Metabolite_name RefMet_name K562_longterm_PKCi_HILIC_100nM_FA_GFX_1 K562_longterm_PKCi_HILIC_100nM_FA_GFX_2 K562_longterm_PKCi_HILIC_100nM_FA_GFX_3 K562_longterm_PKCi_HILIC_100nM_FA_GFX_4 K562_longterm_PKCi_HILIC_100nM_FA_1 K562_longterm_PKCi_HILIC_100nM_FA_2 K562_longterm_PKCi_HILIC_100nM_FA_3 K562_longterm_PKCi_HILIC_100nM_FA_4 K562_longterm_PKCi_HILIC_2000nM_FA_GFX_1 K562_longterm_PKCi_HILIC_2000nM_FA_GFX_2 K562_longterm_PKCi_HILIC_2000nM_FA_GFX_3 K562_longterm_PKCi_HILIC_2000nM_FA_GFX_4 K562_longterm_PKCi_HILIC_2000nM_FA_1 K562_longterm_PKCi_HILIC_2000nM_FA_2 K562_longterm_PKCi_HILIC_2000nM_FA_3 K562_longterm_PKCi_HILIC_2000nM_FA_4 Factors - Treatment:100nM_FA_GFX Treatment:100nM_FA_GFX Treatment:100nM_FA_GFX Treatment:100nM_FA_GFX Treatment:100nM_FA_Veh Treatment:100nM_FA_Veh Treatment:100nM_FA_Veh Treatment:100nM_FA_Veh Treatment:2000nM_FA_GFX Treatment:2000nM_FA_GFX Treatment:2000nM_FA_GFX Treatment:2000nM_FA_GFX Treatment:2000nM_FA_Veh Treatment:2000nM_FA_Veh Treatment:2000nM_FA_Veh Treatment:2000nM_FA_Veh 1-methylnicotinamide 1-Methyl nicotinamide 702240527.2000 727221136.7000 767745819.9000 779448445.2000 2023964147 1994699510 2026425142 1859793927 817689160.7000 769015411.2000 779167936.5000 743866018.8000 1508765220 1355796042 1456725405 1365370024 2_3-Bisphosphoglycerate 4027154.8370 3682719.5470 3345652.4440 3305036.6260 6756078.5540 4781408.9950 5687638.5800 6688004.1790 3928322.5730 4733071.0160 4086910.1540 3838970.6050 3728575.4640 4465268.5080 4158831.4050 3959412.6630 2-hydroxyglutarate 2-Hydroxyglutaric acid 1018405729 976246052 731429564.7000 804179933.2000 488048499.5000 672532862.4000 811827067.5000 589018801.5000 874619772 577524923.3000 624665014 811488598.9000 765747683.3000 800907004 721792099.6000 749829828.2000 2-oxobutyric_acid 3-Methyl pyruvic acid 6221106.4790 6256300.2030 6901845.3140 6768001.5240 2848371.7850 3708339.8860 4039151.4730 3717447.5270 4492591.2520 5045230.9040 5992454.2500 7751512.4090 4115641.8280 4484002.4060 4942898.6170 4584942.9280 3-methyl-2-oxopentanoic acid 3-Methyl-2-oxovaleric acid 9134982.0350 9756462.2150 10478179.3100 7812649.7580 10767261.2900 10775770.1200 9056409.7010 10971516.5900 11417679.0700 11535092.6200 11650720.3100 9969396.2690 16015390.5900 16778231.1000 15280423 17100302.7100 3-phosphoglycerate 3-Phosphoglyceric acid 33065617.8100 31528034.7700 32328768.5400 35760044.2800 43520935.9700 35748084.6100 35168695.6500 53039049.7900 37567321.4100 42754688.7200 35173569.8500 34790605.6500 36846105.6400 33979846.6700 33797800.0400 36031365.0800 6-phosphogluconate 6-Phosphogluconic acid 4859197.4140 4352366.4590 4873074.8970 4319942.2060 4427972.3150 3769887.8300 2934607.8700 3872696.6730 5996383.9570 7319334.5730 7316294.2450 6500923.6470 6386247.0130 6730091.9410 5930647.6460 7390680.1930 acetylcarnitine CAR 2:0 39632756.6200 34365103.5100 36371423.9300 37537556.1800 48373002.7100 53252797.9300 38065098.3800 49186489.0400 50573227.2800 54920585.9600 51886169.1700 47513376.0400 65975400.3400 68683993.6500 66948519.6600 62524615.4100 Acetyl CoA Acetyl-CoA 6829487.2410 6460241.7180 6670946.8040 6625772.3070 5322726.4200 5382189.0680 5481455.6410 5665370.5590 8416927.7360 8659765.4330 8170351.7160 7998897.8290 6618236.0390 6967927.1830 6919993.6590 6685388.9050 ADP ADP 28812708.8400 29118754.1200 33659511.5500 32018797.2400 38657306.8800 33666887.4500 34742927.8600 37169464.5200 53204764.2900 71561071.7700 59648173.6200 52253415.7500 54515003.8600 51007185.3400 53143760.8400 55372812.0200 AICAR AICAR 172714233.4000 170278626.2000 181357582.5000 172616378 507589529.1000 502277517.5000 509806648.4000 523983456.5000 37193679.5600 36743256.5900 36279199.3700 32879109.6100 79091828.1600 65576934.2600 65908639.0600 51066348.3600 alanine Alanine 32065683.1200 32909956.2100 25420485.3900 24251781.4000 29400557.5400 43129106.2000 34417561.2400 25349397.1300 15019743.7500 13477971.5300 17485368.7700 10818105.8000 19300429.9600 20261401.6800 17433664.3100 21915688.4900 Alpha Ketoglutarate 2-Oxoglutaric acid 57756859.0600 70696383.3500 59301918.6700 66433465.8300 41902520.8400 55250360.6400 56460672.3700 45474461.9600 63923749.6300 54090448.7200 58180475.8800 66844207.8400 58003217.7300 55304617.8500 52918474.1900 60252210.1500 AMP-dGMP 14009158.9800 14396992.3100 15310589.9000 15265127.8600 13644476 13462255.8000 7766991.8800 13910475.2900 19407177.4000 19348779.9700 17250693.8300 18585034.5800 19051679.0400 19645515.7500 19877082.8100 19320908.6100 arginine Arginine 3936956121 4180427199 3614113747 4519849089 3966286685 4341564973 4744473857 4489582683 4276146260 3359775161 2935251294 4090627503 4080241426 3943586375 4372765013 4141338876 ascorbate Vitamin C 12447392.5600 11861376.1200 9560923.6220 9039725.9010 17020822.9100 11009884.0300 9438901.8990 11156915.8300 16703863.4200 16391713.8400 53659270.1400 18178615.9400 38032199.6400 19471011.7000 19271918.3300 18214105.1400 asparagine Asparagine 229883754.7000 219821278.6000 217300064.3000 250931272.1000 291545002.1000 302711457.7000 296864853 290482483.2000 309627503.8000 279151514.4000 274516654.2000 317196545.2000 337625953.3000 313430839.1000 332841286.3000 327573424.2000 aspartate Aspartic acid 1175246687 1186668019 1233208484 1192928683 966834207.5000 1032085387 1069611861 962974005.1000 980755746.9000 916691637.3000 876989821.6000 1035628380 805865026.8000 715814315.1000 733523022.3000 794180162.2000 ATP ATP 340800667.6000 326278414.6000 382040149.6000 374836772 418566789.9000 327976546.1000 362652265.9000 395683682.4000 621592694.7000 722271217.1000 620958414.3000 594986262.5000 589062897.7000 610323002.8000 611046121.6000 609486374 beta-alanine beta-Alanine 160641526.4000 169609926.4000 148837145.7000 181202267.9000 158690764.3000 174234592.2000 177227077.3000 157335399.8000 165387242.3000 153820881.8000 153594273.5000 173370843.4000 146950556.4000 162633535.9000 163904423.4000 159446182.3000 betaine Betaine 2300247033 2440677858 2514257611 2544596867 891749179.2000 915259511.8000 937958604.1000 1039600420 1364301712 1371983924 1463155956 1467035362 757107543.7000 757600716.8000 699467933.9000 638335001.4000 C5-Carnitines 83391657.3300 86971883.7900 96797355.1700 96113741.6000 179195929.6000 187145034.4000 185003746.6000 189986898.7000 94812647.5000 95287306.5300 82645276.5300 93524121.8400 86345601.5100 84722366.6800 86158679.4400 81532369.7200 cAMP 3',5' cyclic AMP 1298867.4410 1481390.2090 1157529.9660 1327266.7790 3480957.6330 2961506.1610 3356741.4090 3421585.6920 1759482.9240 1667544.7370 1862314.2270 961437.7945 2638730.9940 2402734.7060 2319555.9140 2067110.4010 carnitine Carnitine 102022967.8000 92564834.8100 104198085.7000 96932933.4100 141447287.5000 155636862.8000 134353191.8000 145668116 108714975.3000 108157143.9000 105467778.6000 110134381.7000 142502940.7000 147468062.1000 144923458.7000 132449046.9000 CDP CDP 6524821.8440 6305164.2250 5613615.5230 6096827.4780 3833177.4310 3723946.8100 5340639.5780 3828621.2320 6062237.1200 5725443.0490 5556713.4180 6280521.5310 5970412.4560 5901835.8690 5774414.4130 6023876.3300 CDP-choline CDP-choline 9476030.7550 9613716.0090 9311145.5190 10127637.0900 697064.0403 525205.5157 606225.1916 670435.4050 552421.0464 797651.2308 1758678.7280 686361.7271 123807.1347 choline Choline 59160241.1700 55543502.9500 61383119.9300 58568202.5700 11106793.4100 9113114.4270 9050815.4300 159132183.2000 163695896.1000 151383814.5000 143136071.5000 78647907.6000 90823908.9000 82143045.3200 83860003.4300 cis-aconitate cis-Aconitic acid 47829261.3700 53667019.7600 55601557.6300 59583822.5500 47258893.8600 50581013.9300 47443220.6200 50322709.1900 44670651.6900 46397609.8600 42475397.4600 47531939.4700 41519258.1300 43228187.6500 42796897.7000 40763812.1500 citrate Citric acid 2548468410 2532988590 2494717576 2551030563 2221557928 2153827509 2284881266 2320425094 2357259452 2393105000 2129393149 2279093023 2253420280 2377895813 2334759359 2272300701 CMP CMP 1014735.7010 973795.4670 1052432.2610 1253022.3590 394862.2514 349617.9640 193427.4591 273675.9651 606432.0533 601819.8797 603912.7206 516647.6178 520077.1123 533871.7778 555271.1355 554684.8764 creatine Creatine 1494177531 1512333892 1332426888 1221430413 1134327735 1209132104 1137781361 943140535.4000 676143992.3000 620557154.1000 731805178.8000 643945898.5000 668382302.4000 675458730.4000 630881300.7000 726358799.3000 CTP CTP 51136751.9600 49307644.4200 54405179.4600 54682590.8900 42123546.4100 36277115.7800 39845374.9900 44465117.1800 46236764.9500 55407561.5700 49818996.4700 47355933.7300 47992811.3100 47276581.8500 49017792.9700 51090623.5000 cystathionine Cystathionine 72765829.1400 69645056.2100 76053563.6800 97742268.0200 189412623.1000 186375775.1000 181500099 210158472.2000 170681847.9000 153302376.1000 143035799.5000 161872944.2000 144026077.6000 145490243.9000 151718255.6000 150258059.9000 cysteic acid Cysteic acid 1299435.4620 1285149.8520 1378718.2760 1358962.6490 1535442.1550 1347304.0690 1249112.0200 1346684.1300 1131463.1180 1248507.0280 1096205.1920 1199851.1170 908493.0637 848822.5115 860756.3057 869676.4034 cystine Cystine 7258393.2500 7284685.4380 8364098.8300 6396711.6500 36829.2878 1864493.7160 3916346.1690 2708561.4650 4679185.9820 2487174.6040 3893781.7890 9124238.3450 1635148.7110 2686568.8940 2869016.5020 2198894.0280 cytidine Cytidine 6038922.7010 7777322.4800 7972835.4350 6361008.2430 1031750.7320 2442265.0450 1158654.3180 1121865.3640 3097936.7520 3698190.6390 4369846.8830 3382235.0050 1254793.8080 1269925.2090 1328719.0060 1351278.4350 dATP dATP 542588.9158 928337.4084 875302.3311 884010.1250 1020149.9910 873657.1700 844700.7360 1012110.9700 1660987.4320 1670071.5250 1757859.7560 2044082.0480 1364447.5280 1514364.3260 1803993.4760 1727397.2510 dCTP dCTP 1023483.2290 1003371.2150 1361321.4070 977308.9538 1037672.9960 1061579.0270 1062937.7300 1135300.5270 1804417.6110 2093346.4620 2218290.6850 2137059.2850 1663794.6620 1364619.4550 1448258.1910 1754428.7330 dihydroxyacetone phosphate Dihydroxyacetone phosphate 16919526.5400 16282008.1000 11835734.1100 11609550.1100 11788206.6200 16672348.9200 19215480.5200 14060655.8900 30447275.6300 19742007.3300 11868258.2300 11358460.6100 31601227.9500 33511735.5500 28819253.2500 29851440.0400 dUMP dUMP 1477358.4550 1516565.5120 1791956.8860 1884631.0090 19504993.6600 16604573.9700 15945130.7100 18757911.9100 erythrose-4-phosphate Erythrose 4-phosphate 680310.9830 671112.8452 592836.5714 415517.2123 720061.4684 657828.8412 652663.5052 597927.6658 782223.0491 720471.1176 742336.1496 630278.0523 883375.3615 749781.7078 939048.0176 850411.1556 F6P-G1P 72296643.5600 72759826.5800 90069294.4000 83763556.0700 163369755.4000 130568303 108090503.3000 136465044.1000 54715592.6200 68182144.3000 67691579.8000 50691985.3900 50083077.5300 49013858.2700 54491179.8800 51563475.8200 formyl-methionine N-Formylmethionine 7540879.5990 7508342.1530 8123692.2610 7630141.8540 8581829.4830 7138839.2930 8957630.4640 8782543.4380 9014385.3390 9820684.8090 8710630.1460 8242708.0610 11425759.7100 10893858.8800 11084384.9400 12065121.3500 Fructose-1_6-bisphosphate Fructose 1,6-bisphosphate 10222072.4100 10218802.9300 10939272.5400 11537272.2400 9328918.2660 8731653.8890 8893647.5050 10164720.5700 10237318.1800 9114255.0330 7423496.5740 8112091.4480 10381537.0100 10814077.6000 12409277.1900 11076583.2500 gamma.aminobutyric acid gamma-Aminobutyric acid 49882292.5500 48546883.2600 43406846.6700 49926549.3800 337223661 360252477 372473448.2000 359503889.1000 178345377.5000 166808810.2000 171312144.6000 144298270.8000 426677588.7000 455611703.4000 430993086.1000 429274317.1000 GAR GAR 93470167.6700 87171901.6100 96769481.8700 96338403.6300 137520690.6000 131045186.2000 134157506.8000 129240331.4000 72573557.3800 71124369.5200 64629401.2700 74287691.8900 36289195.3400 39978307.1200 38514946.3300 35970083.9400 GDP GDP 6912544.4370 6431587.0430 6298717.5180 6205110.9600 3971026.6380 3578280.1250 4430330.3440 4487728.4920 7665777.3370 7864006.6420 6767568.2090 7728610.6030 8029560.2840 8723355.8550 8811482.4020 8080668.2890 Glucose-6-phosphate Glucose 6-phosphate 44696796.2400 43661571.9300 44229176.2900 42520748.4600 54037177.2000 50144437.9200 47681368.8900 48115421.0800 48565071.1500 48660639.8300 51785162.5100 47606592.7800 56619212.5200 53714421.5200 55534060.1000 56168415.0700 glutamate Glutamic acid 1867922016 1796149369 1871136992 1937970848 1723202079 1816929197 1875022102 1764728200 1787486494 1682683019 1697529382 1810845404 1660369884 1545320184 1578452127 1588556040 glutamine Glutamine 8707996944 8538895523 8101225823 8995481288 8491667279 9098735538 9723234193 8962755837 10021855024 9106093482 9240381968 10694619407 10335553663 10020526793 10015851326 10470898919 glycerate Glyceric acid 165338312.2000 157563280.2000 134357156.3000 141649923 76418760.6000 84370181.6300 104163154.3000 93659899.6700 125320451.7000 100507498.1000 121139108.1000 164263767.4000 112252304.6000 121604141.1000 108553929.2000 110932758.8000 Glycerophosphocholine sn-Glycero-3-phosphocholine 6939573269 6599126848 6607306550 7220205083 1372636643 1351000491 1354414367 1474350899 16709219899 16282418547 15251493908 15152505410 8679474873 9170988956 9599252704 8780213656 glycine Glycine 14019405.8400 14938038.1500 15731113.0100 20205727.1500 39132996.5200 35911598.1500 40990881.6400 36358540.8000 40278154.0900 37388162.6200 38348882.8300 39325011.8400 33337436.9900 31573201.3900 37865559.1600 35718225.8700 GMP GMP 1992833.4060 1949426.0030 1927003.2840 2300404.8720 834765.7627 802269.7425 317608.5659 690424.2701 1491092.8680 1507469.1990 1274987.8340 1446644.6020 1410765.2850 1486337.3310 1668410.2680 1508530.8430 GSH Glutathione 6524769099 6666487468 6256661213 6218562828 4823383611 5183199115 5776374111 5381934780 6110802980 6355439531 6444886652 6192773747 5046348631 5031654116 5222135132 5495411488 GSSG Oxidized glutathione 136557963.1000 121547241.9000 99999038.4200 102871643.7000 102160367.3000 64097282.2400 53771721.9900 86579832.2100 104519022.9000 83403501.3000 112844122.3000 117074444.2000 102932749.8000 100836353.7000 83813271.3200 87776849.1200 GTP GTP 24767619.5200 23614678.9400 25113071.5600 26316748.2200 20491775.8600 17529133.2200 20583429.1100 22088321.5400 32122666.2200 37026912.3700 32354438.3000 32686786.5600 34358879.3700 37078961.6500 36771982.8600 37104521.2400 histidine Histidine 1516917103 1464665186 1501613497 1185469748 2184901958 2215598425 2408371634 2291781588 1140187859 1029813479 1075494683 1238090931 1683212604 1650130550 1588948011 1747357166 hydroxyproline-gammaALA 78578725.5600 77066418.9200 83433350.8800 93644401.3400 128406096.5000 128256392 128999734.5000 117404675 113448420.9000 114930508.5000 108087482.2000 109039598.4000 133684332.2000 117957904.8000 124103018.5000 134428082 hypoxanthine Hypoxanthine 1138216.0390 1922407.0870 759285.8097 1079647.2380 932378.0564 3303563.9660 1846659.5540 366106.7251 1412569.4430 1501766.2570 2663113.8980 1085633.7110 2240862.0160 2090218.5330 1579133.0620 2073895.1710 IMP IMP 1976307.1070 1773622.6080 1908947.0740 2124037.7100 3650359.6970 3728964.2600 3875841.1190 4288578.7590 2200736.0250 1934249.8340 1656143.6950 1705595.7130 3062402.8180 3218391.1590 3057582.8190 2567127.9500 isoleucine Isoleucine 1066019937 1033257731 1051657014 1102962403 1531504648 1465212155 1496942098 1517048335 1386171803 1335669895 1313959754 1333430367 1619007152 1515188260 1628233348 1522130920 Itaconic Acid Itaconic acid 16303041.1700 12469872.5400 11766197.4400 9815953.6240 5551027.1940 5956398.9040 7461694.3170 7343804.5920 14074473.3600 8673727.2600 10776769.4500 10856255.2100 8062558.6290 8495791.6090 7612931.3130 7348351.5540 kynurenine Kynurenine 1752964.8820 1952094.8730 2328095.4130 2112583.9550 2926305.3810 2686905.8600 3266016.8410 3298024.4810 2308038.3740 2733597.3700 2800265.8880 2847851.6730 3202497.6670 2988783.5110 3088498.2390 3188037.4930 lactic acid Lactic acid 104592332.9000 108216567.4000 118254376 137993020.9000 131543298.1000 129120056 113844838.6000 111983972.3000 374974588.3000 365354929.7000 265204812.9000 275840562 364905735.8000 392339564.2000 419104955.6000 406118880 leucine Leucine 1043114194 1010426842 1076795983 1145850934 1517948053 1513331691 1547856000 1519816226 1374480240 1364513133 1318613029 1308117677 1653504613 1560530261 1683906128 1641323874 lysine Lysine 82377694.3900 94763205.1600 78763395.3800 104409850 119875556.5000 120779662 129556392 138558880.3000 91879170.0400 74969037.8700 52729659.3400 81396939.8700 96213907.9200 88179739.0600 101469274.3000 93786385.6300 mannose Mannose 15654715.4100 16837315.8200 15486601.1700 18517107.6800 20526524.2100 22068217.8000 19454112.0300 22092359.2600 12857721.7400 20514767.0500 15293070.8000 15454362.0500 8560487.3290 9819784.4500 12912273.1100 10329659.2000 methionine Methionine 481754340.2000 473802657.9000 483441834.1000 518260632.7000 760258673 809259861.1000 787910885.2000 769475703.3000 687660602.8000 625595046.7000 613484937.7000 614911392.2000 806474510.9000 762006742 809893497.1000 832039128.4000 Methionine sulfoxide Methionine sulfoxide 136603769.3000 127706182 105855308.4000 101099734.8000 148513439 112523568.2000 134946182.8000 167717215.6000 121073277.1000 114980172.3000 118028980.5000 136181139.8000 132032327 140435080.2000 122798822.3000 130996113.5000 methylthioadenosine Methylthioadenosine 73518267.5900 77065541.4800 84431909.7800 77012057.9900 98798768.1500 98812057.3200 93269880.7000 105208552.5000 108754399.1000 130093127.4000 114161107.3000 104283482.1000 116844923.5000 115251157.6000 128663174.9000 115573202.7000 Mevalonate Mevalonic acid 50420053.9100 46900385.1900 48741612.7600 51567342.8400 48797905.9400 53531749.1100 56520931.8300 53017902.0700 60131931.1400 56117588.9200 53639763.0900 62169113.4600 60799911.5600 56031451.5200 58323034.8800 60658784.5100 myo.inositol Myo-inositol 1674310919 1640897692 1732114438 2238414799 2477315783 2468343953 2588755921 2409054010 1555637905 1476341422 1580920955 1558998580 1211169429 1068945854 1159609742 1137346588 N-acetylglutamate N-Acetylglutamic acid 1838736.0960 1811973.9010 1698017.1800 1669535.0670 1186146.4500 1145745.6570 1218973.2770 1298591.4560 4849241.5670 4886097.1690 4297093.3710 4606056.3900 5024662.3060 4498377.5230 4359899.4610 4983924.0170 N-acetylphenylalanine N-Acetylphenylalanine 1171571.9970 1116725.6510 1187680.7990 945383.0976 1273469.8710 1002576.8830 1087731.9380 1215921.7470 1792392.5270 2224826.8900 1967994.7970 1732473.5360 1826805.8780 1979028.3520 1869811.6150 1845964.3030 NAD+ NAD 305350221.7000 276798309 289549829.7000 296703000.4000 267238764.5000 260540825.7000 287915284.4000 284796564.1000 340285600.7000 352038972.1000 340399723.5000 356354702.1000 350898290.5000 347869212.5000 354037846.1000 346548682.6000 NADP+ NADP 6818953.2550 6856712.1750 6513194.9420 7142123.4500 9526265.5480 6223905.5700 12763547.2500 11567057.0300 6613842.1080 12580000.6400 5166107.7250 5229576.2070 5825532.4380 11033849.2100 12456530.4900 6935094.9950 niacinamide Niacinamide 151093843.8000 134663095.3000 143329860.8000 112738153.2000 155668549.1000 122157969 126511738.8000 133026312.6000 165387600.5000 174116341.3000 169410901.3000 161117481.2000 170918778.9000 167178605.1000 149005759.6000 163559205.1000 O-phosphoethanolamine Phosphoethanolamine 98118473.1300 98331272.9800 97261514.3900 92803524.1800 20269478.1700 18621296.6000 19888302.3300 25360387.2700 12932115.5900 16624355.9000 21076721.9000 16613847.4100 1532396.7150 1577913.5050 1627445.3880 1540866.8550 ornithine Ornithine 21615575.7500 24172457.4000 17794586.1500 25823063.4900 20808764.4500 21880909.2200 22055343.7000 19515531.7400 28230031.1300 19618474.8000 19532014.2600 27663515.2300 27917000.5800 28173525.0600 29897398.6000 27605410.6200 orotate Orotic acid 588698.5121 784638.2877 714879.2378 1328775.5770 1077890.3790 959404.1108 857825.8616 787781.6468 2897430.6930 3828879.4590 2588968.0370 3635663.8710 5136530.1770 6186342.3630 5100106.3770 4359708.0680 palmitate Palmitic acid 663629330 426834792.6000 417140251.6000 298248276.3000 376297360.8000 503173501.4000 606456954 254311515.3000 1074358839 910445065.5000 818683355.2000 1386802834 1023609076 1349515806 652493170.5000 1147895323 Pantothenate Pantothenic acid 1132885402 1167330145 1196601733 1066153591 986637338 945243155.1000 985580124.7000 988357778.8000 1439678128 1459594024 1449243652 1411317105 1254523500 1270825243 1200286414 1240431326 phenylalanine Phenylalanine 124135281.3000 119214781.8000 129609838.8000 134934531.7000 194057341.9000 185195315.1000 188355282.4000 191284313 154676921.4000 167023372.5000 152556711.3000 161142067 198460376.4000 185386091.7000 199975266.8000 209182756.9000 phosphocholine Choline phosphate 9645521635 9652952564 9400094422 9924321396 11281820546 12128688707 12110363605 12611707854 23122216108 23329889573 21047277383 22825875603 31584155517 31437069797 30721815561 31654153221 phosphocreatine Phosphocreatine 38574021.1100 37976919.3400 39388048.2100 39671102.2000 19121197.4300 15186635.5500 20360110.8400 21353400.4200 16068876.9900 16147946.8500 18079236.5600 18355383.6400 7803553.2120 6631135.6840 8580458.4320 7924532.0940 phosphoenolpyruvate Phosphoenolpyruvic acid 24495418.7200 24785751.4200 27102656.1600 34865168.1400 26785626.9200 24147832.3400 22635588.2100 23545415.5800 30776622.5000 31597319.0600 24629963.9700 27129563.7500 21563250.1300 22418566.5700 22783173.6000 22565097.6900 phosphoserine Phosphoserine 2511325.7350 2369536.5380 2549558.8890 3360663.2780 4776847.7910 5665176.7580 5829414.8200 5607987.9870 2879057.8810 2797419.0800 2019471.0720 2979165.7020 1665950.6500 1487751.2100 1676664.6450 1754169.2890 proline Proline 9167585475 9214115893 9222326654 10131007796 11353261651 12194721233 12534782990 12108781992 12450757291 10886899685 10834024317 12654503689 13872633480 13436002245 13436437299 13256150685 propionylcarnitine CAR 3:0 14453496.4400 14446417.7100 14679768.7200 13374936.0800 23041181.7500 23200104.4500 23254017.1200 22046514.8000 18844366.6800 19914902.3400 17465385.6500 18847832.6500 26543782.2100 23505626.6900 19786252.7500 23749352.3200 Pyridoxine Pyridoxine 221257463.8000 230532361.3000 228544938.8000 222264863 232613327.2000 227842669.7000 233047584.7000 248896548.4000 223078967.6000 228103433 212232614.7000 243886883.9000 211417134.9000 212985679.6000 225801497.3000 202522459.7000 pyruvate Pyruvic acid 3608746.6100 3905465.8030 5137035.7140 3739874.8980 3118712.2800 4537000.6700 4471274.4610 3180796.7590 8269213.5250 5843599.5310 5465798.9210 9223617.6640 5474778.7450 6266918.1910 7169543.0340 6734198.6240 Ribose-1-phosphate Ribose 1-phosphate 9443501.2370 9331495.1150 10625254.7100 9440407.3390 16625820.5800 14870442.7900 15314360.1400 15856179.3700 2225214.4860 2534567.7770 2276476.4920 1974722.6470 1585230.7410 1814503.9630 1766297.6750 1626739.9020 Ribose-Ribulose-5-phosphate-3Me-Lys 9799364.7020 10959339.4100 9286827.1560 8639581.0970 10339674.3900 11902094.0200 10931497.7100 12394476.2100 7995479.1090 5621652.1500 4570789.9690 5423613.0140 10259032.1400 11767269.4400 11001125.7700 13120646.3500 S-Adenosyl-L-Homocysteine S-Adenosylhomocysteine 13676058.8100 13235977.3400 12331846.5000 11473246.0900 12864882.1100 10621923.8200 12970334.2400 13404402.6100 16428816.7400 16154706.4500 14439744.4500 14454060.0600 13250110.8900 15844144.9600 14774664.9900 14147436.3900 S-Adenosyl-L-methionine S-Adenosylmethionine 561868662 532108225.2000 493355900 534683238.6000 377536623.1000 400249211.9000 455641430.5000 407946472.2000 515029902.7000 495993960.8000 527851069.3000 572143127.6000 434195505.6000 448544271.9000 434949098.5000 456466958.9000 sarcosine Sarcosine 32065683.1200 33887443.0400 31832734.4600 24249304.8800 32608511.8800 44290417.8400 36267947.9100 28850175.2200 17172984.0900 15489277.7800 20498152.9400 18873244.9100 22656046.1400 22204446.4000 20890757.2700 24860754.3900 Sedoheptulose-7-phosphate Sedoheptulose 7-phosphate 15748261.6500 16299778.5500 22297047.8400 19369395.2700 35163286.4600 27540790.4700 20071083.1000 27537434.5500 9725038.4370 11031180.4700 11743785.6800 8439029.4650 10155167.1500 9795762.7670 10053900.3600 10484169.3400 serine Serine 74353318.8100 72986967.1000 74721181.3200 83886745.3200 102068348.7000 103207264.1000 103018208.5000 99069965.5600 90430100.3400 84379174.4400 81373912.2000 88214988.0700 92379305.5700 85213934.1400 93684400.8900 92372244.2400 sorbitol Sorbitol 1276498.6370 1063794.0500 1513047.1240 1127945.4430 2685807.1950 2449965.7790 1684152.5040 2082794.0990 524875.5206 1070240.3860 596848.9610 272240.4875 1113727.9270 1309438.4430 1347727.9190 1135749.6070 succinate Succinic acid 23875833.5800 22939040.9300 15743627.7900 14865243.0400 15402603.7500 10631391.7900 13146166.5700 12595032.8200 15836562.1900 22213255.2200 20996769.5500 20460026.7200 25107308.7200 23441147.4900 22205242.3600 23018463.5300 succinyl-CoA Succinyl-CoA 1722196.8540 2088783.9350 2208600.1530 2250764.5270 2672136.9620 2889737.1720 2524108.2520 2649038.2210 2355321.5550 2298677.1210 2589265.5880 2343766.2330 2178850.0090 1688272.4710 2373148.3380 2000814.3380 taurine Taurine 72680610.9700 71146855.0800 78984697.9900 73374271.4000 75717228.9400 105097931.8000 80482202.8000 69526162.3800 37805741.8700 43861432.3600 47114168.7900 42819295.0600 32217514.1700 30316346.4100 30302070.5500 36060476.1400 threonine Threonine 332301994.2000 296662675.1000 306296684.7000 348987922.3000 426118097.7000 439903176.1000 441739078.9000 446066743 347845728.6000 347325064.9000 332536525.4000 367278969.1000 374497524.7000 378443728.3000 422630498.3000 376759294.1000 trans-urocanate Urocanic acid 41314731.3200 43092055.3900 47065044.8000 18426264.2600 37341562.9300 41083272.9400 34371706.2500 18736838.8000 27569698.7100 25663750.8700 120906807.9000 35475454.6500 39636399.5200 35409888.5900 32463995.2800 30621819.6700 tryptophan Tryptophan 122335005.9000 117986232.5000 122992047.8000 125251990 187625039.6000 188722464.5000 183055940.3000 188238436.3000 172541765.1000 156721529 153744192.8000 156649049.1000 200573870.5000 184462562.8000 200086280.2000 205143799.4000 tyrosine Tyrosine 416644751.4000 402460101.4000 406029611.8000 385949844.2000 443351472.3000 458485254.5000 492290026.9000 490248535.1000 455942869 457129576.3000 450411670.2000 472968748.6000 523508577.5000 502264775.8000 545124790.2000 533566332.5000 UDP UDP 24623182.3100 25555509.8400 23622369.0100 25911623.7200 29889687.0900 23664962.3200 41264105.6800 28988440.9200 24677755.8700 27174381.2000 22600835.2600 22978587.5300 24909063.3100 25820610.2400 25519276.0400 27169353.1300 UDP-GlcNAc UDP-N-acetylglucosamine 94912086.5900 95492290.1500 102436471.2000 99205753.2700 59567668.4000 62173649.6700 64387722.6300 63519131.6200 97657137.3800 97107214.8000 93855753.0800 102021782.7000 78746618.7200 68273208.8100 78560458.0400 76741093.1500 UMP UMP 4553113.8370 4448554.2730 4820909.6900 5552148.0400 2885853.6390 2928569.8810 2402040.4360 3046006.1680 3458851.3830 3688421.8660 3333124.4410 3461519.5560 3210004.6850 2938316.7880 3123804.6640 3553786.5820 UTP UTP 270979913.9000 268545957.2000 296653954.1000 298341198.5000 327711881.9000 270390830.1000 296528723.4000 325887873.7000 208464452.1000 243809179.6000 214690422.4000 197919405.2000 233297471 218758075.3000 225533077 235824818.7000 valine Valine 313021043.4000 304339553.5000 301095291.8000 314042800.1000 436398371 460134690 436081954.1000 436995204.5000 389409950 361117514.6000 353287373.5000 355952378.6000 446678393.4000 436783102.1000 445453052.9000 442426989.7000