00 | |
| Asp-Cys-Cys-Ser | 423013.00 | 261409.00 | 1382167.00 | 1150816.67 | 891898.67 | 1208911.67 | |
| Asp-Cys-Gln | 355927.80 | 401909.66 | 418501.02 | 350366.27 | 368236.75 | 349385.40 | |
| Asp-Gly | - | - | - | 522792.35 | 580060.75 | 472876.54 | |
| Asp-Gly-Arg | 294378.95 | 353018.16 | 335536.99 | 195080.90 | 209507.17 | 196759.47 | |
| Asp-Gly-Arg_2 | 258776.48 | 452532.01 | 284267.67 | 288677.15 | 379853.31 | 329265.21 | |
| Asp-Gly-Pro | 734081.67 | 249814.33 | 950001.00 | 699737.00 | 537902.33 | 701768.67 | |
| Asp-Gly-Pro-Ser | - | - | - | 283037.92 | 237549.23 | 509404.16 | |
| Aspidofractine | - | - | 268388.11 | - | 106951.72 | - | |
| Asp-Leu-Ser-His | - | - | 61079.30 | - | - | 122163.29 | |
| Asp-Met-Pro-Pro | - | - | - | 130009.57 | 166011.09 | 286799.44 | |
| Asp-Pro-Ser | 1266536.42 | 1182795.47 | 2491948.88 | 886764.88 | 760428.60 | 2034263.94 | |
| ATP | 35227977.33 | 21070278.00 | 34612188.00 | 43317013.33 | 31064090.00 | 40371308.00 | |
| Behenoylglycine | 430989.60 | 1032198.98 | 1434574.17 | 699617.44 | 1085828.85 | 947786.00 | |
| Bendiocarb | 253426.68 | 194422.67 | 595275.27 | 361775.11 | 282413.58 | 329168.47 | |
| Benzimidazole | 171391.54 | - | 379080.22 | - | - | - | |
| beta-Alanyl-L-arginine | 73303.33 | 113024.00 | 95954.00 | 54472.00 | 61312.33 | 61635.50 | |
| beta-Carboline | 178610.56 | 2110166.58 | 917727.50 | 457408.43 | 475200.69 | 364878.42 | |
| beta-Citryl-L-glutamic acid | 1388177.00 | 844865.33 | 1452049.33 | 171622453.33 | 153089517.33 | 160895248.00 | |
| Betaine | 467888458.67 | 605075264.00 | 450845141.33 | 116428853.33 | 117637261.33 | 126643085.33 | |
| Betaine aldehyde | 209751.72 | 164524.10 | 162423.47 | 618736.35 | 586988.30 | 620983.31 | |
| Biotin amide | 1715841.29 | 2398586.50 | 1356858.04 | - | - | - | |
| Bis(2-ethylhexyl)phthalate | 157351792.00 | 93737117.33 | 115080752.00 | 183012800.00 | 180268837.33 | 150727344.00 | |
| Bis(glycerophospho)-glycerol | - | - | - | 1966925.62 | 2199745.42 | 2080570.96 | |
| Boc-Asn | - | - | 59680.00 | 458440.67 | 505049.00 | 766487.00 | |
| Butenylcarnitine | 117918.01 | 152946.36 | 173034.12 | 150761.59 | 146533.07 | 188431.58 | |
| Calophyllin B | 1600769.33 | - | 4499869.00 | 428390.33 | 2485891.67 | 1496108.67 | |
| Carnosine | 52563.88 | 92278.79 | 52514.01 | 2464545.58 | 2926463.00 | 2712971.25 | |
| Casein K | 1102239.00 | 679710.00 | 630927.33 | 790960.67 | 471434.00 | 640952.67 | |
| Casein K_2 | 66738.09 | 66831.92 | 115434.29 | 71337.24 | 85862.71 | 72092.97 | |
| CDP-choline | 999153.65 | 915423.77 | 861916.17 | 27768991.33 | 26165592.00 | 26697884.00 | |
| CDP-ethanolamine | 71279.94 | 93778.55 | 72397.43 | 525893.95 | 524067.97 | 568819.58 | |
| CDP-ribitol | - | - | - | 318624.14 | 265012.94 | 290207.08 | |
| Cerulenin | 3423122.08 | 4942550.67 | 3776480.08 | 1082748.88 | 1079465.94 | 947920.73 | |
| Chelilutine | 629801.10 | 1259239.62 | 1041220.44 | 845833.42 | 2357810.25 | 2431561.88 | |
| Choline | 102548440.00 | 90556600.00 | 121947032.00 | 1261454421.33 | 1453215786.67 | 1234570538.67 | |
| Choline phosphate | 16030730.67 | 23777488.00 | 24210545.33 | 212840730.67 | 233211498.67 | 236676330.67 | |
| cis-5-Tetradecenoylcarnitine | 288843.20 | 287847.49 | 260600.69 | 388445.79 | 357958.38 | 359985.54 | |
| CMP | - | - | - | 797016.77 | 741841.81 | 671829.67 | |
| CMP-2-aminoethylphosphonate | 1259737.50 | 1181840.81 | 1132023.46 | 634633.54 | 641312.85 | 534938.95 | |
| CMP-N-trimethyl-2-aminoethylphosphonate | 14225195.67 | 14510766.67 | 13476778.67 | 1561953.71 | 1359017.83 | 1566405.29 | |
| Codonopsine | 107770.00 | - | 218228.67 | 103802.00 | - | 118446.00 | |
| Costunolide | 197140.00 | 320890.28 | 359413.06 | 581893.94 | 421885.67 | 612761.69 | |
| Creatine | 1180114709.33 | 1343526485.33 | 1247391189.33 | 2119552213.33 | 2234804565.33 | 2117368064.00 | |
| Creatinine | 32178258.67 | 32928585.33 | 32976144.67 | 35688601.33 | 36360376.67 | 36288008.67 | |
| CTAB | 503354.84 | 1534130.62 | 339789.24 | 528743.21 | 3881294.33 | 580784.56 | |
| CTP | - | - | - | 451457.00 | 397936.28 | 494281.22 | |
| Cyclo(deltaAla-L-Val) | 635524.92 | 721046.23 | 541853.58 | 540780.00 | 602135.73 | 552848.86 | |
| cyclo-dopa 5-O-glucoside | - | - | - | 2332505.00 | 2100907.42 | 2233250.50 | |
| Cyclopamine | 8980516.67 | 4344824.42 | 6404582.83 | 33382340.67 | 4222156.17 | 6208985.00 | |
| Cys-Lys-Met-Gln | 492820.91 | 212790.40 | 752613.03 | 408187.68 | 356667.48 | 789224.17 | |
| Cys-Met-Tyr-Tyr | 2486257.33 | 438573.00 | - | 1483289.67 | 729923.33 | 210997.00 | |
| Cys-Thr-Cys-Cys | - | - | 129011.86 | 102211.37 | 100410.62 | 122996.42 | |
| d1-piperidine-dicarboxylate | 226982.58 | 297219.92 | 425639.32 | 522741.97 | 534022.90 | 673367.08 | |
| D-2-Amino-hexano-6-lactam | 399322.33 | 470251.00 | 486541.33 | 460019.00 | 1576705.67 | 437164.33 | |
| Daminozide | 468637.67 | 89256.00 | 1699990.67 | 316741.33 | 1717755.00 | 808396.67 | |
| Dasytrichone | 13859840.33 | 2747597.00 | 44569109.33 | 3870061.33 | 27558206.67 | 11098202.33 | |
| Deacetoxycephalosporin C | - | - | - | 207422.22 | 284481.64 | 233906.45 | |
| Deoxyvasicinone | 32317.87 | 60903.08 | 180431.47 | 246308.36 | 246185.08 | 217690.19 | |
| Dethiobiotin | 232157.79 | 300510.81 | 233838.36 | 317101.18 | 338169.30 | 313918.15 | |
| D-Galactosamine | 2722623.33 | 1999278.00 | 4928284.67 | 2612221.67 | 1881822.67 | 4620865.67 | |
| D-Galactosamine_2 | 363997.04 | 382808.80 | 327303.14 | 92789.83 | 88810.24 | 89972.14 | |
| D-Glucosamine 6-phosphate | - | - | - | 239857.40 | 261227.61 | 242718.54 | |
| Diacetylhydrazine | 4992178.67 | 2920826.67 | 3030868.00 | 13366581.00 | 6386821.33 | 9142947.67 | |
| Diacetylmonoxime | 159388.12 | 123030.20 | 288150.54 | 152885.41 | 162855.85 | 153889.27 | |
| Diethanolamine | 284744.33 | 278699.00 | 241370.33 | 270171.00 | 530632.67 | 270918.00 | |
| Diethanolamine_2 | 25882866.67 | 12829733.00 | 18049004.00 | 32676709.33 | 13474642.33 | 13143950.00 | |
| dihydrocapsaicin | 119510.74 | 376617.00 | 1244379.17 | 678862.10 | 774011.75 | 855438.65 | |
| Dihydroneopterin phosphate | - | - | - | 183378.52 | 161734.36 | 351995.01 | |
| di-n-Undecylamine | 7146501.00 | 2288119.29 | 1767825.25 | 55659861.33 | 55174930.67 | 51405636.00 | |
| DL-2-Aminooctanoicacid | 49394038.67 | 49125861.33 | 46102229.33 | 4544228.25 | 4914813.83 | 4125833.08 | |
| DL-Methionine sulfone | - | - | 65092.50 | 308182.33 | 382362.33 | 374291.67 | |
| DMNT | 1131510.00 | 2180727.67 | 985794.00 | 875970.00 | 345186.67 | 1024055.33 | |
| D-myo-Inositol 1,2-cyclic phosphate | 650726.65 | 721813.17 | 675709.85 | 840052.85 | 543335.70 | 1899772.67 | |
| Dopaminequinone | 516496.84 | 487896.44 | 430272.74 | 446903.42 | 482830.55 | 444944.41 | |
| D-Pipecolicacid | 795815.88 | 591978.93 | 815155.19 | 947931.44 | 799026.92 | 833905.60 | |
| Ectoine | 638476.46 | 744258.15 | 952558.06 | 1511092.83 | 1640867.38 | 1763146.17 | |
| Elaidiccarnitine | 34017321.33 | 35523052.00 | 29858880.67 | 4806180.33 | 4635515.58 | 5022239.00 | |
| Epinephrinesulfate | 166082.00 | 102227.00 | 271463.00 | 66944.67 | - | 87185.33 | |
| Ergothioneine | 119890106.67 | 139068421.33 | 49473530.67 | 325738.38 | - | 227403.75 | |
| Erythrulose 1-phosphate | 138217.00 | 93711.00 | 151361.50 | 743335.67 | 636353.00 | 1028119.00 | |
| [FA (14:2)] 5,8-tetradecadienal | 12764521.67 | 22178266.00 | 11227707.00 | 7839758.67 | 4403005.33 | 9747138.33 | |
| [FA (20:2)] N-(11Z,14Z-eicosadienoyl)-ethanolamine | 2405048.92 | 2020837.83 | 4576486.00 | 1736993.71 | 4188784.75 | 4660178.83 | |
| [FA (20:5)] 5Z,8Z,11Z,14Z,17Z-eicosapentaenoic acid | 452850.94 | 461885.95 | 529404.38 | 1186812.83 | 1361598.25 | 1415680.46 | |
| [FA (5:2)] 2,4-pentadienoic acid | 196304.26 | 248749.86 | 223436.10 | - | - | - | |
| [FA (6:0)] O-hexanoyl-R-carnitine | - | - | - | 1408316.00 | 1052479.33 | 1170303.00 | |
| [FA (8:2)] 2,4-octadienal | 646801.00 | 785277.33 | 489438.33 | 390000.00 | 250213.00 | 487166.33 | |
| [FA amino(11:0)] 11-amino-undecanoic acid | 399737.31 | 467224.28 | 494739.65 | 391439.13 | 429571.97 | 475704.69 | |
| [FA hydroxy(9:1)] 4-hydroxy-2-nonenal | 693923.48 | 1162913.75 | 854179.85 | 690931.77 | 528341.69 | 568904.71 | |
| [FA methyl(4:1)] 3-methyl-2-butenoic acid | 381962.52 | 516933.75 | 395988.78 | 875947.62 | 1005278.92 | 938139.29 | |
| [FA methyl,hydroxy,ethyl,dimethyl(22:4)] N-(2R-methyl-3-hydr... | - | 161007.70 | 281897.85 | 364025.58 | 379656.89 | 419299.16 | |
| [FA] O-Palmitoyl-R-carnitine | 28405124.67 | 29701340.67 | 23512208.67 | 6024086.00 | 6204994.17 | 5606717.50 | |
| [FA oxo(5:1/5:0/8:0)] (1S,2S)-3-oxo-2-(2Z-pentenyl)-cyclopen... | 948162.06 | 906087.46 | 2309475.38 | 1624514.71 | 2287676.25 | 1783892.12 | |
| [FA oxo(6:0)] N-(3-oxo-hexanoyl)-homoserine lactone | 48542.85 | 71596.92 | 116929.72 | 84547.15 | 110504.35 | 94843.88 | |
| Fasoracetam | 680368.60 | 512170.97 | 660742.12 | 507854.19 | 395651.75 | 393836.07 | |
| FMLP | - | - | - | 1399997.21 | 939044.77 | 1365144.54 | |
| Folate | 961290.67 | 281951.67 | 1127405.00 | 677744.00 | 332532.00 | 559628.00 | |
| Fructoselysine | 1234115.12 | 436832.91 | 2535060.92 | 1380145.33 | 981367.38 | 3149634.17 | |
| Fructoselysine_2 | 2102966.33 | 884338.67 | 4167865.33 | 1783343.00 | 1015023.67 | 3073927.00 | |
| Fructoselysine 6-phosphate | - | - | - | 360914.00 | 355780.33 | 415830.67 | |
| Furfural | 339406.38 | 296323.56 | 691927.44 | 437902.83 | 427345.79 | 610199.17 | |
| [Fv] Desmosdumotin C | 23761590.67 | 721331.33 | 848150.00 | 22799799.33 | 22863580.00 | 14651911.33 | |
| [Fv] Homoflemingin | 768340.42 | 751517.31 | 448429.88 | 343783.85 | 200692.23 | 510058.47 | |
| [Fv] Ovalitenin A | 1668616.21 | 2306916.54 | 3372694.75 | 1017072.73 | 1250490.98 | 1194357.75 | |
| Gamma-Aminobutyryl-lysine | - | - | - | - | 425915.71 | 111282.83 | |
| gamma-Glutamyl-beta-aminopropiononitrile | 2329888.75 | 1798470.08 | 2517958.92 | 2743818.67 | 2150196.54 | 2813063.67 | |
| gamma-Glutamyl-beta-cyanoalanine | 1018293.67 | 428515.00 | 2577836.00 | 455959.33 | 610244.33 | 447694.67 | |
| gamma-Glutamyl-Se-methylselenocysteine | 60661.00 | 61455.00 | 423811.00 | 175012.00 | 73238.33 | 480756.67 | |
| GDP | 283388.00 | 268617.33 | 298943.33 | 726953.33 | 502475.00 | 810209.33 | |
| Gentianaine | 51680.80 | 42608.40 | 108465.83 | 59594.13 | 83950.88 | 62893.15 | |
| Glabranin | 666895.46 | 959833.58 | 1558908.75 | 300991.10 | 420797.05 | 523636.72 | |
| Glaucarubolone | - | - | 136330.00 | 1906506.33 | 1831767.67 | 1809582.00 | |
| Gln-Leu-Lys-His | - | - | - | 58954.81 | 62690.27 | 184165.24 | |
| Glu-Arg | 102176.00 | - | 126446.00 | - | - | 57943.00 | |
| Glu-Arg_2 | - | 67738.51 | - | 301101.84 | 295059.09 | 296661.96 | |
| Glu-Asp | 144230.78 | 136984.08 | 132488.88 | 3620548.17 | 4520202.58 | 3796318.58 | |
| Glu-Glu-Glu | 132272.00 | 161567.00 | 122784.00 | 267444.00 | 262710.33 | 286925.00 | |
| Glu-Gly | - | - | 100370.90 | 720567.42 | 642290.79 | 702549.40 | |
| Glu-Lys-Val | 261186.19 | 384222.23 | 329062.55 | 1557695.62 | 1794719.04 | 1791418.42 | |
| Glu-Met-Thr | 605686.92 | 2335541.08 | 1642635.46 | 793007.62 | 3704290.50 | 3322526.67 | |
| Glu-Pro | 652803.73 | 911008.92 | 656921.33 | 1418637.71 | 1770493.12 | 1702822.58 | |
| Glutathione disulfide | 33474413.33 | 28760608.67 | 43148144.00 | 45782858.67 | 41112588.00 | 41114320.67 | |
| Glu-Thr | 2048922.12 | 1671075.33 | 1726224.29 | 1774209.92 | 1907739.33 | 1767228.08 | |
| Glu-Val | 610905.81 | 470839.00 | 505227.45 | 1040931.33 | 1155832.04 | 1078401.50 | |
| Glycylprolylhydroxyproline | - | - | - | - | - | 80075.01 | |
| Gly-Pro-Ser | 500477.33 | 206315.67 | 1024841.00 | 597851.33 | 346951.00 | 678617.33 | |
| GTP | - | - | - | 306590.00 | 336164.33 | 435947.33 | |
| Guanidinoacetate | 592903.64 | 512348.17 | 702407.52 | 696385.12 | 738479.06 | 749387.60 | |
| Gyromitrin | 395107.89 | 300199.23 | 380321.47 | 180344.62 | 165995.60 | 237691.92 | |
| Heptadecanoylcarnitine | 989822.50 | 1000036.21 | 871610.44 | 296661.58 | 330862.45 | 291649.30 | |
| Hercynine | 19690198.33 | 2287807.29 | 17537177.00 | 138512.63 | 54713.38 | 133580.00 | |
| Hercynine_2 | 18875525.33 | 31620345.33 | 20173361.33 | 147247.40 | 211112.73 | 183869.42 | |
| Hexadecasphinganine | 37860.57 | 94964.95 | 52454.50 | 169337.56 | 402761.64 | 134138.81 | |
| Hexanoylcarnitine | 38463.92 | 61768.71 | - | 274979.58 | 339823.98 | 315209.01 | |
| Hexanoylglycine | 573766.33 | 383745.67 | 582047.33 | 645871.00 | 736735.33 | 592813.00 | |
| Homoarginine | 73906.40 | 36915.83 | 175119.54 | 108965.46 | 110989.57 | 111958.92 | |
| Homocystine | - | - | 157962.58 | 168660.63 | 94299.62 | 191156.04 | |
| Homostachydrine | 1212885.69 | 1388833.08 | 993106.46 | 80404.73 | - | 231376.38 | |
| Hydroxybutyrylcarnitine | 1060148.08 | 1187371.12 | 891868.19 | 1718692.33 | 1606559.83 | 1686384.96 | |
| Hypaphorine | 100166117.33 | 116854613.33 | 93673466.67 | 2500948.92 | 2368089.96 | 2672633.67 | |
| Hypoxanthine | 2671770.17 | 4748961.00 | 2089811.96 | 8829895.33 | 7682357.17 | 5599038.50 | |
| Ile-Met-Met-Thr | 1884848.67 | 265146.50 | 3942376.00 | 1274086.33 | 664640.67 | 2787738.67 | |
| Ile-Pro | 11982141.00 | 13513507.33 | 12287228.00 | 11521844.33 | 11866044.00 | 11531160.33 | |
| Imidazole-4-acetaldehyde | 322686.00 | 243116.33 | 305223.00 | 328904.67 | 263588.33 | 328626.67 | |
| Imidazole-4-acetate | 493683.10 | 885147.58 | 426284.11 | 359551.51 | 451642.09 | 465578.81 | |
| Imidazole lactate | 650929.40 | 727191.21 | 577040.42 | 531163.34 | 521175.52 | 543801.32 | |
| Indole | 976753.04 | 824365.38 | 852258.83 | 783155.19 | 724761.17 | 855311.96 | |
| Indole_2 | 1686517.79 | 1683172.12 | 2044717.79 | 1532125.42 | 1158442.65 | 1305681.67 | |
| Indole-3-acetamide | 877342.12 | 1268329.67 | 4820282.67 | 4920064.50 | 4079353.33 | 4462871.83 | |
| indole-3-acetonitrile oxide | 208659.58 | 439483.35 | 1440134.17 | 1439921.42 | 1787836.42 | 1408779.96 | |
| Indoleacrylicacid | 11672427.33 | 14601011.67 | 11455817.33 | 392221.90 | 319426.31 | 361960.97 | |
| Indoleamine | 148608.93 | 134724.89 | 98245.52 | 66179.18 | 116936.43 | 139873.21 | |
| Iridodial | 288800.67 | 712676.33 | 473460.33 | 251447.67 | 339495.33 | 266786.67 | |
| Isopyridoxal | 957136.90 | 1051190.33 | 938599.15 | 1038880.67 | 1102615.75 | 1110823.29 | |
| Isoquinoline | 350019.89 | 416278.46 | 376759.57 | - | - | - | |
| Isovalerylalanine | - | 70944.94 | 76056.94 | 67437.76 | 63760.79 | 71988.04 | |
| (-)-jasmonoyl-L-isoleucine | - | 192236.23 | 661398.79 | 977030.00 | 698780.00 | 693913.38 | |
| ketoconazol | - | - | 454729.28 | 1181160.81 | 1001655.50 | 1017235.38 | |
| L-1-Pyrroline-3-hydroxy-5-carboxylate | 10654858.33 | 6891958.50 | 11988621.67 | 16624464.00 | 14882435.67 | 17624832.00 | |
| L-1-Pyrroline-3-hydroxy-5-carboxylate_2 | 12456522.67 | 7509982.00 | 15350282.33 | 6897685.67 | 4864305.67 | 7215337.67 | |
| L-2-Amino-6-oxoheptanedioate | 106388.11 | 147888.02 | 151690.30 | 96643.70 | 114675.25 | 111788.66 | |
| Lactosamine | 516242.58 | 468797.82 | 2031373.58 | 518353.51 | 460701.60 | 1739896.46 | |
| L-a-glutamyl-L-Lysine | 61095.93 | 87276.90 | 121020.55 | 581454.66 | 605926.25 | 596472.23 | |
| L-Alanine | 49938020.00 | 39490440.00 | 53390333.33 | 78618164.00 | 67837276.00 | 78603266.67 | |
| L-Arginine | 62976216.00 | 36001808.00 | 72939154.67 | 47448537.33 | 33571863.33 | 45153965.33 | |
| L-Asparagine | 26712118.00 | 20415588.00 | 29141384.67 | 44052608.00 | 42809232.00 | 42319830.67 | |
| L-Carnitine | 152200490.67 | 177343722.67 | 165299178.67 | 113146061.33 | 119106504.00 | 116929754.67 | |
| L-Citrulline | 24765514.67 | 30429382.67 | 21167904.00 | 2069818.29 | 3522325.00 | 2385842.21 | |
| Leu-Ala | 13728030.67 | 16489779.33 | 13477399.67 | 376283.14 | 462103.90 | 481653.32 | |
| Leu-Asn-Ser | 336444.67 | - | 747253.67 | 249565.50 | - | 139868.00 | |
| Leu-Asp | 191128.21 | 203159.27 | 175645.94 | 642035.56 | 726805.33 | 729706.56 | |
| Leu-Asp-Gln | 236692.59 | - | 595174.86 | - | - | - | |
| Leucyl-leucine | 270504.33 | 297680.33 | 248581.33 | 309949.00 | 251103.00 | 237978.33 | |
| Leu-Gly-Ser | - | - | 240298.57 | - | - | - | |
| Leu-Leu-Pro | 748932.33 | 648238.00 | 997015.33 | 717345.00 | 963660.00 | 953539.33 | |
| Leu-Lys-Asp | 3592125.42 | 3362517.92 | 3304665.50 | 479569.70 | 491891.07 | 546924.75 | |
| Leu-Lys-Pro | 15274790.33 | 18314478.33 | 16438852.33 | 6293351.17 | 5514986.50 | 5635345.00 | |
| Leu-Pro | 18729232.33 | 24439529.33 | 17939127.33 | 16609746.00 | 17913116.67 | 16477639.00 | |
| Leu-Ser | - | 77869.30 | 78712.33 | 87309.91 | 126643.85 | 120764.32 | |
| Leu-Thr-Thr | - | - | - | - | 214230.16 | 176013.07 | |
| Leu-Val-Gly | - | - | - | 1167741.96 | 962041.27 | 1865523.33 | |
| L-Glutamate | 110701493.33 | 64604922.67 | 134957906.67 | 125301514.67 | 101259093.33 | 120093045.33 | |
| L-Glutamate methylester | 111203.63 | 128531.16 | 150768.53 | 349938.44 | 487552.74 | 630609.26 | |
| L-Glutamine | 335001909.33 | 256396496.00 | 371019136.00 | 663992725.33 | 645386837.33 | 651534293.33 | |
| L-glycyl-L-hydroxyproline | 220981.73 | 132645.08 | 149320.55 | 216870.61 | 213308.63 | 235826.63 | |
| L-Histidine | 96745564.00 | 74750358.00 | 134628492.00 | 70502442.00 | 53889892.67 | 81147870.67 | |
| L-Homocitrulline | 613626.56 | 673752.25 | 485584.52 | - | - | - | |
| L-Homocitrulline_2 | 296052.38 | 263119.53 | 279292.30 | 316826.19 | 255081.02 | 364471.25 | |
| Lichenin | 328754.28 | 298088.19 | 717912.52 | 351211.10 | 280188.80 | 573247.24 | |
| Linamarin | 234339.33 | 247550.67 | 263315.33 | - | - | 90256.00 | |
| Linatine | 4703931.00 | 544509.67 | 9910083.67 | 3019346.67 | 1641538.00 | 6280171.33 | |
| L-Indospicine | 706017.81 | 579457.44 | 388625.47 | 370430.82 | 189919.76 | 309487.68 | |
| Linoelaidylcarnitine | 17285244.33 | 17430951.00 | 11308266.67 | 2911091.58 | 2672609.33 | 2747117.83 | |
| L-Kynurenine | 113589.41 | 191775.25 | 240470.10 | 249162.43 | 159697.27 | - | |
| L-Leucine | 406061450.67 | 295561776.00 | 446561173.33 | 385679914.67 | 332798368.00 | 388889600.00 | |
| L-Lysine | 56558196.00 | 40452874.67 | 63182841.33 | 54452545.33 | 51472870.67 | 56903190.67 | |
| L-Lysine 1,6-lactam | 1853700.00 | 665253.00 | 5331935.33 | 703595.00 | 2236513.00 | 1160031.33 | |
| L-Methionine | 147801344.00 | 112901237.33 | 149232069.33 | 127868792.00 | 90930400.00 | 129958336.00 | |
| L-Methionine S-oxide | 18600207.33 | 45591706.67 | 40304086.67 | 62208153.33 | 112360717.33 | 85030477.33 | |
| Lophophorine | 363608.95 | 575098.54 | 1194200.33 | 373498.25 | 458931.73 | 442738.27 | |
| L-Ornithine | 12361573.00 | 12836570.67 | 12368881.00 | 16586990.33 | 17573081.67 | 20097787.00 | |
| L-Phenylalanine | 172672336.00 | 174663157.33 | 191997061.33 | 150565973.33 | 136207594.67 | 153769856.00 | |
| L-Pipecolate | 2335082.33 | 2393302.25 | 2418374.12 | 1468087.29 | 1464273.62 | 1400071.00 | |
| L-Pipecolate_2 | 25990.94 | 23697.38 | 29298.74 | 122423.61 | 127283.04 | 134186.21 | |
| L-Proline | 688388309.33 | 599536661.33 | 772917760.00 | 695960234.67 | 715676501.33 | 766116650.67 | |
| L-proline amide | 355830.55 | 275589.34 | 559098.33 | 248803.49 | 456389.66 | 444812.48 | |
| L-Serine | 24039348.00 | 21178349.33 | 27721448.00 | 42801544.00 | 48712077.33 | 45021954.67 | |
| L-thiazolidine-4-carboxylate | 17416060.67 | 7232870.00 | 14170604.33 | 16909106.33 | 5315871.67 | 14578283.33 | |
| L-Tryptophan | 44052156.00 | 34802557.33 | 38642322.67 | 32706055.33 | 29158730.67 | 38296090.67 | |
| L-Tyrosine | 205625578.67 | 173177221.33 | 208462736.00 | 177507056.00 | 171853845.33 | 178810224.00 | |
| L-Tyrosyl-L-arginine | - | - | - | 289013.93 | 415694.14 | 281610.03 | |
| L-Valine | 281765813.33 | 270892400.00 | 291213776.00 | 244886032.00 | 249493136.00 | 253181552.00 | |
| Lys-Asn-Gly | - | 51663.00 | - | 455901.67 | 569713.33 | 482477.00 | |
| Lys-Asp-Gly | 345545.06 | 463471.77 | 338796.52 | 392105.99 | 432150.94 | 361411.20 | |
| Lysergic acid | 180499.51 | 158772.38 | 117937.75 | 71619.90 | 61629.50 | 61924.47 | |
| Lys-Lys-Met-Pro | 176135.33 | 69560.33 | 27123.00 | 176210.67 | 166544.00 | 58095.00 | |
| LysoPC(17:0) | 5154705.00 | 4537609.00 | 4076011.67 | 4530495.33 | 4068209.67 | 4342121.67 | |
| LysoPC(18:0) | 163603936.00 | 154025557.33 | 138212354.67 | 163190213.33 | 139748005.33 | 147815146.67 | |
| LysoPC(18:1(9Z)) | 33272890.67 | 29144686.67 | 27436090.67 | 38944896.00 | 40690905.33 | 40516840.00 | |
| LysoPC(20:1(11Z)) | 718873.33 | 622129.00 | 601742.33 | 654737.67 | 545648.00 | 594132.00 | |
| LysoPC(20:4(5Z,8Z,11Z,14Z)) | 7342485.67 | 7397539.33 | 4846622.33 | 28789790.00 | 32087705.33 | 27882588.67 | |
| LysoPC(22:4(7Z,10Z,13Z,16Z)) | 472793.00 | 480323.67 | 351564.67 | 3360287.33 | 3617685.67 | 3319286.67 | |
| LysoPC(O-18:0) | 1793878.96 | 1557283.08 | 1422474.75 | 2140139.38 | 1939484.12 | 1804292.25 | |
| LysoPE(0:0/18:2(9Z,12Z)) | 1159770.88 | 1310663.83 | 1095677.79 | 2662141.92 | 3013046.83 | 2486047.25 | |
| LysoPE(0:0/20:5(5Z,8Z,11Z,14Z,17Z)) | 1075241.33 | 1504076.00 | 843202.00 | 5818071.33 | 7883305.67 | 6694296.67 | |
| LysoPE(0:0/22:4(7Z,10Z,13Z,16Z)) | 4783135.67 | 5855755.67 | 4080581.00 | 26715099.33 | 31220829.33 | 27524651.33 | |
| LysoPE(0:0/22:5(4Z,7Z,10Z,13Z,16Z)) | 4199334.33 | 5177520.67 | 3404521.33 | 13746167.33 | 14790209.33 | 13405956.67 | |
| LysoPE(0:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) | 3336902.33 | 3837230.67 | 2671215.67 | 8537576.67 | 9272044.67 | 8500939.00 | |
| Lys-Pro | - | - | - | - | 343272.26 | 93004.67 | |
| Lys-Ser-Ser-Ser | - | - | 127272.76 | - | - | 95404.89 | |
| Lys-Trp-Asn | - | 87737.95 | 105638.36 | 847029.40 | 694239.21 | 821736.00 | |
| Lys-Val | 10537065.33 | 10350167.33 | 11369077.67 | 33332420.00 | 34314792.00 | 32566114.67 | |
| Lys-Val-Val | 2101633.00 | 1365412.62 | 1386081.92 | 843145.46 | 473979.07 | 807390.85 | |
| Maleimide | - | - | - | 413626.63 | 340514.48 | 417550.34 | |
| Maltose | - | - | - | 350087.83 | 364994.21 | 366569.43 | |
| Medicagol | 31693940.67 | 21383911.00 | 25859323.33 | 33484157.33 | 32114762.00 | 30830138.00 | |
| Met-Ala-Gly | 1323611.38 | 1964583.38 | 836070.40 | - | - | - | |
| Met-Ala-Tyr | 280013.28 | - | 1042614.15 | - | - | 573493.15 | |
| Met-Asp-Gly | 90445.18 | 80743.26 | 181034.64 | - | - | - | |
| Met-Gly | - | - | 290204.79 | 494635.14 | 1024585.83 | 749560.54 | |
| methiin | 2117492.00 | 1400677.00 | 1947237.00 | 2409893.33 | 2254804.00 | 2524786.33 | |
| Methyl 2-diazoacetamidohexonate | 2850285.58 | 3375005.08 | 3747416.17 | - | - | - | |
| Methyl cinnamate | 281124.33 | 1718194.00 | 185304.67 | 190974.33 | 224295.00 | 410803.00 | |
| Met-Met-Gln | - | - | - | 231334.40 | 192042.54 | 226249.67 | |
| Met-Met-Met | 289991.15 | 345083.28 | 70564.18 | 469932.69 | 498037.50 | 471451.09 | |
| Met-Met-Val | 142540200.00 | 16609332.33 | 323062357.33 | 95113736.00 | 48233800.00 | 198409216.00 | |
| Met-Thr-Asp | 731357.15 | 881727.44 | 836418.48 | 2283202.75 | 2342668.33 | 2434828.17 | |
| Met-Trp-Trp-Tyr | - | - | 277598.60 | - | - | 238618.86 | |
| mildronate | 502742.35 | 539794.38 | 989223.25 | 2207688.08 | 3244428.42 | 2841859.33 | |
| N1-Methyl-2-pyridone-5-carboxamide | 885658.77 | 719023.71 | 863737.88 | 877403.46 | 709323.42 | 808340.23 | |
| N1-Methyl-4-pyridone-5-carboxamide | 164008.98 | - | 357845.96 | - | - | - | |
| N1,N8-diacetylspermidine | 66877.62 | 95538.81 | 61405.98 | 1121652.12 | 909983.75 | 1267727.79 | |
| N-(2,3-Dihydroxybenzoyl)-L-serine | - | - | - | 8656262.17 | 9870933.00 | 8734431.67 | |
| N2-Acetyl-L-lysine | 886542.81 | 986651.29 | 982689.04 | 978216.98 | 1050019.71 | 1109440.83 | |
| N2-(D-1-Carboxyethyl)-L-arginine | 625938.98 | 677121.27 | 540467.04 | 405929.56 | 421593.26 | 374066.90 | |
| N2-(D-1-Carboxyethyl)-L-lysine | 534739.07 | 514037.68 | 622556.58 | 1479061.17 | 1546445.50 | 1591396.42 | |
| N2-Succinyl-L-arginine | 236966.00 | - | 302849.33 | 166829.33 | - | 138001.00 | |
| N2-Succinyl-L-ornithine | 194441.90 | 141385.42 | 172386.54 | 376770.14 | 341367.01 | 364860.66 | |
| N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoate | 574203.06 | 388065.46 | 715374.02 | 563757.82 | 293393.99 | 562051.08 | |
| N-(3-acetamidopropyl)-4-aminobutanal | 60262.82 | 70099.80 | 67410.60 | 94641.70 | 185865.59 | 194865.91 | |
| N-(3-Oxooctanoyl)homoserine lactone | - | - | 194439.61 | 442657.85 | 347968.36 | 396700.19 | |
| N4-Acetylaminobutanal | 927031.79 | 624960.77 | 1655750.58 | 595698.21 | 758934.54 | 923454.12 | |
| N5-acetyl-N5-hydroxy-L-ornithine | 540269.28 | 323221.59 | 746898.04 | 282100.82 | 997343.06 | 570627.32 | |
| N5-(L-1-Carboxyethyl)-L-ornithine | 252432.67 | 328627.32 | 377393.43 | 363227.95 | 352963.29 | 513571.12 | |
| N6-Acetyl-L-lysine | 2515871.42 | 4006019.33 | 2443355.58 | 2448842.25 | 3000815.33 | 2733603.92 | |
| N6-Acetyl-N6-hydroxy-L-lysine | 1353557.71 | 518383.93 | 2191257.88 | 1892358.04 | 1271601.88 | 2003459.00 | |
| N6-Acetyl-N6-hydroxy-L-lysine_2 | - | - | 422691.58 | - | 307845.26 | 70596.88 | |
| N6-Hydroxy-L-lysine | - | - | 52104.57 | 114614.52 | 294431.90 | 289204.70 | |
| N6-Methyl-L-lysine | 160071.64 | 131036.78 | 140311.56 | 346782.83 | 434912.45 | 378136.11 | |
| N6,N6-Dimethyladenosine | - | - | - | 272038.24 | 109977.06 | 457768.50 | |
| N6,N6,N6-Trimethyl-L-lysine | 15559942.33 | 16126990.33 | 15759306.67 | 122170344.00 | 109204690.67 | 108268914.67 | |
| N-Acetyl-ala-ala-ala-methylester | - | - | 71238.39 | - | - | - | |
| N-Acetyl-aspartyl-glutamate | 105144.00 | - | 94473.28 | 152075.29 | 71858.06 | 208930.23 | |
| N-Acetyl-aspartyl-glutamate_2 | 276717.36 | 166333.42 | 370516.39 | - | - | 164863.30 | |
| N-Acetyl-aspartyl-glutamate_3 | - | - | - | 1159318.27 | 1182239.27 | 1263988.75 | |
| N-acetyl-demethylphophinothricin | 515335.97 | 291366.03 | 300818.18 | 269841.80 | 288317.36 | 423267.27 | |
| N-acetyl -D- glucosaminitol | 881190.67 | 950998.31 | 826906.21 | 738121.58 | 848189.35 | 807414.69 | |
| N-acetyl -D- glucosaminitol_2 | 323676.41 | 484472.08 | 291478.95 | 1682522.42 | 1998087.54 | 1830884.83 | |
| N-Acetylindoxyl | 60588005.33 | 40818230.67 | 54012078.67 | 31778490.67 | 22399512.67 | 27718332.00 | |
| N-acetyl-(L)-arginine | 459223.00 | 370073.67 | 634342.67 | 485369.33 | 522809.67 | 674737.67 | |
| N-Acetyl-L-citrulline | 491989002.67 | 274585589.33 | 579429994.67 | 264013493.33 | 196033984.00 | 271972405.33 | |
| N-Acetyl-L-glutamate | 188885.87 | 266990.73 | 183366.06 | 746692.31 | 811163.92 | 747856.27 | |
| N-Acetylornithine | 336688.02 | 903184.31 | 354105.40 | 430050.11 | 280290.85 | 802456.44 | |
| N-Acetylputrescine | 17659263.00 | 11963911.67 | 29942209.33 | 49059318.67 | 52475965.33 | 57311054.67 | |
| N-Acetylvanilalanine | - | - | - | - | - | 86907.35 | |
| NAD+ | 19227530.33 | 17290819.00 | 16734947.33 | 57589794.67 | 53890218.67 | 62068009.33 | |
| NADP+ | 3679097.67 | 3283410.33 | 3604795.33 | 5150231.67 | 4610589.67 | 5331975.33 | |
| N-Benzyloxycarbonylglycine | 1739755.83 | 1276772.67 | 1843004.54 | 1081169.17 | 923465.96 | 1422882.08 | |
| N-Carbamoyl-L-aspartate | 490382.81 | 517977.14 | 468637.29 | 445731.26 | 370869.15 | 460174.07 | |
| N-Carbamyl-L-glutamate | 205573.94 | 267974.08 | 258233.48 | 2365641.00 | 2751151.42 | 2512408.75 | |
| N-Decanoylglycine | 635624.81 | 989312.85 | 1938772.42 | 783301.96 | 1009934.83 | 1092331.90 | |
| N-dimethylethanolamine | 320879.74 | 300963.84 | 289292.10 | 259494.51 | 240155.03 | 275816.33 | |
| Ne,Ne dimethyllysine | 518721.59 | 489590.52 | 502325.98 | 6574614.83 | 6127546.83 | 6180570.00 | |
| Neopterin | 59545.00 | 72432.00 | 64540.00 | 1347116.33 | 1383178.33 | 1445721.67 | |
| N-Ethylglycocyamine | 152144.32 | 206708.30 | 284171.43 | 146742.73 | 135404.21 | 210906.29 | |
| N-Ethylmaleimide | 116932.25 | - | 133869.44 | 592564.99 | 334601.05 | 273087.39 | |
| N-Ethylmaleimide_2 | 595130.85 | 547930.56 | 481098.26 | 1282927.08 | 1323444.58 | 1100318.15 | |
| N-ethylsuccinimide | 3614687.00 | 3081098.33 | 4820026.50 | 3198383.50 | 4077071.33 | 3446792.33 | |
| N-Formimino-L-glutamate | 389417.34 | 276842.24 | 233448.02 | 491536.24 | 278871.57 | 400028.58 | |
| NG,NG-Dimethyl-L-arginine | 274030.76 | 229094.02 | 311498.26 | 2865743.42 | 2730277.75 | 2931704.83 | |
| N-Heptanoylhomoserine lactone | 221778.65 | 251020.52 | 423289.18 | 351537.30 | 401309.26 | 389880.80 | |
| N-hydroxyvaline | 882722.96 | 1298947.60 | 751875.12 | 3431146.08 | 2442118.71 | 2796552.42 | |
| Nicotinamide | 208560432.00 | 105104114.67 | 198090901.33 | 126554704.00 | 79459090.67 | 110927909.33 | |
| nicotinamide riboside | 104319.00 | 106529.00 | 103344.00 | 88797.33 | 96354.00 | 85772.67 | |
| nitrocyclohexane | 383582.03 | 255228.48 | 331699.27 | 287728.32 | 273398.83 | 323422.18 | |
| N,N-Dimethylglycine | 1964806.71 | 2263843.50 | 2135301.92 | 2349532.17 | 2450509.67 | 2459940.17 | |
| N-Nonanoylglycine | 615950.82 | 682042.46 | 557193.43 | 534232.53 | 577544.51 | 415068.68 | |
| N-(octanoyl)-L-homoserine | 716062.46 | 846563.50 | 850604.29 | 1802525.58 | 2024562.25 | 1827157.96 | |
| nornorcapsaicin | 863335.10 | 1384882.71 | 2291498.38 | 903761.98 | 1183679.42 | 1181282.35 | |
| N-palmitoyl phenylalanine | 208774.00 | 491376.00 | 611698.67 | 262220.00 | 292577.00 | 296581.33 | |
| N(pi)-Methyl-L-histidine | 2502782.33 | 1811528.46 | 2537764.58 | 2207966.04 | 2050562.33 | 2344685.17 | |
| N-stearoyl histidine | - | - | - | 596569.00 | 716289.00 | 569336.00 | |
| N-stearoyl tyrosine | 1634453.29 | 1840039.46 | 965501.46 | - | - | - | |
| N-succinyl-L-citrulline | 4118571.00 | 733451.00 | 9164772.00 | 998384.67 | 1605803.00 | 1741376.33 | |
| N-α-acetyl-arginine | 69617.45 | 60549.58 | 100917.39 | 67951.92 | 49315.23 | 70219.87 | |
| O-Acetylcarnitine | 150121125.33 | 169900442.67 | 139069504.00 | 714758357.33 | 676556885.33 | 698913728.00 | |
| O-Acetylcarnitine_2 | 69393.91 | 44269.41 | 190490.33 | 73384.90 | 62998.28 | 142213.39 | |
| O-Acetylneuraminic acid | 2797818.33 | 1400485.67 | 5398815.67 | 2061340.33 | 1736824.67 | 3525318.33 | |
| O-Butanoylcarnitine | 1502058.75 | 1403942.58 | 1397535.08 | 1745476.08 | 1613486.25 | 1626305.00 | |
| Octylamine | 3948324.58 | 10253093.00 | 6798453.33 | 3400853.42 | 1508014.21 | 4813314.67 | |
| O-Phospho-L-serine | - | - | - | 353107.24 | 374721.18 | 423694.92 | |
| O-Propanoylcarnitine | 16148259.00 | 19793422.00 | 15815264.00 | 9933714.17 | 9925662.33 | 10490602.00 | |
| O-Succinyl-L-homoserine | 1415900.71 | 846813.56 | 2970133.92 | 6297330.67 | 5387859.67 | 11596487.00 | |
| O-Succinyl-L-homoserine_2 | 81076.13 | 56925.77 | 84390.84 | 120065.58 | 138878.70 | 231289.59 | |
| Ovothiol disulfide | 405477.91 | 592570.77 | 116205.09 | - | - | - | |
| p-aminobenzoyl glutamate | 255390.00 | - | 490726.67 | 413658.33 | 226590.00 | 398784.00 | |
| [PC (14:0/18:1)] 1-tetradecanoyl-2-(11Z-octadecenoyl)-sn-gly... | 8579205.83 | 8649940.83 | 8163697.17 | 12134614.67 | 12502693.33 | 11996582.67 | |
| [PC (14:0/18:2)] 1-tetradecanoyl-2-(9Z,12Z-octadecadienoyl)-... | 1680685.33 | 1648149.67 | 1287784.67 | 1755672.00 | 1307198.33 | 1715774.33 | |
| [PC (14:0)] 1-tetradecanoyl-sn-glycero-3-phosphocholine | 1715216.42 | 1438030.29 | 1491618.88 | 1713366.67 | 1309191.25 | 1614131.08 | |
| PC(14:1(9Z)/15:0) | 1402112.33 | 1325437.67 | 976311.67 | 369503.00 | 270612.67 | 461100.67 | |
| [PC (15:0/15:0)] 1,2-dipentadecanoyl-sn-glycero-3-phosphocho... | 3779823.00 | 3752736.83 | 3780440.67 | 3526165.25 | 3629043.75 | 3616717.92 | |
| [PC (15:0)] 1-pentadecanoyl-sn-glycero-3-phosphocholine | 1757247.92 | 2052224.00 | 1913648.33 | 2262252.67 | 1885193.33 | 2218710.50 | |
| [PC (16:0/16:0)] 1-hexadecanoyl-2-hexadecanoyl-sn-glycero-3-... | 13806024.33 | 13954206.67 | 14716144.67 | 42971556.00 | 42579745.33 | 42240641.33 | |
| [PC (16:0/18:1)] 1-hexadecanoyl-2-(11Z-octadecenoyl)-sn-glyc... | 149828848.00 | 159807221.33 | 146908074.67 | 171016106.67 | 179139909.33 | 174356458.67 | |
| [PC (16:0/18:2)] 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-s... | 185858496.00 | 180049744.00 | 152717232.00 | 83623192.00 | 77860144.00 | 75465904.00 | |
| [PC (16:0/18:3)] 1-hexadecanoyl-2-(9Z,12Z,15Z-octadecatrieno... | 5705220.33 | 4880111.67 | 4199595.33 | 4537455.67 | 4572110.00 | 4131411.33 | |
| [PC (16:0)] 1-hexadecanoyl-sn-glycero-3-phosphocholine | 266397552.00 | 258761397.33 | 236271797.33 | 266309514.67 | 225221861.33 | 237931621.33 | |
| [PC (16:0/20:4)] 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetra... | 58137653.33 | 53002672.00 | 41340424.00 | 118757928.00 | 105046085.33 | 104888400.00 | |
| [PC (16:0/22:6)] 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-doc... | 17711810.00 | 16953614.67 | 12320815.67 | 11696282.33 | 9701327.00 | 10007033.33 | |
| [PC (16:0/3:0)] 1-hexadecanoyl-2-(2E-propionyl)-sn-glycero-3... | - | 215977.31 | 325396.66 | - | 528438.33 | 326232.81 | |
| PC(16:0/5:0(CHO)) | 1226303.73 | 3949772.25 | 7465432.67 | 10498453.33 | 12121398.00 | 14212991.00 | |
| PC(16:0/5:0(COOH)) | 671999.10 | 2714864.83 | 3112853.92 | 3442242.33 | 5344635.33 | 5792103.33 | |
| PC(16:0/P-18:1(11Z)) | 3264037.33 | 2829776.92 | 2803969.75 | 1910903.38 | 1568750.88 | 1695842.96 | |
| [PC (16:1)] 1-(1Z-hexadecenyl)-sn-glycero-3-phosphocholine | 3066552.42 | 2117742.46 | 1952976.58 | 1068433.52 | 734812.06 | 669461.58 | |
| [PC (16:2)] 1-hexadecyl-sn-glycero-3-phosphocholine | 4661457.00 | 4283617.67 | 4143132.67 | 4865699.00 | 4132713.00 | 4406315.67 | |
| [PC (18:0/22:4)] 1-octadecanoyl-2-(7Z,10Z,13Z,16Z-docosatetr... | 1332401.54 | 1145268.90 | 1058459.96 | 1868049.79 | 1699017.38 | 1556721.12 | |
| [PC (18:0/22:5)] 1-octadecanoyl-2-(4Z,7Z,10Z,13Z,16Z-docosap... | 3000893.00 | 3176593.83 | 2525727.42 | 3002747.33 | 2485277.50 | 2998653.33 | |
| PC(18:0/P-18:1(11Z)) | - | - | 579173.81 | 4329577.83 | 4808715.67 | 4029228.75 | |
| [PC (18:1)] 1-(11Z-octadecenyl)-sn-glycero-3-phosphocholine | 2273173.08 | 1889732.58 | 1670652.54 | 2233789.46 | 1796020.62 | 1849530.29 | |
| [PC (18:1/18:1)] 1-(9Z-octadecenoyl)-2-(9Z-octadecenoyl)-sn-... | 70849373.33 | 70303288.00 | 62147340.00 | 25815282.00 | 24702989.33 | 25726742.67 | |
| [PC (18:1/20:3)] 1-(9Z-octadecenoyl)-2-(5Z,8Z,11Z-eicosatrie... | 27780346.67 | 24660418.00 | 19599748.00 | 41390148.00 | 39476869.33 | 38548792.00 | |
| [PC (18:1/22:5)] 1-(11Z-octadecenoyl)-2-(7Z,10Z,13Z,16Z,19Z-... | 5367752.00 | 5144202.83 | 3994095.08 | 3899061.58 | 2876383.17 | 2923369.33 | |
| [PC (18:2)] 1-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoc... | 21672287.33 | 18604374.00 | 15535779.00 | 16675564.00 | 13060174.33 | 14673317.00 | |
| [PC (19:3)] 1-(10Z,13Z,16Z-nonadecatrienoyl)-sn-glycero-3-ph... | 218651.00 | - | 393054.00 | 10058683.33 | 11647552.33 | 10186916.00 | |
| PC(22:2(13Z,16Z)/P-18:1(11Z)) | 708414.00 | 545449.67 | 608796.00 | 1228856.33 | 991555.67 | 1014476.00 | |
| PC(22:4(7Z,10Z,13Z,16Z)/P-18:0) | 935365.33 | 869669.67 | 703044.67 | 2319323.67 | 1936841.00 | 1985291.67 | |
| PC(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z)) | 936393.79 | 799960.06 | 828859.75 | 2461893.67 | 2073597.08 | 1935967.12 | |
| [PC (22:6)] 1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-gly... | 1266717.00 | 1062567.33 | 542471.33 | 1777977.33 | 1772293.67 | 1561359.00 | |
| [PC acetyl(16:1)] 1-(9Z-hexadecenoyl)-2-acetyl-sn-glycero-3-... | 446331.60 | 583325.04 | 1139706.62 | 2945696.67 | 2887134.58 | 3111959.33 | |
| [PE (16:0/16:0)] 1,2-dihexadecanoyl-sn-glycero-3-phosphoetha... | 936147.69 | 1244641.29 | 1023708.90 | 250972.70 | 256655.52 | 314871.57 | |
| [PE (16:0/18:2)] 1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-s... | 2747022.33 | 2150280.33 | 2421799.33 | 1266696.33 | 1353848.00 | 1412024.33 | |
| [PE (16:0/18:3)] 1-hexadecanoyl-2-(9Z,12Z,15Z-octadecatrieno... | 911617.00 | 856539.33 | 552099.33 | 352155.67 | 311064.33 | 350018.67 | |
| [PE (16:0/20:4)] 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetra... | 7740987.67 | 7420533.67 | 5333299.67 | 7845192.00 | 7546616.00 | 7321748.67 | |
| [PE (16:0/22:6)] 1-hexadecanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-doc... | 3530962.50 | 3628144.25 | 2451416.75 | 3612561.25 | 2960669.25 | 2949168.50 | |
| [PE (18:0)] 1-octadecanoyl-sn-glycero-3-phosphoethanolamine | 1907886.25 | 1820804.67 | 1751964.33 | 2454828.33 | 2371868.17 | 2369509.08 | |
| [PE (18:1)] 1-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanola... | 2179224.79 | 3365461.17 | 2629410.58 | 9268743.67 | 12449342.33 | 9528503.33 | |
| [PE (18:1/20:4)] 1-(1Z-octadecenyl)-2-(5Z,8Z,11Z,14Z-eicosat... | 9420090.67 | 9227342.67 | 6759355.33 | 4608051.67 | 2655587.33 | 3311585.00 | |
| PE(18:3(6Z,9Z,12Z)/P-18:1(11Z)) | 3968289.33 | 3602666.58 | 2477322.92 | 1509817.46 | 788736.08 | 1075657.19 | |
| [PE (20:4)] 1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-... | 13013486.33 | 16630502.00 | 11130135.67 | 68052158.67 | 78969917.33 | 68848584.00 | |
| PE(20:4(5Z,8Z,11Z,14Z)/P-18:1(11Z)) | 6437644.50 | 5706817.00 | 3905250.92 | 2886836.50 | 1568776.25 | 1937698.62 | |
| PE(22:4(7Z,10Z,13Z,16Z)/P-18:1(11Z)) | 4392068.67 | 3716846.00 | 2302129.33 | 1596022.33 | 1031166.33 | 1165045.33 | |
| Perillyl alcohol | 4645199.67 | 8475202.67 | 4670011.33 | 3015054.00 | 1840958.00 | 3847742.67 | |
| Phe-Gly | 1145792.33 | 704413.33 | 709434.67 | 473259.33 | 279658.67 | 365418.00 | |
| Phenylethylmalonamide | 2138582.96 | 1206010.94 | 1291202.77 | 837497.33 | 370347.10 | 706451.58 | |
| Phe-Pro | 1434825.08 | 1419661.38 | 1248988.25 | - | - | - | |
| Phe-Trp | 2794295.83 | 2098031.58 | 3797234.67 | 5551305.50 | 4937983.25 | 6031180.67 | |
| Phosphocreatine | 743775.23 | 703101.29 | 702826.44 | 28598306.67 | 28155582.00 | 28769144.00 | |
| Phosphonoacetaldehyde | 471617.01 | 442754.14 | 442606.68 | 845116.31 | 959620.15 | 1030592.42 | |
| Picolinamide | 7986858.33 | 8623235.00 | 9349599.67 | 23241568.00 | 22898380.67 | 23346304.00 | |
| Piperidine | 257605.81 | 163355.02 | 234790.35 | 369555.76 | 388131.19 | 475030.67 | |
| Pro-Arg-His | 495864.08 | 484271.52 | 581643.64 | 604082.80 | 589991.72 | 631585.54 | |
| Pro-Arg-His_2 | 556884.56 | 604673.68 | 597537.77 | 559209.76 | 542990.57 | 599626.85 | |
| Pro-Pro | 95158.67 | 87255.96 | 629340.94 | 434116.25 | 346754.41 | 432953.99 | |
| Pro-Ser-Ser | 1341087.33 | 1370379.33 | 616030.00 | 483282.67 | 481894.33 | 586823.00 | |
| Protoporphyrin | - | - | - | 1673182.46 | 1463931.21 | 1676479.21 | |
| PS(12:0/15:0) | 1214663.62 | 3860495.67 | 6329079.33 | 2558694.75 | 3602034.08 | 3887042.92 | |
| PS(18:0/18:1(9Z)) | 2309115.58 | 4595309.75 | 7815842.50 | 3796461.08 | 5587125.33 | 5529204.33 | |
| [PS (18:0/20:4)] 1-octadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetra... | 39296682.67 | 34831824.00 | 26580385.33 | 39972876.00 | 35399007.33 | 34792711.33 | |
| PS(18:0/22:5(7Z,10Z,13Z,16Z,19Z)) | 13092580.33 | 11418113.67 | 8495736.67 | 5741994.33 | 4903643.67 | 4984006.00 | |
| PS(22:1(11Z)/0:0) | 482705.66 | 1618396.83 | 2804527.08 | 1889564.25 | 2369569.50 | 2447399.92 | |
| PS(36:2) | 2653464.00 | 2957340.17 | 9748469.00 | 3665355.58 | 3006468.17 | 4146313.58 | |
| PS(38:2) | 626406.90 | 1953303.17 | 4816165.50 | 2377456.46 | 3753865.92 | 3385864.58 | |
| PS(38:5) | 6033902.67 | 5206140.33 | 3708282.33 | 7148496.33 | 6560616.33 | 6298807.33 | |
| PS(40:4) | 6607302.67 | 5991289.67 | 4408603.33 | 3707122.00 | 3471666.33 | 3437957.67 | |
| psicoselysine | 825365.19 | 333302.01 | 1713722.79 | 1050707.19 | 716803.44 | 1742296.88 | |
| PS(O-16:0/22:2(13Z,16Z)) | 1055286.10 | 2398781.92 | 3575106.33 | 3414307.25 | 4130211.67 | 3938390.50 | |
| PS(O-18:0/20:3(8Z,11Z,14Z)) | 1536804.21 | 2806716.17 | 4435772.00 | 5367831.83 | 7043416.00 | 6366304.67 | |
| PS(O-18:0/20:5(5Z,8Z,11Z,14Z,17Z)) | - | - | - | 4093795.83 | 5228605.00 | 4952594.00 | |
| PS(O-18:0/22:4(7Z,10Z,13Z,16Z)) | 557495.67 | 1086180.00 | 926804.00 | 3356448.00 | 4799157.33 | 3839131.00 | |
| PS(O-20:0/20:5(5Z,8Z,11Z,14Z,17Z)) | - | 830221.12 | 725042.62 | 3428097.33 | 4401822.00 | 3570319.33 | |
| Pyridoxal | 26144879.33 | 37028518.67 | 29201392.00 | 18113000.00 | 17983396.33 | 16183068.00 | |
| Pyridoxamine | 1000276.42 | 1218266.23 | 939460.48 | 812942.04 | 953507.52 | 889889.23 | |
| Pyridoxine | 777836.00 | 814981.00 | 1229990.00 | 3162417.67 | 3095104.33 | 2977681.33 | |
| Quinolin-2-ol | - | - | 194392.73 | 223036.12 | - | 162562.25 | |
| Retronecine | 265734.82 | 419351.24 | 247770.77 | 85934.70 | 107959.64 | 80638.60 | |
| Riboflavin | 209395.44 | 125904.48 | 220851.41 | 269621.40 | 92031.00 | 237593.57 | |
| Ricinine | 275237.33 | 259878.00 | 285595.00 | 218997.33 | 129754.33 | 198549.00 | |
| S-Adenosyl-L-homocysteine | 442153.54 | 979103.96 | 313736.36 | 576560.68 | 1067950.50 | 966477.25 | |
| S-Adenosyl-L-methionine | 449675.01 | 873620.17 | 544046.97 | 1168309.75 | 1554554.42 | 1362980.42 | |
| (-)-Salsolinol | 59054.00 | - | 90707.00 | 66336.00 | 74183.00 | 69627.50 | |
| Sanguinarine | 140847.20 | 152820.91 | 175982.51 | 213046.46 | 266107.09 | 219236.34 | |
| S-Butyl-DL-homocysteine-[S,R]-sulfoximine | - | - | 87548.42 | 134099.68 | 111906.75 | 175730.45 | |
| (S)-Coclaurine | 167935.17 | 110215.95 | 144403.52 | 155445.24 | 135779.68 | 139041.28 | |
| Slaframine | 6189657.00 | 6025737.33 | 5172537.00 | 4896116.00 | 3504771.33 | 4344589.67 | |
| Slaframine_2 | 25114385.33 | 29847716.67 | 24943415.33 | 19125139.00 | 18512737.67 | 18006684.67 | |
| SM(d16:1/18:1) | 10937147.33 | 11016725.33 | 8944286.67 | 7573043.67 | 6393454.00 | 7637202.33 | |
| SM(d16:1/22:1) | 992298.67 | 846463.33 | 895047.00 | 638959.67 | 510300.67 | 609042.67 | |
| SM(d18:0/24:1(15Z)(OH)) | - | 588267.44 | 1219535.71 | 2825285.67 | 3582644.75 | 3892904.67 | |
| SM(d18:1/14:0) | 8090177.00 | 7759478.33 | 7026986.67 | 5329754.00 | 4332410.33 | 5264285.00 | |
| SM(d18:1/17:0) | 193080.33 | 241182.57 | 226533.52 | 149270.77 | 100991.00 | 137346.65 | |
| SM(d18:1/18:0) | 454342.67 | 572589.00 | 505058.67 | 670921.00 | 557380.00 | 606467.67 | |
| SM(d18:1/18:1(9Z)) | 4107731.67 | 3640772.00 | 3331324.67 | 2470204.33 | 2391019.33 | 3104492.00 | |
| SM(d18:1/22:0) | 752334.98 | 752059.67 | 826875.38 | 464057.40 | 521397.91 | 506801.43 | |
| SM(d18:1/22:1(13Z)) | 268836.08 | 311900.04 | 308862.97 | 204541.48 | 199104.05 | 203321.12 | |
| SM(d18:1/24:1(15Z)) | 6480347.00 | 6519630.67 | 6649496.33 | 4257980.67 | 3836680.67 | 4592088.00 | |
| sn-glycero-3-Phosphocholine | 100109181.33 | 104670069.33 | 98580200.00 | 25288916.00 | 22855631.33 | 23996790.00 | |
| sn-glycero-3-Phosphoethanolamine | 1234961.62 | 1372894.38 | 1349633.00 | 604518.01 | 732747.75 | 669597.27 | |
| (S)-Norcoclaurine | - | - | 228023.85 | 537954.06 | 838814.58 | 798567.27 | |
| [SP (16:0)] N-(hexadecanoyl)-sphing-4-enine | 1104505.27 | 988733.50 | 873181.48 | 4018078.58 | 3674479.33 | 3504737.67 | |
| [SP (16:0)] N-(hexadecanoyl)-sphing-4-enine-1-phosphocholine | 39005351.33 | 39238192.00 | 35901688.00 | 35326983.33 | 30124840.67 | 38654714.67 | |
| [SP (2:0)] sphinga-4E,14Z-dienine | 476082.82 | 983298.33 | 685478.21 | 757813.00 | 613231.96 | 922932.96 | |
| [SP] 3-dehydrosphinganine | 77207.13 | 80698.71 | 104028.96 | 1646675.29 | 1962446.33 | 1652689.75 | |
| [SP amino,tetramethyl(4:0/18:0/3:0)] 2S-amino-5,9,13,17-tetr... | 305648.67 | 699886.00 | 957725.00 | 412549.67 | 591143.67 | 630026.33 | |
| [SP hydrox] 6-hydroxysphing-4E-enine | 455988.96 | 506212.07 | 438338.86 | 470129.21 | 367033.61 | 893696.12 | |
| [SP] Sphing-4-enine-1-phosphate | - | - | - | 9269854.50 | 7175817.83 | 8170379.83 | |
| [SP] Sphinganine-1-phosphate | - | - | - | 3136784.25 | 2548548.50 | 2727164.33 | |
| S-Succinylglutathione | 750252.65 | 225755.02 | 411189.39 | 1789636.79 | 1090574.06 | 1883797.46 | |
| [ST (2:0)] 5alpha-cholesta-8,24-dien-3beta-ol | 305690.10 | 644633.06 | 1108096.69 | 613223.21 | 700266.81 | 951117.38 | |
| [ST (20:5)] cholest-5-en-3beta-yl (5Z,8Z,11Z,14Z,17Z-eicosap... | 439283.67 | - | 294958.33 | 369264.00 | - | - | |
| [ST (3:0)] (5Z,7E)-(1S,3R)-24-nor-9,10-seco-5,7,10(19)-chola... | 172366.00 | 127093.00 | 130063.00 | 856105.33 | 1121015.67 | 1033424.00 | |
| [ST (3:0)] (5Z,7E)-(1S,3R,24R)-22-oxa-9,10-seco-5,7,10(19)-c... | 1523115.00 | 1187387.67 | 1135996.33 | 1048721.33 | 1031565.33 | 990858.33 | |
| [ST (3:0)] cholest-5Z,7Z,24-trien-3beta-ol | 326222.42 | 960850.15 | 2133768.75 | 842648.81 | 1488062.00 | 1381361.50 | |
| [ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene | 2543966.00 | 2581194.33 | 2939032.33 | 2518025.67 | 2767630.00 | 2761152.33 | |
| [ST] (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene_2 | 3430216.75 | 3625435.67 | 7315881.17 | 5834607.67 | 7479363.00 | 5936403.17 | |
| Stachydrine | 59321844.00 | 87285794.67 | 48047536.00 | 1760785.71 | 1670108.12 | 1702678.29 | |
| Stearoylcarnitine | 12337225.33 | 12525758.33 | 11952500.33 | 1714951.42 | 1736458.54 | 1820461.67 | |
| [ST hydroxy(5:0)] 3-hydroxy-estra-1,3,5(10),6,8-pentaen-17-o... | 76837.66 | - | 81811.10 | 258503.87 | 214694.09 | 276117.21 | |
| Suberylglycine | - | - | - | 136875.41 | 76184.62 | 116877.20 | |
| Succinyl proline | 152762.37 | 76314.44 | 109357.79 | 93509.85 | 76982.15 | 102357.37 | |
| Tazettine | 337947.67 | 3956224.67 | 335794.67 | - | 222886.00 | 920712.33 | |
| Tenuazonic acid | 135618.84 | 163288.43 | 409360.16 | 596564.86 | 584236.95 | 525663.25 | |
| Tetradecanoylcarnitine | 1267904.83 | 1146224.33 | 1049258.58 | 674172.42 | 677324.75 | 584475.57 | |
| Tetrapentylammonium | 1496925.00 | 963799.33 | 706536.33 | 22031604.00 | 69976240.00 | 20187654.67 | |
| Thalicsessine | 39172676.00 | 11873210.33 | 52698954.67 | 54380968.00 | 37703460.00 | 65524749.33 | |
| Thiamin | 15037274.33 | 7222546.67 | 17093015.33 | 17241870.33 | 15911327.33 | 18760400.67 | |
| Thiomorpholine 3-carboxylate | 164672.65 | 228279.71 | 443010.26 | 1167185.31 | 1105513.23 | 1124294.38 | |
| Thiomorpholine 3-carboxylate_2 | 115379.38 | - | 273054.41 | 782880.56 | 683095.60 | 813780.77 | |
| Thr-Ala | 4621208.25 | 5490284.17 | 4657838.75 | 65894349.33 | 63297622.67 | 61843152.00 | |
| Thr-Ala-Asp | 1398803.33 | 1001598.67 | 1204113.00 | 688199.33 | 558217.33 | 653791.33 | |
| Thr-Cys | 416977.56 | 565967.89 | 1216308.00 | 2148737.04 | 3575673.67 | 3376963.08 | |
| Thr-Cys_2 | 10478.62 | 8203.56 | 46629.32 | 62069.64 | 66608.39 | 70577.89 | |
| trans-Hexadec-2-enoylcarnitine | 1827721.04 | 1857141.50 | 1614200.42 | 732829.60 | 584910.31 | 570250.16 | |
| Tributyl phosphate | 2362693.42 | 2592198.33 | 2232412.21 | 2200130.46 | 1736531.96 | 2223199.29 | |
| Tris(butoxyethyl)phosphate | 1995020.67 | 1709261.00 | 2755237.67 | 1999173.33 | 2095034.33 | 1743475.00 | |
| Trp-Trp-Tyr-Tyr | 8164914.67 | 2183873.33 | 8548673.00 | 14167964.33 | 12463057.00 | 16091204.67 | |
| Tyr-OEt | - | - | 239877.99 | 415085.36 | 561394.55 | 520340.38 | |
| UDP | 255830.81 | 296053.05 | 235466.13 | 2005638.58 | 1923532.04 | 2199732.96 | |
| Urethane | 97201.00 | 89208.00 | 86471.00 | 174324.33 | 189092.00 | 206888.00 | |
| Urethane_2 | 68625.00 | 65546.00 | 66685.67 | 168010.00 | 158522.00 | 159606.00 | |
| Urocanate | 479181.01 | 544093.52 | 418768.14 | 511898.12 | 423967.54 | 1345966.46 | |
| Val-Asn-Asp | 1198574.33 | 327011.33 | 1551607.67 | 1702689.67 | 1197140.67 | 1714072.33 | |
| Valeroidine | 57596.52 | 91531.16 | 151519.73 | 243474.74 | 200295.57 | 185469.21 | |
| Val-Gly | 1431065.88 | 4093608.58 | 1187945.38 | 1354882.50 | 1233282.71 | 2437644.42 | |
| Val-Pro-Arg | 295605.76 | 591111.76 | 225737.57 | 423410.09 | 152287.30 | 523722.27 | |
| Val-Ser | 731224.83 | 475378.91 | 1407127.29 | 307728.83 | 1209266.19 | 559732.88 | |
| Verticine | 323275.17 | 677125.58 | 811030.08 | 441336.97 | 471034.28 | 552577.27 | |
| (Z)-4-Hydroxyphenylacetaldehyde-oxime | 288722.92 | 198137.93 | 389287.18 | 326594.84 | 270230.20 | 329245.45 | |
| ZAPA | 368322.33 | 76945.33 | 444085.00 | 359767.00 | 225225.67 | 432858.67 | |
| α-(2,6-anhydro-3-deoxy-D-arabino-heptulopyranosid)onate 7-p... | 210062.67 | 205574.33 | 798873.67 | 636829.33 | 458502.00 | 1412676.33 |
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 |
