Metabolite_name RefMet_name DS1-123-005 DS1-123-032 DS1-123-035 DS1-123-046 DS1-123-057 DS1-123-070 DS1-123-072 DS1-123-094 DS1-123-100 DS1-123-103 DS1-123-125 DS1-123-134 DS1-123-139 DS1-123-146 DS1-123-027 DS1-123-031 DS1-123-058 DS1-123-063 DS1-123-073 DS1-123-093 DS1-123-111 DS1-123-124 DS1-123-136 DS1-123-148 DS1-123-011 DS1-123-018 DS1-123-037 DS1-123-043 DS1-123-080 DS1-123-083 DS1-123-105 DS1-123-127 DS1-123-007 DS1-123-021 DS1-123-028 DS1-123-042 DS1-123-050 DS1-123-071 DS1-123-087 DS1-123-102 DS1-123-106 DS1-123-116 DS1-123-117 DS1-123-123 DS1-123-131 DS1-123-133 DS1-123-145 DS1-123-001 DS1-123-003 DS1-123-014 DS1-123-015 DS1-123-025 DS1-123-039 DS1-123-051 DS1-123-076 DS1-123-081 DS1-123-085 DS1-123-099 DS1-123-109 DS1-123-114 DS1-123-130 DS1-123-142 Factors - TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU1 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU12 TimeGroup:FU6 TimeGroup:FU6 TimeGroup:FU6 TimeGroup:FU6 TimeGroup:FU6 TimeGroup:FU6 TimeGroup:FU6 TimeGroup:FU6 TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:REND TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START TimeGroup:START 10-Formyltetrahydrofolate N10-Formyl-THF 27079.8200 15359.5100 1-3-Bisphosphoglycerate 3-Phospho-D-glyceroyl dihydrogen phosphate 41188.3800 26280.6300 77488.1100 32262.2100 60685.7300 55923.4500 57703.4200 48842.8800 46946.1800 84351.2100 22398.2200 67113.5700 79299.9500 25059.9700 39042.5000 19434.0800 46662.8000 18376.3400 51091.1200 27706.7400 45018.6500 24500.5300 27897.2900 45320.3900 42255.0800 22708.4500 42976.1300 36602.7400 23698.1600 25146.6400 68660.1300 29677.9900 35638.8200 28102.2600 21713.8000 46945.3400 61825.1900 66964.1000 28084.2100 36992.2000 58355.1900 31824.3400 47920.4500 63300.8900 20107.3500 29660.8300 49752.4600 44859.9000 35739.6400 32323.2700 19960.9700 33584.3000 51806.8200 50759.2300 37028.1400 22609.1500 44770.8400 66547 19944.1700 21387.1300 20599.0300 51652.8300 2^_3^-Cyclic CMP 2',3' cyclic CMP 15286.9100 57434.8800 21745.9000 87088.1200 26463.7100 78379.3400 54099.9200 69100.8100 86994.2200 46528.3600 62725.9500 60120.8100 104940.1000 67131.7400 115160.2900 49068.0100 62711.1400 87250.2100 98912.5600 80467.3400 82451.3800 84298.7200 122212.6600 96600.9300 47683.1600 26847.8300 58782.5700 88703.9000 15179.0500 78224.5100 67968.2200 49653.0800 84217.9600 115301.9600 22592.9400 84240.5600 21855.8800 24198.7300 12344.1800 94762.0600 46771.4600 116901.5900 23407.2600 65884.0900 27222.2200 47846.9500 48658.4500 73805.2100 80460.5100 14490.4100 93114.0200 21779.6800 17370.9900 54328.9900 29706.7100 93180.1800 38287.5800 161963.4800 30905.9200 61477.1400 2/3-Phospho-D-glycerate 2-Phosphoglyceric acid 1418.6100 869.9800 2301.3900 3910.0200 14675.3600 3430.1400 1540.8300 1287.4700 9645.9900 1357.0100 1193.1800 1738.1100 1125.5600 1523.4200 1417.2500 4407.7400 2027.8000 1108.5200 18757.1000 1050.0100 1162.2600 14529.7100 1431.0800 3320.6400 1030.4300 16303.2300 6806.5700 1380.9300 1767.8900 1270.6800 1153.9500 1417.4700 4719.1600 4983.8300 12700.6200 2-Aminomuconate 2-Aminomuconic acid 26658.1500 22155.7600 17906.8400 38019.6200 76866.8200 125879.4500 14137.9800 23450.3400 214796.5800 60699.8400 61027.3800 126241.0200 20160.8400 28808.5100 31874.9500 63949.0300 66976.8500 3190.0700 122270.6900 87215.2400 56664.0100 56531 60992.2500 25821.1400 47567.0600 34219.7800 19672.3800 79327.1100 12379.6200 45124.2900 55507.0600 51429.6400 26532.3000 33261.5100 57789.5400 155936.9200 34640.1400 147112.3900 42834.3100 110904.5000 45161.1400 40136.7400 116173.8500 4603.6800 39822.4800 36995.8500 2682.7100 69535.8100 78689.3900 2800.3000 106818.7600 114594.3800 78814.9600 49978.5700 164360.8300 34061.3700 30772.6800 2-Hydroxyglutarate 2-Hydroxyglutaric acid 657814.6900 925703.2500 654692.8100 743009.5000 650305.4400 773191.6900 686475.4400 894533.7500 732410.8100 680054.5600 741198 492113.0900 571097.4400 717248.1900 885164.1900 750570 787239.8100 655848.2500 803852.1900 667299.5600 760203.3100 865640.0600 756332.7500 536023 937382.1900 478990.6600 745338.1900 543671.4400 815380.1900 736813 900096.5600 818686.6900 714445.9400 783752.7500 804674.7500 608967.9400 633521.4400 628607.9400 586633.5600 712659.8100 580941.9400 583953.1900 728781.3100 557647.9400 836904.5600 714597.9400 664104.3100 614282.1900 915193.1900 806288.1900 689269.5600 796102.2500 714828 592404.0600 651903 721095.5600 553082.5000 785087.0600 677624.1900 683803.6900 648684.8100 816724.9400 2-Oxoglutarate 2-Oxoglutaric acid 123601.3400 151627.7300 188729.9200 125014.9000 132817.4200 187749.3000 77872.3500 238589.8100 147210.4400 156204.7700 120531.7300 154437.7000 151808.5600 138508.5200 205746.7500 133016.8600 183238.3800 163673.3000 197401.6200 121718.6600 201824.3800 181093.2000 198731.8600 202965.7500 165981.8800 124897.9700 231803.0800 139872.0200 115861.8800 198670.0600 206820.3000 204842.9400 137115.6700 338433.0900 261909.1700 122414.5600 244159 9384279 205636.2500 191138.7300 100119.3400 144087.4200 158420.4500 285014.7800 166656.6400 125871.7700 227908.6900 127605.2800 180919.0600 263768.6200 175449.0800 175998.9800 133690.3600 135812.0800 212751.6900 208318.3600 113785.2300 207930.7500 106353.6300 142565.0600 145749 203889.8900 3D-(3-5/4)-Trihydroxycyclohexane-1-2-dione 455930.6600 485915.4700 262503.8400 702587.9400 464122.5900 286278.5300 396828.1600 462370.4100 409416.3400 214717.0500 531865.3800 254052.4500 181264.5500 271654.9100 323294.9400 285971.8100 311875.2500 344849.0300 403767.6600 216142.8800 482549.6200 474830.0900 270394.3400 352486.4100 212385.9500 504853.5000 393590.4100 330428.4700 389591.3800 386669.5900 285872.3800 305763.7200 382819.9100 285702.5000 397701.0900 461983.8800 438918.2200 2931646.7500 216203.7700 365430.8400 333088.7500 231264.0800 371985.2200 315954.1900 319854.7800 402874.2500 352831.3800 214034.0200 333091.6200 367877.8800 348417.8100 292985.8400 335624.5300 284327.7200 346127.5300 230551.3000 290909.1900 398166.2800 302140 267851.4700 426664.4700 410325.5900 3-Methyldioxyindole 3-Methyldioxyindole 389498.5000 13893.5100 87791.5000 246635.2000 532687.6200 15016.4100 25899.5600 53559.7900 549764 459244.5000 11020.8800 23772.6600 17386.2400 30299.9500 479122.5000 26830.1200 348509.2200 697662.5600 99052.4400 905626.7500 1514187.3800 533854.1900 14193.6800 42937.8000 45767.5800 13931.5200 59192.9400 22822.7200 859529.2500 43150.4800 310959.6600 9735.9900 14705.9200 35707.0800 230750.7700 616794.9400 100666.6300 113783.5000 7553.6200 14437.9500 776086.5000 374256.8400 62560.6800 24186.0100 627925.5000 21943.7000 14769.0200 348277.4700 20286.7400 117835.8800 48605.9900 425884.5900 516814.9700 532871.2500 60246 16424.5000 14987.2100 721567.9400 68939.7400 1722267.1200 9952.8900 9426.6600 3-Phospho-D-glyceroyl phosphate 3-Phospho-D-glyceroyl dihydrogen phosphate 41188.3800 26280.6300 77488.1100 32262.2100 60685.7300 55923.4500 57703.4200 48842.8800 46946.1800 84351.2100 22398.2200 67113.5700 79299.9500 25059.9700 39042.5000 19434.0800 46662.8000 18376.3400 51091.1200 27706.7400 45018.6500 24500.5300 27897.2900 45320.3900 42255.0800 22708.4500 42976.1300 36602.7400 23698.1600 25146.6400 68660.1300 29677.9900 35638.8200 28102.2600 21713.8000 46945.3400 61825.1900 66964.1000 28084.2100 36992.2000 58355.1900 31824.3400 47920.4500 63300.8900 20107.3500 29660.8300 49752.4600 44859.9000 35739.6400 32323.2700 19960.9700 33584.3000 51806.8200 50759.2300 37028.1400 22609.1500 44770.8400 66547 19944.1700 21387.1300 20599.0300 51652.8300 3-Sulfino-L-alanine 3-Sulfino-alanine 7049.6300 1326.0200 1329.4000 2208.6200 1101.1700 3-Sulfocatechol 3-Sulfocatechol 12190.7200 16537.7700 95277.5700 46022.7800 12981.0400 15839.6300 90959.9300 30136.6500 77522.7200 86771.9600 49676.6900 111522.1900 20994.8400 32761.6900 16008.6600 60251.8600 53398.4500 11677.8600 35090.8100 58861.8100 58353.2500 17434.5900 5-Hydroxyindoleacetate 5-Hydroxyindoleacetic acid 51994.6600 77726.4900 5544.6400 96733.0400 57451.7400 6636.5000 46432.5800 24912.2800 75879.2900 99925.8200 6459.2300 5590.9600 94326.7700 46510.4300 68991.9800 41841.2500 22020.5600 27820.2700 16246.9500 93003.5600 57402.1800 10129.8900 68184.6500 8194.0800 53396.8200 60677.7700 49596.8000 85100.8900 85046.6800 56185.3800 6310.8200 73365.8000 6970.0200 16830.5800 6459 60267.3600 47525.9500 8804.3500 79186.1800 8335.7000 81971.2000 86807.0900 6715.5200 22162.5800 75200.3200 26987.1700 74788.9500 20942.5300 5566.1900 76374.0400 50430.4200 69369.4500 30086.4200 48670.3500 37361.1800 61490.9600 76038.9900 5-Hydroxyisourate 5-Hydroxyisouric acid 33755.0100 13502.9900 17164.2900 19673.4100 28753.5800 19308.6700 13372.2900 37158.5300 127183.5600 57770.1600 32284.4900 8142.3100 156775.4800 4313.6100 70482.7000 41624.8600 7013.5300 3670.0200 3833.7000 2569.8300 2358.4000 79230.3400 13503.4100 114018.8200 7120.0400 32311.1300 95853.4000 5780.4700 86514.3200 4843.7600 54378.7500 1337.4900 12447.5500 13361.9900 132301.3100 6130.0500 99800.7600 21580.6900 3097.4300 31909.7500 42292.3600 31614.3300 5408.4200 35715.9800 8673.1200 5-L-Glutamyl-taurine 5-L-Glutamyl-taurine 4959.3100 16985.4200 51881.8100 19103.4400 13432.1400 21963.7300 15992.4100 19460.4100 10646.2200 23885.6100 18395.2700 3327.3600 44052.3400 15634.6700 3412.9000 40305.9500 17995.7800 15545.9600 18725.8000 14499.8300 20959.0800 24922.4500 16974.1000 41800.9500 48044.7300 17792.0900 21117.9200 33327.7300 27179.8200 33633.5700 1389.1800 37087.9000 33380.4600 27064.2000 18875.1200 17011.3100 12111.5500 18159.2400 10752.6900 19032.6500 4770.4700 21545.1400 19350.6600 2153.5900 23124.5400 17648.5500 35316.5300 12990.2300 20909.9800 19856.7100 17084.8500 18521.4300 16800.1100 17635.5000 6-Hydroxykynurenic acid 6-Hydroxykynurenic acid 34590.3300 103876.6800 102352.4100 112067.6900 64237.3900 84681.2700 75892.5800 90488.3400 65338.3300 84995 56319.2000 30413.2800 71949.4700 106922.0300 129254.7700 169670.8000 110093.8000 109755.6000 76478.8800 100042.5600 76471.8800 102138.8200 83216 96242.9000 106510.1500 82896.4900 50391.5700 95810.0400 103485.8800 93886.9100 132468.3800 108866.3800 124257.8200 121136.6200 124666.9600 94333.2300 112143.9400 47061.7800 65453.0500 55204.6400 42778.6100 76464.4400 55201.2600 23944.7100 66044.0100 44217.8300 142118.7500 81790.4000 155861.2700 147853.4500 45847.1900 115111.3100 147419.7700 73365.3100 52513.6700 49643.8500 38251.1700 64553.8100 53957.0500 29849.3500 67095.0700 130852.6600 6-Phospho-D-gluconate 6-Phosphogluconic acid 30308.3200 31019.1700 13692.7800 72373.3000 195267.1200 14245.1500 14438.6900 18531.6200 39369.3700 24635.6300 21487.9000 27893.6700 53236.9200 16460.6500 17404.7800 17147.7100 17045.3100 20074.5700 99425.7100 31381.6200 17201.0400 29974.0100 33490.1100 14750.7400 119799.4000 34678.2000 16007.5400 32229.5800 32179.0900 21243.9300 36917.8300 92372.7900 61700.3600 61733.7800 71926.7100 36320.3300 18666.5000 19538.8300 35092.6800 71670.6800 63310.9900 Adenine Adenine 121126.0300 121619.6600 47925.6200 141383.6700 96296.4000 88831.9100 84874.6100 107286.7900 65319.0600 119854.3400 108093.1200 79495.7300 125501.1200 100325.8800 119020.4100 87309.6200 109204.7600 102284.7100 153345.8900 133672.5600 152187.0200 145340.1700 74524.8000 71549.7400 55832.6100 100722.5300 125913.8400 77069.2300 167643.2000 127069.4100 68615.0200 147938.7300 67600.8300 87386.8800 110467.2100 65117.6600 82011.5500 68308.5900 68879.8000 99351.9800 104904.0900 137972.2800 55876.1400 105593.6900 78158.0500 76952.3200 96274.4300 113121.8800 109068.5300 91657.0400 114161.5900 38752.3800 140872.0200 136566.5600 132435.2000 67540.4700 59035.5400 93634.9600 100289.6600 89862.1600 116560.9800 Argininosuccinate Argininosuccinic acid 88821.3200 67592.2800 79061.6000 51378.1400 57343.3200 53231.3800 74039.7700 102936.4100 39495.2300 21736.2200 39241.7900 42728.0100 53684.9100 61800.6100 111758.9700 111667.4500 45245 36730.7200 121122.1300 16573.3100 74621.5800 87091.1900 62589.6400 65968.7800 67640.9500 79219.2900 40450.2400 69638.2400 28469.6100 82887.2100 69906.9600 53903.0500 60469.8200 82434.4100 75442.9700 53590.0300 42158 62431.4100 85537.7900 63604.2700 18125.2000 88675.1600 22251.3500 63078.0200 74405.9000 66055.0400 48072.8600 77225.8200 58802.2600 62196.8200 41773.8800 118273.5900 73648.3400 44187.3600 55226.4200 25029.1300 42246.4400 61322.3400 58345.7400 50434.1700 36958.8600 67178.3600 Ascorbate Vitamin C 5632979.5000 47745268 88859936 15350851 36613628 125595800 31575888 70287368 46041228 39531740 21348436 90173544 87287192 19212678 14468936 5621902.5000 68058552 53241632 85412304 28145338 83629672 35885116 58480724 110171944 19120962 20680384 40047152 6893130.5000 49969136 42340216 55899184 119079096 28678874 90086872 34253800 64186772 44790252 22641514 117530272 65117568 30250960 108555080 23791432 66323012 25647658 29364070 113710888 25523968 10651027 81938816 36690292 38740292 104783928 23441754 56819052 44700732 62758844 108314072 54402932 25148022 71073224 29706304 ATP ATP 44670.2400 20659.0700 51025.4200 34312.8500 30820.1500 45887.9500 37160.4600 58292.1900 30202.7500 44967.6800 36926.5400 68855.9700 24842.3600 42696.2500 115614.5600 30598.0200 42312.5200 56169.6700 84223.5900 25027.8500 21433.0100 48894.6800 26386.6400 102804.9700 50231 41029.8400 69740.8800 30900.3500 25984.3100 98860.0900 49705.6600 62767.6400 22823.4500 40120.3900 43035.8100 28365.9000 114366.0200 42534.8900 22245.7400 40915.3000 21655.1700 81454.5900 54966.2500 32114.0300 37325.5500 48227.8900 28215.0500 41393.9300 51923.2100 51614.8100 33685.9500 16184.4600 44324.9800 40811.2100 40626.8400 67880.5400 40202 28119.5700 25683.9200 34481.5100 Carnosine Carnosine 16761.2200 20119.1500 29554.0200 83287.9500 22937.5800 19887.3700 59073.9500 16551.6000 15656.0800 41661.8000 18583.6700 40974.5200 21134.0900 30519.9100 49462.1200 22503.9400 23876.8000 45459.1900 71986.8800 21897.8100 17191.3300 17575.3600 23174.3400 32238.5300 28659.6200 45045.3100 13807.5300 25758.3700 75952.7700 63929.0200 59486.6100 49169.7900 14666.3300 37939.3200 17472.8000 22066.9500 63930.6900 48445.6600 16154.7000 15490.0700 52207.5900 72532.7800 27744.8300 19291.6800 48544.8400 22544.9300 62785.9200 18394.6000 21769.6800 15175.3900 30026.9600 46556.0500 17699.7900 Citrate Citric acid 277625184 231282944 215870000 152952256 165128704 239253376 232728384 203374800 199089392 328622976 188056896 167951696 203510736 226230272 312728096 269656800 225982464 152243472 196246704 259437232 236666688 162163056 258309248 214289664 401303040 237233104 149694592 161047392 272745728 174363296 289419264 255083952 253799936 218007872 242913552 134502160 281593472 71508008 221560960 170273456 252500784 198658736 207820336 164527568 159748752 182007808 214182144 263678480 309350304 329652736 138879216 238093840 186574384 121898696 169679952 279418720 173288704 275224224 201216512 353493120 193267280 207903616 CTP CTP 16940 28225.1500 19854.6300 20320.3000 27587.5300 5798.5600 16889.4500 7143.2400 16997.1900 15727 47996.7100 17326.3100 31627.9600 21801.5400 23040.9500 1663.8500 15110.3100 26797.0200 14174.6500 11725.9100 37330.4900 18339.9000 9984.7300 36724.0400 16956.0400 32964.1200 15993.6500 24558.7200 36050.4500 13277.6200 15044.8600 13967.5500 18734.9400 19123.8500 17149.1000 18200.8000 33509.9600 21867.3300 12573.3300 33488.7000 20216.6200 19119.7700 38665.2200 21745.0700 15203.4800 4769.9500 27540.5800 62175.0800 8422.9600 29880.1500 31238.9000 19218.8500 18594.4300 14375.3800 22550.9400 29495.0600 18917.8600 24706.3900 Cys-Gly Cys-Gly 69292.6800 182926.7500 18313.5100 61273.9200 182127.6700 38455.1100 109628.7100 86640.5300 64634.5900 25737.1500 130184.4000 147362.0800 9554.3800 19129.5800 20669.2100 100796.1000 80761.9100 141963.5200 28433.1900 163481.8800 47788.1600 72503.9700 107505.2800 29251.8200 38747.5500 77021.6500 11728.5700 109336.6600 99914.4400 90237.9800 185417.6700 41575.6100 156019.5900 41872.1400 107509.7500 29832.9000 25989.4900 208595.7300 96113.6800 42376.9200 201216.5500 25214.4000 71877.1500 45653.1400 43309.1000 198168.5500 27552.7000 10857.5700 163757.3000 58362.2000 60499.2000 146251.6400 37447.4000 63380.4200 61982.5600 67295.5900 181262.9200 69194.4500 27743.9600 86271.9500 18710.3400 D-4--Phosphopantothenate (R)-4'-Phosphopantothenic acid 19515.7400 62913.8600 18801.4500 39772.4300 53568.6300 33230.3800 53410.2300 23459.0300 23769.1300 15283.5800 75032.7100 57971.0900 45329.9800 61695.3500 29693.9500 26819.7700 27775.6300 40508.1700 26793.0300 19198.9700 17016.9500 38170.1200 11867.7500 15318.3500 61290.4200 7122.9000 18281.5200 32296.5100 7006.2500 61527.1400 41072.7600 25560.5200 59730.2900 17010.8800 37324.9000 5757.3400 17660.6900 32111.2100 41031.6800 43138.9500 37186.9100 15653.9300 60106.3800 18730 63105.2800 43825.9200 19338.7000 24334.8300 44676.5200 39682.0900 18942.1000 65166.8000 16471.9800 27858.1100 46900.2000 46291.9900 45025.3400 55272.4500 38266.1400 45958.1500 dAMP dAMP 70413.5500 22905.2900 115873.2000 43582.7000 44626.0600 94325.8800 30895.4400 54317.6800 65029.7900 35943.2900 90734.1300 21799.6700 58968.2700 19986.2100 11770.3700 75629.7000 48887.7900 23535.1300 65318.5300 87345.8700 15466.2100 30858.7100 49951.9400 23984.8900 89201.1000 19829.6300 35413.7000 56577.2700 16132.7500 48160.3600 20286.5400 24282.3000 47383.7000 53093.6200 42176.2300 75504.5900 41625.6600 54717.9300 16610.1900 21909.3100 D-Arabitol/Xylitol/Ribitol 3736857.2500 5927208.5000 3492498 3253115.7500 2623029 3801794.2500 3326538 5437154 4435430 2472891.7500 3104395.2500 3106715.7500 3968128.7500 3071242.7500 3779445.2500 4786717.5000 3039465.2500 3502524.2500 5541034.5000 4026086.7500 3909081.7500 3734015.2500 4212556.5000 2836862 4091839.7500 3818587 4317962.5000 4307866.5000 3725518 4953013.5000 4502011.5000 4223525.5000 4017967.2500 3278577.2500 4251517 3385872.2500 2352649.2500 2166659.7500 4218926.5000 6197026.5000 3227218.2500 3836326.7500 3328047.7500 3472947.2500 3496532 3629136 3052908.7500 3375666 4151067.7500 4116209.2500 3574384 3798804 2605911.7500 2920211.7500 4925420.5000 4276003.5000 4153263.7500 3845077.7500 3347790.7500 3066855.7500 3282924.7500 3622125 dCMP dCMP 33381.3000 14137.9500 62571.7500 73487.5100 205597.5500 60079.1100 85070.5600 13255.8900 14466.1300 74158.3300 24229.8700 75556.6300 18080.8400 30645.5800 78592.9100 67049.7600 54557.9600 34727.4800 17903.7700 138385.9200 38002.5300 149489.0200 52883.3600 59853.9000 38563.1400 83591.6000 55416.6100 20114.3400 65457.0200 37563.9500 35538.7400 40543.3300 56566.3000 70988.9900 25500.3000 72292.7600 15488.7400 47926.4400 26731.5400 18017.2400 23395.2700 16088.6700 119037.5300 15618.1900 80844.0200 15910.3600 Dehydroascorbate L-Dehydroascorbic acid 5973020.5000 8391179 5705000 4331578 4385052.5000 6221694.5000 5682338.5000 5474290.5000 4940811.5000 8884263 4643356 4439516 5449156.5000 5879772 8038874.5000 7493451.5000 7358949.5000 4325361.5000 5177291.5000 6951300 6329244 7591537.5000 6466364 5655424 9725933 6662840 4507521.5000 4183549 6193426.5000 3675541 7520173.5000 5677442.5000 7279288 8189660 6979180.5000 4171912.2500 6414966 3346240 5376928.5000 4485321.5000 5683397.5000 5492282.5000 5619451.5000 4531957.5000 5654724.5000 4281147.5000 5528840 6342432 8565593 9151529 3809559 7181364 4685710.5000 3719143.7500 3796080.7500 6914346.5000 4585490 6809980 4738264 9309287 4563539 5964080 D-Fructose 1-6-bisphosphate Fructose 1,6-bisphosphate 83514.9900 129229.5900 28702.1900 23680.1200 22834.1600 32965.6400 29096.2000 31776.9600 61909.8000 35352.0100 100438.4300 36136.8400 D-Glucose Glucose 44626476 45244660 37299596 45399156 37753660 34510244 39809888 41013292 44216388 36220344 36551756 41127548 40093516 36515680 37613824 34899004 42537204 37019568 39628516 38832364 37356436 41784860 36326956 37772588 36919312 40295732 40339116 36928176 36816032 43792704 39213044 41007964 36515668 37298236 37225028 43090940 42042976 48391756 36717068 42593184 31526974 44614336 39969988 40816084 42849812 38890000 36872600 40665560 30447990 48129900 38830420 34892352 43738484 38078684 41731904 36917492 42542876 42825516 45232708 38377492 44518820 41351720 D-Glyceraldehyde 3-phosphate/Glycerone phosphate Glyceraldehyde 3-phosphate 21150.9400 13582.0700 19061.8600 36374.0400 21133.2500 3449.1400 17046.1300 14998.2700 15673.5700 20054.9200 1520.6300 15041.4500 35814.8200 7376.3900 33997.5900 2020.3900 1202.9100 5890.5900 1640.6100 6911.4600 16547 10258.4000 2523.5800 1120.1100 4065.6600 16663.8700 2248.2700 16566.5400 51515.2600 16614.1200 12884.0100 14404.3300 1450.4200 3290.1600 4501.0300 6036.7000 16071.0900 17039.3700 9616.4800 7237.6000 10137.5000 12381.6700 1303.7000 9762.0600 5763.0300 18396.1000 3316.8100 D-Hexose-phosphate 140803.8000 238346.4800 147008.2500 180588.1100 162234.6400 79076.8400 198348.2500 176141.2500 174560.2200 103504.9000 124012.2900 118870.0200 146910.8600 146147.5600 170222.9800 163533.1100 156016.5800 191741.1900 169277.3400 156471.2700 140949.8600 219401.4800 98950.1600 177184.7500 150654.0900 96013.7500 141415.5800 141209.1400 171224.9800 200741.0200 188800.1400 184928.3900 121109.5000 202789.7700 147619.4800 183138.3100 161736.8000 146120.3600 133831.5900 208333.5800 143679.4400 138872.9700 222545.3900 126806.5400 173299.1400 107684.0400 124719.2800 130484.7600 176011.4200 241143.0800 102103.0200 136276.3300 150895.8000 140658 183192.1700 120042.9700 144553.0800 164382.1600 190597.8900 178036.0600 151560.8300 140384.5900 D-Rhamnose Rhamnose 4304361.5000 4122185 4644902.5000 1526239.1200 7239696 3815626.7500 6451220 7192949.5000 4072444.7500 4104122 4060413 3125132 3721011 4428923.5000 6090140.5000 7447469.5000 4609919.5000 3175290.7500 6645444.5000 4492875.5000 4802465.5000 8584021 5821083.5000 6115218 5470196 4501344.5000 3634777 5410011.5000 5291338 5292934.5000 4356782 4274148.5000 6219600.5000 5616880 6974225.5000 3101238.2500 6326180 4548228.5000 3857343 6570811.5000 4286198.5000 3886125.7500 7504620.5000 3383879.2500 8877407 5012410 5409075.5000 4939388 7842629.5000 4160378.7500 3336915.2500 6125034.5000 1384198.5000 6560296 5575674.5000 5166795 3838319 4534270 5981314.5000 4616279.5000 5326728 5706248 FA(10:0) Capric acid 41354556 34799212 29600712 32589798 39553388 25929750 35343232 38743268 38998332 27111370 35676036 34249836 32312960 38199540 36569024 38603212 30523866 35140044 30392134 35030680 35083388 38757024 38687392 30614056 36945428 33010098 37114076 37263196 33300072 35763476 39159548 28284218 38480448 33146128 36222044 33264024 31339958 34926524 27845874 37275096 33593012 31103546 36279268 36785640 36054556 37094216 31397786 32901662 33596876 26752170 36248580 29686118 23772902 39358204 32010834 38906060 31611806 30627448 37696588 34961128 38447104 38397300 FA(12:0) Lauric acid 2564613 2558308.2500 1249398.3800 3964462.2500 2607135.7500 2303469.5000 1883309 1818273.6200 3225513 1896342.3800 3558590.7500 1293176.8800 1459952.6200 3503210.7500 2186302.2500 2300509 1291239.6200 1744472.3800 2381376.7500 1966690.6200 2030931.5000 3143073.7500 2832443.7500 1261481.7500 3151132.7500 1707070.5000 2363420.2500 2288951.7500 2436715.7500 2736137.2500 2605154.2500 1685152 1890706.1200 1221020.8800 2191857.7500 1939676.1200 1980829.6200 1750958.3800 1504670.3800 3169010 1923494.5000 1912877.1200 2440951.7500 1729557 2827076 3689348 1135955.8800 1893297.6200 1750673.6200 1637233 2839069.2500 2165732.2500 2182446.2500 2359920.7500 2556451 2472812.2500 2248701 1425361.6200 1710307 2906010 2152235.2500 3293726 FA(14:0) Myristic acid 7298897.5000 9415975 9041564 5945274.5000 8389443 4186106 9274413 8145796.5000 7160649.5000 4831267.5000 6329002.5000 8356430.5000 9591199 5434754.5000 9326117 8309164.5000 7158781.5000 8246234 6751371.5000 7607652 7462096.5000 7978633.5000 10635719 8702416 6339414.5000 8509425 10515850 7024290.5000 6830082 8645987 6493108.5000 6859606.5000 8426796 7622286 8008747.5000 6408248 7227410.5000 8421025 4760816.5000 7401322 9851783 7711328.5000 10382471 9243746 7524812 5967336.5000 7121554 6377889.5000 8207922 6148129.5000 7183582.5000 6379762 7126166 7422892 8210262 9139239 7023598.5000 8210334 7376616.5000 6256904.5000 9491732 8234562 FA(14:1) Tetradecenoic acid 2554877.7500 2673197.2500 2493005 2670045.2500 2696354 2109220.5000 2538375 2488305.7500 2392574.2500 1984089.5000 2571617.7500 2379191.7500 2092366.6200 2603339 2200362.7500 2577618.7500 2122065.2500 2254248 2610740.5000 2574585.7500 2423300.5000 2699202.7500 2241816 2203489.5000 2650258.2500 2138117 2860730.7500 2771525.5000 2448273.7500 2552897.7500 2517572.5000 2112871.2500 2486145.7500 2119115 2439891.2500 2563387.2500 2376102 2271737.7500 1921844.1200 2258998.7500 2574964.7500 2153249 2528814.2500 2464745.2500 2333092.2500 2718818.2500 1956462.8800 2325988.5000 2516778.7500 2309882.2500 2665889 2515914.7500 1666931.3800 2576833.2500 2511440 2568172.7500 2482541.5000 2350163.7500 2212742.2500 2567206.2500 2772048.2500 2812291.7500 FA(16:0) Palmitic acid 46242652 51063244 47186016 53849060 45541504 34854872 44507140 47046812 47009300 34858764 45811056 44122548 47055328 49690304 50154576 50971616 49389036 44922996 51153440 45876284 42642248 52684816 53798668 48144272 40890976 36629908 62071612 44183988 50969996 45955296 48988108 49484128 41780248 43128092 52319376 45400988 56494180 47686508 33550922 39654080 51212892 38808116 51463660 40594532 50977504 69336960 61177872 33693144 45938704 48846336 48418172 43170892 43146020 49030692 49385876 54438276 41301684 39676484 47836652 45101744 49378196 62151804 FA(16:1) Hexadecenoic acid 3547817.2500 4416902 2499456.7500 5050901.5000 4166233.7500 2394901.2500 4404345.5000 3864029.7500 4299425 2493078.2500 4249050 3190443 3194518 4470047.5000 3731309.2500 4493188 3341897 3309650.7500 3144118.7500 3339468.7500 3584649 3836978 4583399.5000 2626508.7500 3738027.2500 3376848.7500 4636022 3951542.7500 4186335 4547483 4500359.5000 2770181.7500 2653001 3114562.2500 4082007.7500 3654746.2500 3358769.2500 2647455.2500 2803454.2500 3645482.2500 3380660.7500 3557581 3348784 3315720 4786183.5000 4272737 2888334.7500 3421976.7500 3492675 2924390.7500 4237031.5000 3021996 2905011.7500 3808394 4194017.7500 4124746.2500 3502026 2643411.7500 3137277.2500 3574549.2500 4442854 4352929.5000 FA(18:0) Stearic acid 18822966 23548654 27102728 25395050 24825482 22690422 21962264 22954240 19804762 20278358 21875580 22347448 23100242 23994118 33836412 23852414 22899968 19032986 34749888 20390184 20835282 26059642 24529146 24788080 20578848 19771640 43912460 23679088 26235894 23791184 25961634 22439786 20657902 27356162 24053730 23127506 42662196 25562584 17638470 20051510 27284966 19641370 28692832 22247930 26092592 50633324 46904020 15520044 20866222 23891648 22156406 20831656 19293194 22128404 25102842 31879318 19420196 16970226 26631998 23289418 23307898 29077240 FA(18:1) Octadecenoic acid 2944646.7500 2717265 3360173.2500 3398523 2994764 2515480.5000 2505341.2500 2657560.7500 2647389.2500 2721561 3177866 2598514.2500 6015632 2961290.7500 2603234.2500 2643032.2500 27953514 2762011 3883928.7500 3059367 3297306 3414248.7500 5815278.5000 16853692 4139084.7500 2852490.2500 4684084.5000 3188445.2500 3293406.7500 3112101.7500 3184206.2500 3122351 3128267.2500 3289188.7500 2635206 3590951.2500 3706328.7500 2650314 3082970.2500 2540134 3084278 2216702.5000 9447870 11471808 5396377.5000 4960082 4308127.5000 2564808.7500 3216556 2740992.5000 2450984.2500 2482379.5000 2277520.2500 2649955.2500 2642713.2500 3206333.2500 2598436.5000 2258571.7500 3006590.7500 3061429.2500 2486426 6789740.5000 FA(18:2) Octadecadienoic acid 1083929.6200 959173.1900 1031460.9400 991047.4400 1248364.1200 1034672.6900 1148923.3800 1287898.3800 970653.7500 829381 1133073.5000 1122982.2500 1156073.5000 1104588.6200 1097189.7500 887213.6900 5195456.5000 1097996.7500 1386930.1200 1023720.7500 1120819.5000 1018785.6900 1490491 3653346.7500 1513969.6200 1168386.5000 1857167 919232.5600 1198727.8800 1156600.6200 1007718.1900 987272.1900 1052981 1142712.6200 1008221 1385843 1299082.6200 1199337.7500 828847.5000 1058336.7500 1303647.1200 1048191.1900 3078175 3534142.7500 1337861.3800 1246860.6200 1624432 1045655.8100 1198981.5000 1063302.8800 960540.9400 840316.6900 712734.8100 1117287.1200 1057556.8800 1208812.6200 1078446.8800 918383 1168111.3800 1096080.3800 1008549.6900 3185634.2500 FA(18:3) Octadecatrienoic acid 103162.9300 105424.0400 129134.4100 130454.3800 126036 87532.3700 147426.3000 128658.6500 138608.0300 132503.5000 151134.3800 126288.6200 151141.6700 115578.8200 112209.3800 101239 439387.9700 121675.1300 128863.1000 130899.8400 140214.5500 136823.4800 174048.6100 358530.7200 155628.1700 124053.1600 186661.7700 145430.0600 135366.3600 143127.2700 149464.1400 94030.4100 146368.5600 144811.1100 128955.7900 131324.5200 111351.9100 94372.8800 121331.6000 139461.9400 143697.3100 124254.1600 277912.1600 255467.8800 171385.0600 130020.1200 118437.9600 90764.9900 116409.0200 122157.6200 98838.4000 114992.0400 116092.9100 120415.8700 112238.0700 140532.6900 115077.2600 85140.1200 103739 169725.2000 115351.5300 193534.0200 FA(20:3) Eicosatrienoic acid 12635.2000 14140.9800 64515.4700 34063.2100 22791.1100 31297.7200 46694.8200 45626.2100 21935.3000 34455.5300 15518.8200 103262.9600 16291.0100 20450.0800 383771.5900 14587.1100 26545.7600 95200.9000 24368.9700 38168.2600 84689.2700 206998.9500 21714.6700 57311.0600 47970.0400 37818.5200 64528.8000 15059.6600 48321.4100 44553.1800 64514.7000 64984.4500 23345.2800 53436.4700 70947.4500 9891.4600 64276.2000 16037.3600 39027.5800 41666.3900 178556.0600 145085.2000 56288.3100 14667.4200 18587.0600 17702.6900 23317.8500 15037.1500 37216.5500 57467.2500 23162.9700 8933.3200 12561.4100 23045.6300 17923.7900 32749.9900 99380.1000 36921.1300 79655.2000 FA(20:4) Arachidonic acid 127399.9900 96945.1000 162814.2000 51762.5800 189824.6900 115590.5700 158669.7800 45742.4800 139433.7300 223585.2500 78886.9900 60563.6900 416192.3400 58708.2900 138285.6100 130404.9900 861913.6900 91519.4100 45297.6400 285787.6200 120241.7000 172928.0800 357794.6200 654327.5600 167688.3300 182390.6100 149295.3000 74184.5600 246302.9400 74662.5900 182210.3100 147666.7500 160625.2000 285144.7800 120638.8500 308654.7200 123639.0600 119601.9100 78349.0100 32991.7000 326159.6600 123544.4800 633860.0600 548080.7500 152478.5500 51016.5900 66369.5500 70486.0900 154900.7300 127422.4600 52517.4500 123850.5600 135495.2000 115224.3800 58418.5000 220805.7000 125419.9700 157516.4500 172409.4200 335222.2500 82478.1000 298762.5300 FA(20:5) Eicosapentaenoic acid 105413.6600 21717.2300 57067.9900 32172.9700 44564.7500 10633.4000 75696.7900 172773.8100 63376.2900 18335.3200 38169.5300 140857.3900 142993.6100 40773.6100 126259.9600 56144.2500 57651.6100 64758.2500 79944.2300 29202.5500 16143.0500 93321.1600 74052.7900 17277.3300 32404.4800 41435.5300 56180.3800 65132.6900 48928.7800 53119 122320.6500 18783.0700 72390.5300 33935.0400 104346.3100 56565.5800 50195.9500 79752.8000 57613.7400 131378.3900 101601.8400 77419.5700 78246.2000 103401.6900 27861.7900 66171.0700 53064.6200 15201.5300 47106.2800 94203.7900 69914.8600 33114.2900 28701.9000 86429 47479.2000 27914.9900 11635.9700 63656.7500 91211.4100 67513.5200 16859.0800 FA(22:5) Docosapentaenoic acid 12475.3900 10480.0400 34006.7200 16128.8200 49471.0300 12993.1600 8105.0600 10797.8000 15166.8500 39108.1100 10712.8100 FA(22:6) DHA 135735.1200 69606.4300 183360.4500 130748.3800 179290.1900 213104 286223.5900 61613 187649.7500 465951.7500 166858.9800 100558.6600 231382.9200 184924.0600 121110.6800 172150.9100 648524.6900 82529.3800 51442.7900 371650.5000 183552.1900 170322.0800 310476.6200 277481.1600 232799.8300 115960.6000 252474.1700 93914.6000 411243.1600 38706.3900 245970.1700 227955.9400 101709.1600 328072.9100 171964.1700 132758.6700 340650.0300 49051.0200 188062.3000 60868.4100 482846.1600 153370.6200 439287.7500 393693.7500 194486.4500 112812.6900 81908.5600 90233.7900 136844.4100 130965.0100 151709.4800 164820.4500 103038.2300 105732.3200 64116.0800 245472.5800 186784.7300 237166.3800 256285.2500 539372.7500 108376.4600 159794.8600 FA(4:0) Butyric acid 463835.7800 137339.7500 199136.8600 300092.5300 234236.0800 239867.6400 274747.0600 305465.6900 175664.5800 132698.8600 215987.3000 241266.9500 166262.9800 298505.2200 265667.0300 257234.0200 238527.5500 181725.5800 280879.7800 186645.7500 246282.5000 252807.8300 254044.9800 223125.6700 290048.8400 189353.1200 219239.9200 213123.9500 236639.4200 257348.9800 258311.4200 211953.7700 251067.0800 252902.9200 352329.3800 241827.3300 216688.9200 213114.0500 179504.7500 213429.6200 225455.2300 210088.9400 248581.6400 180713.8000 287609.0600 261537.3000 237895 252337.3100 316794.7800 326247.8400 287377.0900 287223.7800 253243.3000 273927.3400 277792.7800 238177.5000 201777.6700 185368.1200 198716.8600 217786.1400 213943.3800 268360.2800 FA(5:0) Valeric acid 52165.4400 113068.8200 67378.7700 129575.1500 98180.0400 72852.7400 165478.0500 156590.6400 86233.2400 50489.9400 105005.8400 102525.4100 48361.5300 161455.7300 127915.6000 122584.4100 78320.3800 66150.2300 114377.2300 124678.1200 147014.4400 116448.2500 139451.4200 126190.9100 127533.5200 99918.8500 141162.4800 86962.2300 134720.2500 165073.3000 72465.4000 33676.7300 108070.6300 120335.6900 104788.2500 129043.4800 97065.4400 99935.8200 90464.7800 115696.8500 102551.2500 100863 137935.0300 114681.6200 156761.5300 66412.6200 56687.1400 62031.8000 111780.7100 140466.3600 71363.3500 105972.5700 70591.0500 123984.1800 143755.6400 109322.8400 99527.9800 69322.8700 125642.1500 104134.6500 91943.9000 105158.4100 FA(6:0) Caproic acid 308164.3800 311690.3400 276321.8800 322919.6600 284083.2500 217207.3100 306492.5900 296412.8800 360347.6600 279770.5000 326219.6600 323697.7800 283281.5900 354883.9700 333417.8400 321448.2800 265343.6200 264633.7800 305137.7200 267650.9100 351816.6200 365913.6600 324996.8400 355450.5300 335274.0900 282261.2500 358813.3800 339798.6600 277547.4400 318935.3400 363591.7500 278584.1200 376626.3800 278056.3100 308458.9700 284528.4700 283969 257718.4500 248713.0200 373207.7500 374959.5900 295837.5900 349462.5900 306206.4100 427785.5900 403943.7500 307040.0600 356733.7200 349625.2500 310031.0900 322829.0900 364700.5000 247361.4400 313982.2200 312134.1200 300519.9100 388135.1600 304476.4700 318316.3800 340043.4100 357088.8800 413269.7500 FA(7:0) Heptylic acid 634191.5600 632372.2500 537460.9400 650302.8100 582517.3100 385904.3800 645606.3800 577739.6900 637762.8100 471316.2200 686924.8100 572740.6900 531804.8100 674131.4400 620316.5000 623352.4400 412919.8400 590911.8100 571499.0600 567075.7500 650827.6200 709972.0600 638152.5000 605307.3100 615179.4400 577789.6200 646563.5000 627308.0600 612040.0600 655404.2500 650982 454131.2200 635880.1200 525878 657780.1900 524298 586249.5600 574957.8100 423099.9100 693894.8100 694845.6900 565380.7500 709455.5600 538275.2500 715318.3100 763798.8100 535872.8800 600891.8100 653989.2500 596226.0600 602970.6200 607970.7500 376476.2500 592535.5600 563399.1900 645807.0600 622742.6200 522054.3800 646665.2500 695033.4400 657063.3100 668662.8100 FA(8:0) Caprylic acid 60619860 622275.4400 706172.6900 623652.7500 549633.0600 267167.5300 777416.6900 537237.3800 500053.1200 318659.5300 599224 377819.6600 546926.6200 598474.3100 613306.1900 975897.8100 349867.5000 508561.2800 747199.7500 584151.7500 565462.6900 705856.2500 520497.2800 3007831.2500 811353 383509.2500 69893928 525266.1900 588352.3100 533984.9400 706247.8100 400540.0900 498418.5900 634440.6900 753366.5600 513835.9100 548327.6900 518579.5000 262825.4400 486581.2800 610141.6900 437531.6200 1894761.1200 373970 723671.8100 512509.9700 481090.9700 460715.4700 832399.6900 682272.7500 420183.8800 649791.6900 192712.6200 566542.7500 503499.5300 530402.0600 462635.7500 522762.5000 685030.6900 538418.3100 547771.5600 1299962.6200 FA(9:0) Pelargonic acid 15050888 15306512 13507881 14617803 15457147 10416761 13209776 14847995 24130744 15996675 22030738 19408578 15985797 21748530 14987135 14784643 10971506 13934451 13904504 12946613 20611134 20150538 20378224 16114116 15224116 14249408 16981056 15497052 13334548 16202404 24095518 15411592 16248728 12121208 15596832 12880021 13929509 13565789 12000544 23786544 20605216 18399640 20462784 19524856 18712410 25151534 18461990 14425381 14300899 15290051 17648072 14640955 10257743 13769755 14709909 16267385 17083808 19224264 22965862 21029424 19788008 19357112 Fumarate Fumaric acid 223556.6400 1804205 3168062 474868.6600 1199855.6200 4801024 1135725.8800 2621778.7500 1679706.6200 1398376.3800 717672 3092024.7500 3354276 641363.4400 491487.9700 256964.4400 2679515.7500 1758762.3800 3066580.2500 1006906.9400 2961513.7500 1446178.3800 2239263.7500 4179479.7500 644751 739809.1900 1600955.8800 249440.2500 1767542.8800 1533649.3800 1924269.5000 4545573 960355.8100 3330831.2500 1295976.6200 2430114.2500 1536394.1200 1248278 4530730.5000 2345044.2500 1181038.3800 4411185.5000 815243.5000 2366735.5000 872746.5000 1126341.6200 4362020.5000 1017676.3100 389473.4100 2749893.2500 1242792.8800 1412626.8800 3776170.7500 853151.6900 2003345.1200 1551529.3800 2342647.2500 4051067.2500 2096205 932208.4400 2530853.7500 1044065.9400 Glycerol 3-phosphate sn-Glycero-3-phosphate 614972 841877.1900 1162346.2500 969585.0600 1314207.8800 718969.6900 1675628.1200 708931.6900 775853.1900 714871.6900 764343.0600 910595.8100 887693.5000 1169203 554051.1900 833094.5000 1460960.1200 958958.7500 706111.3100 645754.4400 824154.5000 1168193 644484.7500 1145963.6200 551105.7500 609448.3800 671749.9400 978326 554269.9400 671333.8100 974267.1900 836240.6900 752496.1900 991846.1900 1215031.8800 974731.7500 789946.1900 966473.3100 741810.5000 685774.8100 607169.7500 873724.5600 1272993.1200 676915.3800 1454183.1200 872169.8100 939261.1900 591289 881902 901883.6900 685239.6200 1169232.7500 1089245.3800 972014.0600 740002.8100 694823.1900 687666.2500 921030.4400 1264504.5000 636394.8800 960357 972953.3100 glycine Glycine 205516.4800 258633.2700 234930.0600 240315.7500 204489.6100 127998.1200 242342.2500 210388.7500 206122.3000 147195.4200 239126.2000 207573.0800 162928.6700 220039.3800 195497.5600 245068.1700 172966.0200 185308.7000 194887.6100 274797.9700 167597.4200 295487.6900 233403.9200 268651.7200 235471.8900 250781.6200 176555.2700 163395.2000 247355.6900 252832.8300 231778.4500 131166.2300 169959.5200 177960.3000 258863.1700 228709.0800 169334.3900 218129.4400 130060.7700 178638.6100 256857.2000 157656.2700 256854.3300 203580.7300 198451.3000 196602.7700 155007.6100 253959.8300 214764.0800 167815.3300 147610.3000 166776.4200 130453.2400 188625.4500 204629.1100 221063.3100 175836.8300 245884.5800 242830.1200 319416.0900 182523.7000 193558.3000 Glycolate Glycolic acid 800710 1124256.1200 739057.9400 704898.8100 617509.2500 598616.1900 1182414.1200 915343.4400 943685.8100 747117 949294.5000 739207.4400 831865.6900 1122042.3800 983989.0600 1196736.6200 698618.0600 1109767.8800 1137322.2500 913054.5000 775814.5000 1198096.3800 917729.0600 912675.1900 1338095.7500 667745.5600 693808.5000 880097.5000 773589.3100 944816.1900 1098219.6200 848500.5000 972799.7500 1143643.6200 1360436.6200 671713.9400 935483 782460.4400 566533.3100 819956.4400 913606.3100 713169.4400 1289348.6200 718629.5000 1167481.8800 902090.0600 860964 790831.3100 1396142.1200 1186899.6200 707727.6900 919609.6900 594398.6900 1028176.3100 937540.1900 986219.9400 662209.9400 865122.5000 963887.6900 987374.0600 943975.5000 1187492.3800 Homocarnosine Homocarnosine 424914.3400 344938.2500 203564.2300 274516.5900 106671.7400 178546.1200 792342.0600 158366.3100 246699.8300 229453.1200 259245.5500 181489.3900 708250.3100 473512.1600 312788.1600 690280.6200 499583.5900 184341.8100 205841.0600 544220.0600 404244.9700 357225.9700 159065.8100 146347.7300 264525.4100 184168.2500 542062.2500 54588.5700 431182.8400 156008.3000 189876.8800 153241.7300 330719.7200 216408.5000 35650.3200 345115.9400 28005.9100 188139.4400 22431.1500 386756.2500 453671.6200 214827.5800 150452.3100 219774.5000 146138.1600 125748.0900 224086.2000 767861.2500 154783.2500 297741.9700 409014 289744.1600 188056.4500 116720.5200 290809.1200 422811.7800 191377.7000 329042.7800 661578.4400 227656.0800 107928.5100 882786.8100 Hydroxyindole-acetylglycine Hydroxyindoleacetylglycine 111492.5900 68872.6500 70391.1000 86653.0300 70225.7000 65655.5300 85316.1200 104320.1600 75294.6500 61421.2000 61986.6100 70539.3100 82141.7200 71300.9800 75895.7700 89095.5500 83916.1300 94406.9600 89729.3100 66641.1000 86682.2300 68504.1200 74229.5600 57081.6500 80361.4600 80238.4600 104621.0600 80354.8200 99701.0500 92446.2200 83079.5700 65111.7100 100235.4800 88742.5900 74944.3400 80242.2400 93751.2500 68440.2400 64193.8200 90381.3000 88626.7200 68672.9500 88441.1000 83909.3200 74675.4300 110097.4900 91629.7600 79013.2800 102191.2300 83080.8600 92780.9100 85188.3500 65968.6300 78560.1400 77214.3800 74792.9800 107785.1500 76967.9800 97046.0900 87097 75960.9900 97159.8700 Indole Indole 7973.1000 2962.5400 1779.2700 10117.3700 9354.7700 4265.1600 6695.3500 10888.1700 4492.2900 5390.6900 3790.0500 2597.8000 4951.2000 7756.8900 2745.3600 1924.2500 12776.0300 6583.1300 4785.6700 5895.1700 6432.8300 3529.6600 2247.5900 2195.6100 1785.9000 8756.2300 1981.1000 2749.2400 6105.2100 3200.7400 3815.1300 5385.0100 5993.1100 10295.6700 5062.9300 4490.9500 4554.7300 7656.0600 3991.9200 12582.5900 5411.5100 1856.8100 9152.4900 2264.6000 4483.2200 5711.9100 4809.2000 4006.8700 8144.3700 5313.0300 6075.8100 7861.3600 4777.1300 4467.6500 Indole-3-acetate Indoleacetic acid 170691.2300 3001.0100 5563.8500 3297.8900 3538.8600 6399.9600 4337.8100 2585.8900 7890.1200 9337.9600 4419.6600 5328.7400 7488.1300 5209.9100 5176.0600 3633.9500 8917.4400 5000.2100 4880.0100 5687.2100 4070.8200 5558.8800 6253.7200 11925.7900 3915.1800 6467.9900 3501.4300 5503.4400 4867.8100 4552.6300 4735.5600 6990.9100 2102.1700 7681.1900 5601.0300 3804.7800 2785.2600 13535.9900 7059.8800 5052.5600 5380.0600 5930.8600 2910.8100 5393.6800 6756.6300 1952.0900 3554.8700 5102.8200 5498.3500 4293.4300 4364.5900 6648.6200 10941.6800 2208.3500 5627.0600 2704.5600 3281.0700 7092.4400 2725.5600 3775.0300 2905.5800 2780.9200 Indolepyruvate Indolepyruvate 4994.7400 6489.8200 9467.2100 7511.7600 2428.1300 4853.4500 2018.3900 6212.9700 6313.4200 9627.4900 4519.0900 9352.5700 20246.3100 4772.9100 7795.5200 4683.9200 12817.6000 3820.4600 5404.1600 5861.6100 6135.1700 6228.1900 9544.9300 15859.2600 6244.6800 8946.9100 6405.4200 3626.6000 9010.1800 11049.8900 2274.9000 10346.6100 6709.5600 6879.4900 6655 6450.4900 4160.0100 7354.6200 4740.9000 4306.8300 6806.1100 2866.4100 25925.0300 10138.8200 4343.2100 3792.1900 9951.9100 5546.6000 5038.3800 4893.0900 7498.3600 7416.2400 10546.5000 3378.7900 3008.7600 8110.3100 9234.1000 5090.0100 5672.1500 13897.2000 5989.7900 8996.2000 Indoxyl Indoxyl 3562.7700 2805.9600 2597.7400 2195.6100 1496.4000 3282.3600 1992.2100 1427.1800 2175.1500 2087.4300 1545.0100 1470.2500 1709.2500 4441.2700 4153.4300 2048.3100 3617.5000 2437.7200 1172.7500 2083.8900 1678.7800 4704.1300 8974.4900 2872.3600 3196.4600 1991.7400 1694.6000 1598.7500 1655.5200 9406.1600 1693.9200 1697.0400 2306.6200 1858.3800 2231.2700 Lactate Lactic acid 47712332 56992684 58562124 56464212 46909836 55042084 44974164 40678668 38213812 69653896 48357044 35245748 52414388 42850828 55230108 66791036 52859152 58339280 41558524 47032548 40679884 52887472 43276444 44488272 50082740 58596020 49464964 50382084 53316832 41776532 43749568 52502420 59747644 64482692 55710624 59349440 61915024 45019956 40834712 40658396 45581328 46519300 42360644 50336820 51251116 40806224 39233064 54209620 61978420 54347212 44116340 52682484 64974836 48468348 39388020 47983472 45141252 44234732 42339232 64342132 46118596 48810560 L-aspartate Aspartic acid 149497.5800 137030.9800 90422.5600 99097.3000 122095.4600 102050.6000 93182.6500 224934.9400 173865.4700 164643.8900 152473.1700 96694.2500 208955.6400 126711.5900 86137.1500 205182.7300 113767.4100 97837.4500 133499.9400 190825.0500 175158.8800 125876.7800 83028.7900 64619.8300 143031.8000 173250.8800 155865.8900 100622.9800 173484.8800 128797.9700 199165.6700 102933.4300 195652.0800 134289.0600 62130.4300 97889.9700 130467.0200 137140.1100 102394.6600 142126.2000 160437.1700 101836.3100 227289.4200 149899.0300 126459.3400 140212.0800 112517.8700 102136.4600 211030.8800 146506.9500 117149 135850.8300 113004.3500 109381.3800 127041.2200 123268.8800 134524.8300 128796.2300 131145.9200 176762.9400 84998.1200 147797.8300 L-Cysteate Cysteic acid 23173.0400 32463.2200 48852.4900 19315.7300 33386.3100 87622.9000 27780.0300 28433.9900 18381.4600 100200.3500 18841.6300 65422.0700 65223.4000 23211.7500 34297.7800 19872.8900 65358.8900 30252.1000 32713.3500 23245.0200 28299.4200 23556.3500 26993.0500 71857.9100 34539.5200 61498.1900 61294.5000 21450.7100 21793.1800 16173.1400 22453.2700 91463.6800 24898.8100 93202.8800 63314.9300 36975.9200 58698.7800 25396.7100 87464.9700 25996.9400 17186.6200 34634.3900 44537.4200 45864.9300 13407.4300 26265.6400 87208.9600 35448.4900 38043.7500 27911.2600 33282.8600 47284.1300 58143.3200 27257.6000 35205.2800 24923.3600 41173.2000 73572.0900 33942.9400 41804.8400 23533.8100 44627.2600 L-cysteine Cysteine 4156.5300 1170.0100 14698.6600 4581.4300 2711.4900 15104.5300 15462.7400 1108.9800 1056.8600 4197.3800 11873.6400 14000.6800 3459.1000 4068.0900 L-cystine Cystine 68292.2400 244417.1700 412529.1600 147455.0200 147198.5200 690282.5600 193034.7000 191673.9500 199663.4800 919419.5000 187242.5800 300250.7200 415769.3400 116693.0400 270303.6200 157968.9500 443799.2200 357138.5000 183973.6700 308694.2800 178710.3800 222585.8000 285900.0900 403775.4700 154938.7300 359719.2500 199798.6900 193914.8300 263864.6200 162875.1400 170732.6700 422302.8400 326726.5900 420310.5900 260037.3300 408063 351166.2500 261120.9500 532236 218317.0800 249777.9500 410026.2800 131205.0500 367487.5900 277836.6200 102156.4700 305870.3400 417193.4100 182229.7700 268297.1600 208483.1700 301302.7800 748854.3100 162850.2800 249419.6900 227728.8300 304175.3400 418340.8400 208117.4800 247025.5500 275139.7800 118804.3100 L-histidine Histidine 548929.1200 873583.5000 733938.5000 764756.4400 525009.3100 1067210.2500 977316.2500 490128.1600 773191.8100 1173229.3800 628145.3100 697202.6900 854505.0600 921674.9400 666128 935902.1900 1027605.9400 643658.0600 604630.7500 922603.7500 841381.7500 748582.8100 556259 722258.8100 716527.5000 669661.1900 567084.7500 590813.6900 927271.2500 536168.1900 1116225.5000 1123793.6200 815235.1900 796806.1900 949900 695749.5600 867710.0600 619019.7500 819011.6900 679588.5600 804492.1900 807841.7500 1001277.5600 927918.8100 798346.3100 810284 871695 566696.3800 816076.5000 980950.4400 534505.0600 712034 672177.8800 400936.5000 554212.3100 842661.8100 639263.5600 1118824 1062866.2500 1287860.5000 917924.8100 961011.5000 L-serine Serine 155606.8600 108877 137125.7500 159319.0200 108742.2900 84966.8800 182568.1100 117967.9800 125173.4000 94077.6900 55234.4400 78070.7300 120950.8200 131485.0200 172929.0500 132413.1400 90957.2700 101521.3100 99461.9900 194353.2300 171806.8800 208040.7700 130978 114317.9800 102190.5600 233522.1400 103663.4000 184380.1200 222529.0800 158357.4800 160691.1600 143851.7000 106335.9100 186343.5500 109434.7900 103234.6900 165595.7700 311783.9700 102059.7200 101603.2100 185674.5500 175052.4800 199967.5800 163003.1200 84108.8500 109178.2700 91247.4100 160556.4800 148952.7300 140835.3600 98351.0600 117969.9900 113894.6200 143419.7000 99879.2900 153031.6700 94088.5900 155336.1200 216953.6700 215642.7500 67159.3900 156007.0500 L-threonine Threonine 517852.9100 502535.9100 589960.9400 650967.3100 465041.4100 315921.6200 476723.4100 268203.7800 603050.0600 350610.7500 477301.1600 891362.6900 424435.2200 910275.1900 590394.7500 517106.9100 669859.6900 839913.5000 444852.0300 896190.6900 699793.7500 575283.8100 309957.1200 367922 568699.3800 572859.6900 388951.6200 474201.5000 580583.7500 413671.1600 597448.1900 390035.0900 459173.5300 469272.2500 590092.8100 670899.0600 576799.0600 312781.4700 424650.2200 317607.4700 1071540.6200 607130.5000 738430.1900 487242.5000 583848.8800 617308.5600 648066.9400 364982.6600 391941.3400 420695.7500 435903.2800 511739.3800 370914.5900 503495.7500 368524.9700 524096.5900 423264.2500 777535.1900 982379.8100 838030 597078.7500 472532.3800 Malate Malic acid 324071 318020.6900 205791.5000 272392.4700 278200.0600 263819.0600 275637.8800 343355.5900 191393.2700 234772.7500 239707.8900 232371.5200 279426.2500 336381.5000 316398.5300 330991.1200 416813.7200 219272.3800 230246.9800 240375.1700 286906.1200 352016.5900 323123.1600 333220.4700 360404.7500 276956.2800 422256.9700 300889.5900 329960.7800 302357.5000 375842.0300 229209.3800 389407.3400 396502.9700 473380.5900 264610.6600 463765.2800 16126311 181828.4400 243859 202981.8000 233006.8000 316904.7200 323577.1200 281332.4700 365191.8800 347281.4700 321998.5300 440420.3800 501883 273660.7800 401100 281892.8800 238220.9200 269268.7500 265128.9700 183535.3100 250766.9500 323539.5900 314611.3400 332908.4700 450348.2500 Maltose/Sucrose 180434.2000 14099.1800 33778.5000 45717.4900 44376.1800 62557.3800 17902.2700 23425.9400 27932.4400 77195.1300 33455.3700 33762.1800 19107.7800 23570.4200 39356.5000 23014.6200 19003.7700 22090.7500 40488.5000 140724.4700 17336.4400 118827.5400 31738.2500 22150.9400 35580.9300 33552.0100 12122.0700 23075.2300 36915.2000 19028.8200 22128.9500 31207.9300 23104.2100 18886.5900 31574.1800 33696.1200 197550.8800 16373.7200 48671.2100 21780.3100 30130.6900 82029.5700 49922.3900 188820.3300 49846.1900 20500.3900 229769.7500 56766.9500 21334.2500 Mannitol/Sorbitol/Glucitol/Iditol 9997533 19575144 7044056 9451585 7695726 5414777.5000 9087857 8849982 9475962 7297341.5000 7597939.5000 6135867.5000 7136481.5000 6041688.5000 7695252 6476713.5000 6691905.5000 8325949.5000 8812743 7195988.5000 7545852 7669048.5000 5458440.5000 4756893 8518116 7604859.5000 10037961 6488980 7021116.5000 10545097 9984541 6893930.5000 6838216.5000 6912368.5000 6505878.5000 8127584 6663516 3843255.2500 6120103.5000 8260806.5000 6033771.5000 7925073.5000 7531086 6849980 7158331.5000 5297038.5000 4578616 7536920 5249221.5000 12396873 8557695 6306322 6581402.5000 7298283.5000 8441192 6955777.5000 7881310 9441085 7796934.5000 7474261.5000 5349285.5000 5345268 N-Acetylneuraminate N-Acetylneuraminic acid 2110575.2500 3948290.7500 2524780.7500 2867949.7500 2041971.1200 2087028 2189488 3827180.7500 2618661 2407455.7500 2482272.2500 1466658.5000 2104099.7500 1658441.6200 2330012.2500 4039980.7500 2739318.2500 2466636.2500 3799008 2629682 2198439 2268353.5000 2526968.7500 1531537 2110362.2500 3183677.2500 3291107.7500 3974893.7500 2630530 3974571.2500 2486437.5000 2740282 2524809.7500 2713947.2500 3515891.2500 2287128.2500 2007669.8800 1535494.8800 2314090.7500 4290446.5000 2002736.6200 2415469.7500 2137417.7500 2194560 2212078 1575596 1450723.3800 2254181.7500 3184252.7500 3435759 3130032.2500 3589935 2338741 2537279 3760209.7500 2104676 2640430.7500 2028733.3800 2327761 2057759.3800 1552760 1593198.3800 NAD+ NAD 80316.2900 20620.8700 19921.6200 21789.7600 19990.8000 16490.1000 20089.7400 20483.3700 51396.6100 17257.8000 20049.2400 17982.0900 25855.0400 51727.7700 21697.2500 39225.6100 15554.0300 16956.4700 64250.8800 NADH NADH 31110.6200 25079.2800 17148.8300 27730.8400 15366.9800 52436.1700 13154.5700 28426.5400 24778.6200 43687.9700 10002.5100 44334.9800 11749.7500 23687.4400 16236.9200 24458.8200 34972.5300 16904.4500 23151.9500 43840.7500 26598.5600 13111.6000 16019.8600 21783.9500 44839.6400 20432.3200 30436.0800 48951.8000 35170.7800 14964.6300 26502.9400 20712.2900 N-formyl kynurenine N-Formyl-L-kynurenine 14478.5600 15019.6400 14029.4200 N-Glycoloyl-neuraminate N-Glycoloylneuraminic acid 28295.6600 71371.1200 20408.3600 55091.4000 49441.8200 15526.0200 16731.7300 17347.0500 29126.7700 14914.4700 38966.8600 16785.7100 20514.1300 34178.1800 19460.7000 21479.5600 35080.5500 33075.1700 34587.0800 26792.4700 7918.3100 47551.5500 40193.9900 11400.5200 23975.4400 58000.5000 21489.9400 53951.5500 18394.0700 25660.2300 33827.1700 21341.9200 28595.8700 12551.8900 14168.3600 20417.6700 11701.3600 15818.7100 25364.1400 32640.7200 19368.0300 30475.1800 17058.7200 33756.7000 19093.6600 24811.2700 25966.7600 17940.5500 24430.6300 20893.2200 31858.2100 13699.0400 12280.1400 47392.7800 17664.5800 28235.9900 19400.9900 44044.7200 22753.2000 21802.0200 36653.0900 36666.8700 N-Methylethanolamine phosphate N-Methylethanolamine phosphate 37392.2000 18765.8500 29777.0500 16699.2600 55365.1400 15316.9200 26739.5900 27064.7100 33817.9600 27079.1200 12873.7900 29045.8800 25769.8400 16981.9500 63104.4200 N-Succinyl-L-glutamate 5-semialdehyde 111366.4000 149712.5500 130423.4000 90761.9000 145413.6100 88197.9600 55709.6600 194176.8100 88749.2400 143340.8900 49663.2300 112374.7700 65290.7200 65802.2300 128336.3700 126378.9400 98841.0900 114019.4800 158984.1100 124025.2300 107631.6500 209143.4800 155561.9200 68225.2700 133598.3600 61762.2300 200530.2000 207891.0800 117905.4000 185161.9400 160076.5800 186223.8900 170661.0600 127445.0200 209735.5000 124136.9400 79194.7000 124721.6900 88680.5900 169102.9400 137520.7200 54006.0500 48416.1000 112542.1200 63492.2100 121622.7300 45179.8900 165593.7200 105874.3400 126842.9700 117057.5000 193186.5500 116824.4000 203340.6200 147401.1600 54626.7300 137084.2700 126694.1000 127884.8500 172934.9200 123985.2200 53962.3600 Oxaloacetate Oxaloacetic acid 266024 191089.6900 206319.9400 120480.8800 151115.2800 248020.8300 222727.8100 216131.1200 210627.6700 372213.3400 172057 167171.3800 197941.9800 191860.0800 277902.6600 267945.7200 250703.5500 140625.2800 221596.5500 219703.7700 223786.1400 155174.2000 239381.2500 254367.8600 407108.1200 265124.8800 154996.8900 118643.9100 264599.7200 175567.8300 280402.0300 263527.1900 255773.7500 225699.8600 246622.3000 138553.6200 279167.4100 68999.0800 223169.7000 146448.6700 266358.3400 185087.8000 208385.9200 152864.8300 169712.6700 149529.4400 240862.3000 231133.6700 260860.0800 309255.0300 118669.1000 204808.7500 170327.3400 100852.4000 137007.1400 299012 148963.3800 242657.3800 199336.0200 346835.0300 141052.1100 205637.7500 Pantetheine 4--phosphate Pantetheine 4'-phosphate 51970.8200 61763.4100 46750.3600 150235.7700 96388.1500 55242.3300 21275.6300 91436.0700 30367.6700 37428.6400 71268.6600 236920.1200 32025.3800 42771.4200 20412.6100 99360.0900 83233.0300 30109.0300 63996.1400 66636.5500 143103.8400 23489.0400 130778.5600 118321.9400 30920.5000 80974.6600 75901.2300 35349.8600 162509.2000 92130.4100 60306.6900 33366.7500 62314.8100 87772.6600 37163.1200 98805.7300 107943.5900 41456.8800 72251.7300 65469.3200 51191.2100 68889.1600 26377.4400 39089.7900 32160.4800 96957.1600 95083.2600 28922.9800 49698.6800 79600.5200 136912.8000 68124.0200 91807.5400 67777.1200 84762.5900 166305.5600 Pantothenate Pantothenic acid 95051.7700 110481.4800 253064.5200 106690.9100 152517.4200 235021.6900 139580.4400 264815.9700 129493.2300 126258.9900 129122.1200 50431.8500 129819.6300 113264.2500 162963.1900 151544.8600 235231.3900 112374.1200 212525.0500 158526.3900 151928.0800 178478.3900 186014.1200 115281.2300 125780.7500 61823.6600 208233.6400 250879.1100 180365.3900 183742.0200 210222.8100 228834.3300 112182.3000 259351.4200 216209.1100 115432.9900 255512.8600 39247.3600 131425.2000 194192.6200 110837.3700 124858.6600 143410.8900 115566.0200 151833.5600 51770.0400 122165.1600 48937.5600 80248.6800 152934.1600 153605.7300 246978.2700 113534.9900 66856.7800 227949.4200 150366.7300 106910.9600 172025.5600 107378.6500 152009.0800 102543.2000 107053.8700 Phosphate Phosphoric acid 365781.9100 326629.4700 409754.7800 416496.5900 434620.4700 292352.4700 395782.4100 383389.7500 389996.3400 459967.0300 429578.3800 373845.8400 337711.2800 367019.6600 387188.7800 324874.0900 363677.7800 389724.5900 341505.7500 378765.8400 346053.8800 429919.6600 459905.7200 437395.5900 416919.6200 414441.7200 368879.5300 391673 387596.1600 332363.4100 381575.1600 299832.4700 320722.9700 403690.8400 369939.5300 337300.2800 436691.7500 477610.8400 368709.0300 318023.1600 399772.5000 387676.1600 388397.0300 333297.4700 412441.5300 327001.0900 368122.1600 400757.6200 379516.0300 368602.0900 394619.5900 365118.6600 278255.1600 415289.7200 392513.7800 404587.2800 326139.6600 296054.9700 362807.6200 384629.7800 343474.9100 430549.5000 Phosphocreatine Phosphocreatine 113890.2300 125047.4000 181116.1200 138691.2500 236837.3300 142218.8900 231205.3800 217431.3800 204359.7500 155224.3800 100559.1200 277522.1600 85832.2400 331238.4700 108552.6000 103065.7700 223921.3800 185468.3100 183845.0200 128539.6900 195449.0800 292757.7800 164031.3900 201930.5500 95912.4700 31843.3600 106878.5900 96927.4300 135702.7000 168647 269065.5900 181275.1700 97467.4600 206399.9200 196195.0800 173951.6400 120562.6900 56960.5500 148962.1900 146052.9400 68280.8100 226472 276000.9700 53497.0100 339242.7200 138566.8600 190995.2000 27427.9600 140843.9500 157952.2300 95365.6200 168447.3300 188601.3000 164021.3600 141527.5800 218663.8600 77982.6200 427849.6200 253191.8100 144177.8100 174764.7500 178242.3100 Phosphoethanolamine Phosphoethanolamine 17434.7100 38118.6100 56155.8400 23997.1300 21407.5000 52115.7500 22942.2400 16325.5500 38472.1200 32971.3100 14149.8400 67564.3700 67407.2500 19978.6500 1977.3700 20021.6500 98604.4100 18446 20507.7900 17674.6600 57081.3000 42101.3000 12821 62025.7900 32754.2400 26854.6800 23412.5100 19359.7000 4732.3800 15964.6700 22946.4200 30088.1700 32000.9500 48691.6700 21270.8200 45484.4300 15429.7200 49819.3900 64375.4100 32446.0500 23647.6400 21316.2400 85961.3200 17095.0200 70951.2700 18014.7900 58356.0900 57916.6200 35445.0800 23835.2900 15849.4600 47378.0500 44851 28585.4000 31687.1200 31441.4200 18455.9800 74396.4600 66582.5700 26944.5300 14006.9400 20979.7200 Pyridoxamine 5^-phosphate Pyridoxamine 5'-phosphate 51882.3300 37356.7500 34572.8800 69030.7300 25925.4100 63639.4400 122064.6600 32975.5000 2171.2600 52292.4500 2005.5600 25011.2900 35007.3400 30659.9200 1621.4200 3989.5700 110345.2300 55464.9800 24858.6600 49450.8000 2863.8300 11703.2300 16553.3700 72866.8000 1674.3400 64608.7300 36233.8200 19193.1700 12885.1300 12359.7700 1995.1300 13761.7700 14871.8800 43389.4300 6286.4700 15674.6700 15574.5100 10106.3200 50636.7000 21029.7000 3601.5000 9120.5700 43190.9900 26153.1900 4569.5100 3892.9700 5808.9300 48866.7300 50941.2700 61727.4700 44454.0600 5111.5900 54480 11662.4000 7476.6300 Pyruvate Pyruvic acid 6786803.5000 8017704 7150179.5000 7834256 5869102.5000 7025642 6620432.5000 6278302.5000 5246350.5000 8454405 6577483.5000 4748447.5000 7133700 5490769.5000 8417485 8797447 6493022.5000 7634770 5361198.5000 5157731.5000 5550493.5000 6916436 5042454.5000 6501722.5000 8224253.5000 7398734 5565139 5911575.5000 6808293.5000 4942708.5000 6365402 6679045.5000 7278272 9674973 7216338.5000 8467171 9387036 9145871 5307005.5000 4402138.5000 6011962 6890496 5313498.5000 5306667.5000 6181948 5143407.5000 6416062.5000 7571902.5000 7918118.5000 9435893 5401279.5000 6845336 9200427 5456658 4799242.5000 5538204 5688081.5000 5838246.5000 5787435.5000 5919965.5000 6007994.5000 6677953.5000 Quinolinic acid Quinolinic acid 33543.0100 95252.5000 28839.2600 99627.0600 80634.1900 79744.4800 82308.5900 327553.4400 45635.9100 70013.7100 68034.5900 30204.5300 124714.9000 22360.1900 158585.5200 99661.1600 63056.5300 125656.9800 39999.0300 28941.4000 125349.6600 51836.1600 230655.5500 37835.9200 63119.8400 38324.7800 59739.7800 25461.5300 18647.8300 36230.6000 99830.0500 40489.2200 205315.3600 38051.6600 62400.0800 111001.8400 54908.8000 31841.9300 24593.7800 38462.1000 29177.9600 24695.7700 31228.9700 25512.7000 44606.6100 89545.9300 55008.1000 60257.1100 175797.5800 77351.5200 Ribose/Ribulose/Arabinose/Xylose/Xylulose 1797852.8800 1802010.3800 1519570.3800 1882296 1667742 1285682 1728924.6200 1792738.5000 2051833.6200 1406609.6200 1619211.8800 1672081 1781381.8800 1594779.5000 1569093.6200 1452166 1698200.3800 1635639.6200 2009068.6200 1589388.3800 1713486 1815800.8800 1437468.6200 1461109 1741099.6200 1623488.8800 1748644.1200 1543345.8800 1560398.3800 1753326 1651140.5000 1710992.1200 1596788.8800 1661914.6200 1442524 1906717.1200 1648747.8800 1908670.1200 1551083.6200 2234800.2500 1304286.3800 1671918.1200 1613009.3800 1843672.1200 1652907.1200 1643272.1200 1556284.5000 1581268.8800 1356544.3800 1998662.1200 1853285.6200 1390363.1200 1611830.8800 1513239.5000 1775784 1303890 1833706 2077777 2082689 1364466.3800 1797857.6200 1816730.6200 (S)(+)-Allantoin Allantoin 17215.8900 6094.4100 6070.1100 4977.2100 14223.8900 28006.0300 17897.4400 20991.3300 5150.8100 3311.2900 4918 13805.9100 26918.4600 7279.7400 1926.2300 17814.6200 6081.3100 3870.3700 7461.4100 13585.0700 22461.2500 3030.6000 12871.2800 2182.0300 5610.4400 4945.7100 9633 7270.1100 15296.8900 2809.5500 22456.3200 3420.3600 6003.7000 3605.0400 4805.5700 19549.7900 4723.9800 5844.9900 1371.6400 11546.0500 17435.7000 4960.9200 4211.7000 13329.8300 8118.3000 4284.4700 5329.4000 22625.7000 14871.9700 3051.2400 5239.1800 2146.0300 5277.1500 2997.2200 3436.0900 5201.4100 25929.0200 7384.4500 6203.3900 20281.9600 14717.5300 10875.0500 S-Glutathionyl-L-cysteine S-Glutathionyl-cysteine 15149.8000 17991.9700 41392.1800 41583.6400 51219.3700 18998.4400 23793.4700 14415.9400 10486.5800 20044.5300 31896.2900 18331.7800 23607.7000 38911.9200 19983.7400 45768.8500 188705.8300 56071.2900 20084.5100 49724.9000 23242.1100 58630.3000 35003.4200 71458.1600 57446.7800 31412.5500 18212.5500 13799.5200 24117.9300 35912.7300 24040.5100 36736.3300 36155.7500 45068.1900 60599.3000 71827.7000 97837.2200 18574.8700 10440.4300 16423.1000 12236.7600 43777.9600 49060.3800 47317 15722.9200 48353.9200 31378.0500 43651.0800 12959.1900 49142.2600 28609.6200 14361.0500 22153.7800 27685.8400 47841.7900 32560.6500 30182.7900 16857.9700 Sphinganine 1-phosphate Sphinganine 1-phosphate 13862.5900 14925.0200 17930.4900 13371.8000 14818.2800 16991.6100 7350.1100 13341.8300 11013.4800 7275.0900 13688.7800 6407.6000 15174.7500 20295.2800 22645.5200 10973.4500 12245.6700 9129.4600 23600.6200 18656.0300 11755.3700 14169.5200 11553.4800 16904.5200 6902.3700 12762.7500 26168.6600 11823.3400 19033.4100 4891.6400 8516.1700 7147.3700 18980.0100 14738.2400 13788.8600 16429.2000 29458.1700 11794.0800 11984.1500 12419.6400 23586.7800 10617.1300 13685.7200 21986.3500 24825.6600 35777.7600 33258.3200 9123.5500 10905.6600 12342.6800 11519.0800 16423.6000 34339.1700 8485.2300 17124.5500 15116.7700 20373.2500 11180.0200 11610.2800 9211.4500 5017.5300 24586.0600 Sphingosine 1-phosphate Sphingosine 1-phosphate 4049.6600 4442.2000 10288.3500 19108.0500 2659.6000 16657.5800 3932.3300 11234.5200 27827.2700 3481.2500 7035.6300 32378.2700 3427.9500 5218.3500 2471.9100 3601.4200 3401.6200 35475.6400 2716.1300 4742.9200 2713.9700 3180.7400 2486.4000 11717.2600 2090.9900 9066.2700 8651.0400 3064.1100 3368.5200 14398.4900 2569.3300 5090.3500 16770.9900 21614.2500 7886.9500 6053.8500 3986.9200 3866.1400 15098.9800 7300.4100 15776.0500 3999.2000 4439.8000 Succinate Succinic acid 148466.5000 274141.9700 193080.0800 364210.4700 279648.5900 182187.8000 178815.4400 371698.9100 265392.7200 81155.5300 455368.3400 180657.5000 165615.2800 167311.2700 189341.0200 177928.6900 244273.6100 230632.8300 238129.7300 183459.5500 196637.3100 459357.1600 172611.5500 168131.9500 152438.3600 244356.3000 167941 215654.1100 171795.4500 230138.8800 300960.2200 220875.2700 249377.0200 141865.9700 215659.5000 205275.4200 177597.4500 1066928.8800 64816.2400 201676.1100 152037.2300 204315.6400 237602.1400 146951.1400 314047.7800 237080.6400 142765.4700 143964.1400 206398.9500 177486.9200 277228.0900 229242.5200 111774.5600 250213.1200 280006.6900 227636.7300 146685 182415.8900 171491.8600 171718.4500 232111.3900 306940.3400 Tetrahydrofolate THF 2346.6000 5549.0100 2046.6200 2102.0300 1939.1800 1804.6900 1965.5800 Thiocysteine Thiocysteine 7288.0500 3839.7300 Thymidine Thymidine 68958.9600 20956 21517.9200 73580.3400 33677.0300 26780.7800 62615 76381.8700 117553.4600 17109.7200 76921.1300 27608.4700 21474.7300 27178.9100 21876.3200 39663.4600 19760.5600 37072.5500 26305.5600 29830.4000 34678.8400 30682.9400 26255.4600 29976.0800 39704.4400 37305.2900 22025.5600 81174.3400 20036.2200 18372.8000 80155.2000 41718.7500 26980.0100 52045.6000 62685.4900 61352.2100 20860.1700 35576.5200 101625.1600 33392.7900 50100.9500 56152.8900 52378.5000 98286.5400 37934.2000 30993.0400 43930.8500 18432.6400 23566.6300 26606.5500 57603.9100 15701.1400 22869.8200 46715.1100 62218.9000 65640.3100 45014.1700 41096.8600 42996.9900 49170.4800 UDP UDP 699998.6900 743982.8100 672389 780923.6900 828551 586399.5600 627032.2500 686514.5000 944851.6900 336960.3800 810374.8100 721455.5600 581808.9400 720153.5000 584221.9400 586643.5000 481875.4700 840663.5600 724182.9400 674562.9400 697739.5600 610879 720987.5600 406118.5900 656838.5600 820069.5000 875845.8100 742005.2500 777945.5000 879405.2500 761506.5600 488055.5000 583755.6900 462663.5900 506140.7200 549259.3100 644948.5600 680085.8100 626308.6200 757790.5000 694279.4400 570083.0600 633277.4400 709068.3100 763281.5600 842459.9400 423130.4100 655391.2500 635301.5600 606763.1900 873898.5000 668567.8100 538114 767380.5000 807426.5000 891116.9400 808637.6900 492659.7500 831921.6900 633189.7500 728381.8100 790400.3100 UDP-glucose UDP-glucose 27671.5000 13095.8500 9569.5400 29284.1200 2078.8300 16053.9400 1981.7500 28909.0600 1542.2700 15309.9100 15642.9500 19392.7300 3024.6800 11868.8700 1266.9500 12596.6800 UDP-N-acetyl-D-glucosamine UDP-N-acetylglucosamine 59532.5600 Uracil Uracil 45689.9600 43047.7300 22005.6100 33291.1500 41803.2100 38603.6200 42219.8300 61630.0700 18192.7500 19871.3600 31336.5200 22942.4700 14735.0900 60071.9100 22046.9700 23719.2600 25637.2100 48342.3800 29880.8000 17602.7700 19229.9200 45895.5000 41514.4600 38253.8800 23415.8700 36438.1100 34059.5300 45385.1600 36581.0700 32364.2500 21312.2600 18302.9600 30573.6900 30904.3100 32597.5800 39037.4200 44186.4400 12700.6600 25452.2300 27036.5600 30957.7200 55294.4300 26217.8300 21819.8100 27147.8300 32500.8200 52300.4200 27542.0100 23505.4500 48852.5800 31328.7900 29053.4000 28348.8000 30082.9400 30300.6200 29257.8400 21589.2900 23733.5900 32506.6700 31672.6300 24326.1200 25201.7400 Urate Uric acid 2825476 2592585 2829439.7500 1177336.5000 3782017.7500 6282418.5000 4181878.7500 2179875 3233209.2500 18626862 3293888 4355290.5000 6001670.5000 3157553.2500 3644323.2500 4095827 3635757.2500 1684144.8800 1328775.1200 13020700 5112530.5000 3632576 6828586 4554373 4251935.5000 4649085.5000 2520705 1477994.5000 12222620 1265477.8800 5478405 5223304.5000 3868300.7500 2921911.2500 3107890.7500 2339256.2500 4164689 2040222.3800 5425667.5000 1391844 9138020 3631749.2500 4496303.5000 8063204.5000 3293798.7500 1877328.5000 2529014.2500 3799385.2500 3806923.2500 3962476.7500 1557827.3800 2772804 2854035.7500 2466743.7500 1291243.1200 5391930.5000 5256103.5000 5637173.5000 4253614.5000 12947220 2880062 2632793.2500