metabolite_name Nexus_D21_4pos-4 Nexus_D21_4pos-8 Nexus_D21_4pos-15 Nexus_D21_4pos-16 Nexus_D21_4pos-17 Nexus_D21_4pos-19 Nexus_D21_4pos-20 Nexus_D21_4pos-31 Nexus_D21_4pos-32 Nexus_D21_4pos-35 Nexus_D21_4pos-36 Nexus_D21_4pos-38 Nexus_D21_4pos-41 Nexus_D21_4pos-42 Nexus_D21_4pos-44 Nexus_D21_4pos-45 Nexus_T21_4pos-49 Nexus_D21_4pos-51 Nexus_D21_4pos-60 Nexus_D21_4pos-63 Nexus_D21_4pos-64 Nexus_D21_4pos-65 Nexus_D21_4pos-66 Nexus_D21_4pos-67 Nexus_D21_4pos-68 Nexus_D21_4pos-71 Nexus_D21_4pos-72 Nexus_D21_4pos-73 Nexus_D21_4pos-74 Nexus_D21_4pos-75 Nexus_D21_4pos-76 Nexus_D21_4pos-77 Nexus_D21_4pos-78 Nexus_D21_4pos-79 Nexus_D21_4pos-80 Nexus_D21_4pos-82 Nexus_D21_4pos-83 Nexus_D21_4pos-84 Nexus_D21_4pos-85 Nexus_D21_4pos-86 Nexus_D21_4pos-87 Nexus_D21_4pos-88 Nexus_D21_4pos-89 Nexus_D21_4pos-90 Nexus_D21_4pos-91 Nexus_D21_4pos-93 Nexus_D21_4pos-95 Nexus_D21_4pos-96 Nexus_D21_4pos-98 Nexus_T21_4pos-1 Nexus_T21_4pos-2 Nexus_T21_4pos-3 Nexus_T21_4pos-5 Nexus_T21_4pos-6 Nexus_T21_4pos-7 Nexus_T21_4pos-9 Nexus_T21_4pos-10 Nexus_T21_4pos-11 Nexus_T21_4pos-12 Nexus_T21_4pos-13 Nexus_T21_4pos-14 Nexus_T21_4pos-18 Nexus_T21_4pos-21 Nexus_T21_4pos-22 Nexus_T21_4pos-23 Nexus_T21_4pos-24 Nexus_T21_4pos-25 Nexus_T21_4pos-26 Nexus_T21_4pos-27 Nexus_T21_4pos-28 Nexus_T21_4pos-29 Nexus_T21_4pos-30 Nexus_T21_4pos-33 Nexus_T21_4pos-34 Nexus_T21_4pos-37 Nexus_T21_4pos-39 Nexus_T21_4pos-40 Nexus_T21_4pos-43 Nexus_T21_4pos-46 Nexus_T21_4pos-47 Nexus_T21_4pos-48 Nexus_T21_4pos-50 Nexus_T21_4pos-52 Nexus_T21_4pos-53 Nexus_T21_4pos-54 Nexus_T21_4pos-55 Nexus_T21_4pos-56 Nexus_T21_4pos-57 Nexus_T21_4pos-58 Nexus_T21_4pos-59 Nexus_T21_4pos-61 Nexus_T21_4pos-62 Nexus_T21_4pos-69 Nexus_T21_4pos-70 Nexus_T21_4pos-81 Nexus_T21_4pos-92 Nexus_T21_4pos-94 Nexus_T21_4pos-97 L-Alanine 13871950.00 10596360.00 14716940.00 10596530.00 16564880.00 20192420.00 15668140.00 24625910.00 15931630.00 24018710.00 25799620.00 24939820.00 15550180.00 21782630.00 18382350.00 15348790.00 16861900.00 22499570.00 30287200.00 21478950.00 23792520.00 17369340.00 9065835.00 18644600.00 20856810.00 21002430.00 21931820.00 28212080.00 17640680.00 28251090.00 17957840.00 19126930.00 25421590.00 25286520.00 24584530.00 18087910.00 19231890.00 21426740.00 16470690.00 15734170.00 21367340.00 15676480.00 14085380.00 20133920.00 18641070.00 11881740.00 24043050.00 20285300.00 22519610.00 26245770.00 18150700.00 16613840.00 26705930.00 22452770.00 16706670.00 19504790.00 18572200.00 17626710.00 13748840.00 11464200.00 22643460.00 25148340.00 19359090.00 18872440.00 47099280.00 20290310.00 17513760.00 18285810.00 17526980.00 11824820.00 17490290.00 16674510.00 15481540.00 18031730.00 22045050.00 20410860.00 21963220.00 14100000.00 16754450.00 17514880.00 17352880.00 22854120.00 20901360.00 14613460.00 20176690.00 23810660.00 18689800.00 23033720.00 16478700.00 14514620.00 16749680.00 19168720.00 26259490.00 14068040.00 24176540.00 10435190.00 19868390.00 27589310.00 L-arginine 2504206.00 1249671.00 2258545.00 1676463.00 1682432.00 2148875.00 2858449.00 3546060.00 3562263.00 3984498.00 3705917.00 5494884.00 3338318.00 3978037.00 3778125.00 2481823.00 4407454.00 3435504.00 2418455.00 2829746.00 3735713.00 4347680.00 3114935.00 4932426.00 3111854.00 2885558.00 3090875.00 2675741.00 3001229.00 2454666.00 2432449.00 2149289.00 2009946.00 3232453.00 2577943.00 3104342.00 4017453.00 3287370.00 2326095.00 3290691.00 7369814.00 3568276.00 4005897.00 2819841.00 2592671.00 3067235.00 3190433.00 5187135.00 1396334.00 3975600.00 1577372.00 4089260.00 4952646.00 4029435.00 3131113.00 2474432.00 1967762.00 4661634.00 1786622.00 1999248.00 3408802.00 3374841.00 3333344.00 2461584.00 7174210.00 2335209.00 2341911.00 2894876.00 3159680.00 2028727.00 2428380.00 3199249.00 2182453.00 2572804.00 2766463.00 1532455.00 5913690.00 3706819.00 3512872.00 4851504.00 4314820.00 2126371.00 2956418.00 2469088.00 2031500.00 5897680.00 4166182.00 5608086.00 2823871.00 2781387.00 4160131.00 3283512.00 4940824.00 1569585.00 5219676.00 3128748.00 3498829.00 1480553.00 L-asparagine 692714.50 539184.60 573677.90 495420.40 865374.30 532913.80 690626.80 954798.70 611908.50 882959.80 1205906.00 848234.00 611622.80 707577.60 787222.90 605749.50 803925.00 565908.60 862783.80 631444.80 722110.40 769814.80 584852.40 651417.60 589150.40 804152.50 943506.80 882232.80 1010875.00 796670.80 667396.90 669100.60 688073.00 968790.10 846605.30 912542.70 873006.30 522346.80 571232.00 516330.80 1386302.00 813731.70 672320.80 734556.10 469459.10 687522.70 644874.80 1010248.00 892823.50 845986.80 794340.70 1363300.00 1139321.00 1158564.00 725754.20 783548.20 773813.10 626610.10 659055.10 565750.90 672886.80 687287.40 778765.50 691397.90 1453669.00 650938.20 533967.60 682711.60 649396.80 878421.20 869368.30 595401.30 629886.80 638584.60 956894.50 775239.50 929156.30 683398.60 680042.90 766355.30 694995.40 867460.80 773522.80 543783.60 557890.80 1737532.00 745221.70 1307480.00 580302.20 694430.80 1050438.00 686703.80 915853.80 563274.90 987155.20 725376.30 585468.20 1043387.00 L-Aspartate 108990.50 47753.64 57532.38 57757.83 244585.80 62746.36 51928.14 73289.19 107669.30 54819.11 72892.29 49495.75 40369.16 69336.98 89396.05 108305.40 99421.29 73235.00 78854.28 89523.69 86375.45 114709.80 65560.49 116605.00 96570.52 98513.02 105662.10 81020.90 187004.30 45164.34 82071.41 97738.82 66877.21 105769.90 59069.84 131569.30 53865.69 57718.50 47346.21 43534.46 104654.20 107085.40 68091.84 78795.48 88155.95 71650.06 80790.05 89840.41 96099.59 109119.70 102948.40 171000.30 70765.23 38382.79 49240.27 72608.59 98262.78 107862.70 90337.66 64248.97 66724.58 111416.10 55532.62 80631.88 129610.50 41720.63 45863.73 29058.80 74417.54 38997.82 24102.42 46965.25 65038.95 62853.21 105985.10 128557.00 65655.24 77064.31 48178.61 105765.20 77621.09 107318.30 46712.40 75203.07 79347.65 65908.47 152198.30 56155.74 61392.61 61093.61 79931.43 144928.70 38194.64 93129.22 70348.46 121192.50 53529.97 45349.37 L-cysteine 1294350.00 1966433.00 1422775.00 2130414.00 2375617.00 2033950.00 3427759.00 1876381.00 1785051.00 2642156.00 1539625.00 1293614.00 1422816.00 2918387.00 2224110.00 2792656.00 846177.40 1147238.00 1711005.00 2274206.00 2798445.00 2117314.00 1774297.00 2296008.00 2043933.00 1147473.00 1537965.00 1423554.00 1997336.00 1657301.00 1543009.00 2232684.00 1976510.00 345433.40 1340646.00 1717149.00 1833037.00 1659162.00 1566852.00 1485058.00 2076054.00 1538771.00 2233176.00 1170147.00 1610643.00 1315288.00 1535436.00 1229475.00 1667863.00 1260806.00 854354.80 1446521.00 2118331.00 1156082.00 1258109.00 2440743.00 1758767.00 1882476.00 1703691.00 1405194.00 1803670.00 1624389.00 2295399.00 1804107.00 2357176.00 2063668.00 1949279.00 1888769.00 1904014.00 1654129.00 1879034.00 220912.50 1587919.00 1484923.00 1900592.00 1968016.00 1923332.00 1598763.00 2093886.00 1808464.00 1462932.00 1623292.00 2040663.00 2065205.00 1757343.00 1598378.00 1382624.00 2095669.00 1306130.00 1464947.00 2056730.00 869974.20 2008138.00 2063936.00 1510486.00 1361146.00 1324886.00 1865703.00 L-glutamate 2916207.00 1294597.00 981015.90 860107.20 4254792.00 2802312.00 3812456.00 1338503.00 2204767.00 1728628.00 934499.80 891733.60 3280497.00 2621807.00 1691660.00 2897680.00 2847713.00 1925172.00 4007063.00 1502313.00 3441346.00 2487986.00 949866.30 1301052.00 3181885.00 2371019.00 2335073.00 2447080.00 3246920.00 1306098.00 1675173.00 2922692.00 2027763.00 2466900.00 2845776.00 2013442.00 1768407.00 1314818.00 1253784.00 1132658.00 3695164.00 1402231.00 3332039.00 2816503.00 4329904.00 1171186.00 1473758.00 1927255.00 1990589.00 1601310.00 2660004.00 3119438.00 1726466.00 1459652.00 1225939.00 1598947.00 2433447.00 2283586.00 3041947.00 1835975.00 2088132.00 3630675.00 1218548.00 2552258.00 4284906.00 1251886.00 898537.50 1969380.00 1388496.00 899170.70 2841147.00 803537.90 1606450.00 1199412.00 2173888.00 2828139.00 1785557.00 1816914.00 1271246.00 2435791.00 1253302.00 3033572.00 1596077.00 1792335.00 2734235.00 1063236.00 1730425.00 1443606.00 1918180.00 1339837.00 1704163.00 3183635.00 1762152.00 5401488.00 2194796.00 2689590.00 1894452.00 2281755.00 L-glutamine 8079218.00 9861681.00 11714120.00 11463230.00 15533000.00 10357360.00 11067900.00 14118530.00 13776430.00 13023530.00 14235850.00 14727400.00 13848980.00 13567420.00 14529710.00 12018420.00 11629910.00 13763450.00 13981250.00 12733920.00 15250260.00 11074980.00 11592260.00 15066890.00 12838080.00 11081020.00 16267190.00 13330120.00 16405660.00 16294850.00 13963800.00 12174570.00 14198310.00 16457800.00 16069580.00 14358540.00 12283240.00 14249190.00 15572250.00 13101330.00 14667870.00 15551900.00 9756331.00 16041760.00 12451900.00 12564790.00 14940670.00 16161880.00 15883270.00 11688910.00 12835420.00 12834760.00 17861900.00 9637172.00 15085000.00 9847391.00 14749140.00 10813380.00 12109720.00 9967324.00 14439200.00 13060470.00 13249840.00 11356090.00 22959450.00 12015400.00 11396820.00 12586950.00 13073140.00 12722480.00 9845205.00 12226630.00 10526290.00 15578270.00 11991950.00 18330840.00 13771130.00 9243995.00 13299830.00 16734570.00 10300420.00 14287570.00 13326920.00 11565420.00 10699660.00 16677500.00 17108300.00 14870570.00 13342300.00 11811310.00 15339380.00 12197470.00 14360540.00 12683370.00 11463640.00 16533280.00 10776080.00 15143130.00 L-histidine 3606578.00 3028937.00 3370561.00 2318562.00 3933698.00 3089099.00 2931602.00 2694664.00 3543112.00 6517890.00 3527370.00 3819151.00 3087530.00 2770575.00 3942740.00 2359349.00 3054614.00 2789174.00 3099476.00 2779295.00 3115014.00 3716776.00 2251095.00 2734570.00 2921525.00 2444785.00 3761871.00 4026420.00 3441530.00 3177433.00 3493407.00 3483379.00 3137315.00 4043246.00 3652601.00 9777071.00 3547476.00 3128814.00 6395032.00 3101716.00 4247742.00 3492379.00 2802822.00 3724680.00 2751891.00 3610560.00 3296184.00 3221139.00 3103655.00 4043068.00 2367467.00 4208538.00 3610367.00 3773134.00 3789426.00 3297227.00 3455725.00 2998254.00 2552106.00 2923292.00 2488435.00 3364884.00 2895111.00 2523497.00 9945071.00 2920704.00 2935995.00 2875668.00 3704879.00 2845992.00 5802716.00 3952246.00 2349393.00 2359946.00 3845197.00 3777688.00 3212548.00 2454663.00 2639379.00 3264647.00 3213351.00 3948661.00 3008034.00 2124268.00 3678569.00 3345287.00 6370174.00 3400402.00 2906958.00 3081071.00 3643021.00 2418192.00 3220356.00 2749576.00 4073972.00 3200662.00 3086969.00 3020176.00 L-leucine 243848400.00 145307300.00 184750600.00 189987100.00 320431200.00 425065200.00 311800200.00 206703600.00 271872900.00 444576200.00 199788800.00 260821900.00 198807300.00 224065000.00 268378500.00 209533700.00 237466200.00 301926800.00 383709500.00 124756700.00 187435200.00 229250700.00 191032400.00 289126900.00 311962600.00 341150800.00 513413600.00 287160100.00 335506400.00 241771600.00 248195700.00 268911600.00 291476200.00 419196200.00 463356300.00 201563400.00 314899100.00 236148700.00 223905600.00 260699500.00 496131400.00 294439300.00 248603800.00 254399900.00 302245700.00 186994000.00 326167700.00 183467600.00 195533700.00 224254500.00 274583300.00 231935000.00 322880700.00 364712400.00 221870000.00 224269700.00 230999800.00 326465200.00 181147300.00 150119900.00 209426000.00 328764600.00 201252300.00 264849800.00 237883700.00 109752900.00 201856800.00 331430600.00 159643300.00 238876000.00 293554100.00 206858200.00 140433900.00 168801800.00 290203700.00 224196100.00 205687800.00 233173200.00 185412300.00 410102400.00 289666900.00 222626600.00 214711700.00 190473800.00 249805600.00 298229900.00 189921000.00 385606700.00 174028600.00 278643900.00 410289900.00 173568600.00 325870800.00 234849700.00 466379000.00 173905800.00 384195400.00 209361700.00 L-lysine 12364900.00 6107354.00 9405009.00 8586224.00 15054330.00 12753010.00 13537740.00 15711900.00 13106100.00 18283440.00 14327700.00 15315090.00 10561620.00 13343860.00 14903320.00 8861175.00 13524940.00 13234170.00 15642320.00 8830805.00 18560630.00 14629570.00 7159108.00 11170980.00 8778103.00 13997600.00 14513110.00 14957220.00 11009000.00 11868110.00 11198750.00 12706440.00 13710050.00 15960090.00 14586960.00 9690330.00 20376040.00 9592883.00 12769570.00 10979480.00 21062180.00 13674820.00 12563550.00 10141100.00 9910291.00 10238470.00 12861840.00 11950780.00 8176890.00 10893540.00 11794590.00 9310452.00 15491580.00 15011120.00 10530040.00 10354650.00 11068040.00 14032250.00 9254309.00 7807296.00 10702360.00 15808360.00 11177530.00 13272630.00 13750490.00 7915372.00 10321520.00 12233780.00 9926247.00 8548581.00 12687260.00 12098920.00 7077828.00 11420840.00 10847980.00 7791318.00 11800140.00 11167900.00 12069040.00 21016010.00 16104230.00 13530880.00 11582910.00 8286404.00 14752270.00 14855910.00 10773900.00 16409480.00 7668664.00 8630543.00 15457380.00 13070840.00 12663070.00 8455433.00 16878540.00 8315318.00 13441500.00 8782489.00 L-methionine 14578520.00 8449848.00 12134930.00 8605615.00 19494080.00 14259250.00 12759320.00 19004610.00 14451910.00 25861380.00 14265490.00 18779790.00 15278130.00 14047860.00 15561650.00 14086880.00 14107260.00 13810300.00 28043070.00 9320439.00 17558490.00 13493730.00 7328910.00 16249450.00 15413560.00 24591900.00 23278260.00 21265520.00 13271210.00 13668720.00 15076350.00 14143100.00 20343250.00 27260290.00 20130390.00 12914620.00 20072120.00 11392030.00 8094892.00 11869160.00 44729510.00 22842440.00 12148180.00 17375480.00 12621610.00 10130610.00 18232320.00 11993120.00 10022630.00 19782810.00 13468000.00 17602090.00 25906590.00 24603970.00 11561120.00 14783430.00 13396580.00 16656330.00 9540047.00 6343666.00 10708960.00 17126630.00 11365030.00 13603660.00 19383640.00 10320760.00 10503090.00 14161860.00 8478403.00 11036930.00 18921990.00 10369910.00 8453745.00 10447300.00 18864940.00 12671280.00 12703650.00 9878638.00 12365680.00 26355620.00 19143230.00 11614100.00 15389230.00 8971025.00 13220770.00 24574360.00 12991160.00 26937390.00 8574793.00 8753096.00 18616500.00 8967921.00 19196420.00 7945866.00 40595190.00 11896450.00 18233190.00 8597855.00 L-phenylalanine 42205050.00 27719620.00 41340150.00 36174450.00 46743120.00 54857360.00 49729680.00 36300810.00 48462670.00 68470060.00 62628560.00 48394830.00 35611630.00 42951490.00 53108190.00 34816070.00 43237600.00 44254050.00 49030000.00 28976890.00 46114380.00 47587410.00 30626370.00 45109160.00 48501310.00 46946590.00 58579250.00 59266910.00 49041010.00 45041070.00 48404060.00 43843150.00 44568120.00 64317940.00 58284240.00 58350420.00 49797640.00 44115670.00 35370330.00 44095870.00 66254420.00 54218480.00 41093140.00 44693100.00 44601970.00 43214490.00 50774890.00 46065080.00 42928570.00 60206300.00 50888090.00 54357050.00 59207500.00 60245510.00 41204180.00 41772040.00 45085110.00 49202550.00 26571390.00 28489780.00 39050270.00 36061520.00 41610510.00 41863780.00 43747000.00 23158770.00 42472960.00 58760780.00 33297550.00 50721730.00 49986630.00 41104540.00 45273540.00 42780700.00 42641160.00 41256780.00 37465980.00 41570240.00 42037780.00 55782290.00 59669850.00 44724810.00 70769280.00 40069450.00 52397840.00 47925500.00 43696530.00 66655480.00 45676260.00 40823130.00 55568620.00 33742700.00 46149080.00 37926490.00 58147680.00 38309530.00 65830080.00 39896650.00 L-proline 160579100.00 121360400.00 186665300.00 120252900.00 298869500.00 255897000.00 161812500.00 302750000.00 254535800.00 312184500.00 218024900.00 191754200.00 169157400.00 230619900.00 199525800.00 138873300.00 252310700.00 283412100.00 341724700.00 142933500.00 222731500.00 164176000.00 84254740.00 182565100.00 291961000.00 288837600.00 327534400.00 296750300.00 206738400.00 223457100.00 195493300.00 215854200.00 314861800.00 307811500.00 303649200.00 196798000.00 198198100.00 235622800.00 188347600.00 143254700.00 276654200.00 194974500.00 148263900.00 183628500.00 227179900.00 116093100.00 290147500.00 162289400.00 194445600.00 377659800.00 220660800.00 178449800.00 284330800.00 361264100.00 159543400.00 171463300.00 259872100.00 219437200.00 90249060.00 97867620.00 239252900.00 260266800.00 248380100.00 221955200.00 555085800.00 144687500.00 166361500.00 391892800.00 146356800.00 115106400.00 322183700.00 174510000.00 121042100.00 145085000.00 332145000.00 301784800.00 203283800.00 182145500.00 124799800.00 201936400.00 203387800.00 261896400.00 147962800.00 113748800.00 134014400.00 201480900.00 132540400.00 365096300.00 168776500.00 141003500.00 213306700.00 183058500.00 217700600.00 104176000.00 358185500.00 93363540.00 276811000.00 228802000.00 L-serine 1037942.00 1001600.00 665672.70 857349.60 1578010.00 916322.70 729147.70 1215112.00 986415.50 979920.60 1347461.00 1195455.00 1309316.00 1408381.00 1393898.00 932441.90 1059739.00 861886.50 960650.20 738762.10 1225676.00 1124766.00 1032638.00 881832.80 982244.20 1331658.00 1335870.00 1251055.00 1197722.00 1286843.00 1462014.00 1192319.00 1413721.00 1635757.00 1132294.00 1218120.00 1053564.00 1143487.00 1180697.00 793018.70 1876166.00 1368076.00 1221404.00 1414407.00 807877.00 842364.00 983204.40 1090636.00 1063612.00 1194971.00 1204510.00 1308340.00 1712622.00 911168.20 1445549.00 922109.80 1422410.00 811798.20 800722.30 633119.10 870214.60 897452.50 892457.20 787795.20 1832619.00 719601.70 629342.60 811246.20 754878.20 769394.80 1185648.00 721907.10 749587.20 802632.80 1141974.00 1398886.00 1138754.00 726997.50 868116.10 1040061.00 911777.20 1063146.00 1030875.00 831179.40 785042.40 1438892.00 1231439.00 1178503.00 810106.30 658182.90 1194583.00 963782.20 1141922.00 948294.20 1562684.00 941255.20 578769.80 912499.90 L-threonine 3592491.00 3942689.00 3310224.00 1746275.00 5751892.00 3546046.00 2471068.00 5432026.00 4211606.00 6113790.00 6479850.00 5377298.00 3175593.00 4255856.00 4956994.00 3659719.00 4133168.00 3557436.00 5011254.00 3563434.00 5182794.00 4657958.00 2145113.00 3429128.00 3223972.00 4689260.00 6942266.00 4303132.00 3967119.00 4076016.00 3445093.00 4010760.00 4623446.00 4245272.00 4476257.00 3055586.00 6587424.00 4351008.00 4696234.00 3317274.00 6538102.00 3928160.00 3580337.00 4950692.00 3741855.00 2664256.00 3767219.00 3687238.00 2761018.00 4393866.00 4810258.00 3292344.00 5817480.00 4953232.00 4370312.00 3736413.00 4531942.00 4098883.00 3207242.00 2264888.00 4091571.00 4505981.00 3322029.00 4141691.00 9253484.00 2291254.00 3168949.00 3579874.00 2989730.00 2665733.00 3310955.00 3341782.00 2361913.00 2920145.00 4451018.00 4058380.00 4649812.00 3376230.00 3233930.00 5089880.00 4008205.00 4337290.00 3542769.00 2344605.00 2850870.00 5196308.00 2713560.00 6663734.00 2358921.00 3122879.00 5511906.00 3835158.00 4685086.00 2545421.00 6636106.00 2500664.00 4297907.00 3114659.00 L-tryptophan 28089930.00 32774810.00 23411690.00 35069930.00 29145940.00 25548360.00 37408630.00 26578090.00 32715140.00 21232860.00 44808040.00 35293180.00 35613810.00 33295720.00 26381870.00 36649280.00 37567160.00 40181920.00 29613470.00 22950580.00 26416060.00 26614760.00 47894770.00 24096760.00 36887210.00 26513970.00 46257400.00 49712440.00 46528320.00 39241600.00 30709600.00 33005770.00 42290640.00 44884300.00 42766750.00 54983180.00 30755240.00 24929240.00 30327000.00 38653730.00 31903170.00 62735730.00 35643420.00 41183000.00 28618690.00 22420590.00 45198040.00 35008480.00 20045770.00 36671940.00 39651580.00 23788950.00 40467300.00 37100910.00 40992900.00 21790690.00 32735080.00 35008780.00 24277140.00 16233660.00 19650150.00 29893710.00 39833790.00 21810600.00 26954150.00 15740340.00 30262700.00 30285790.00 28458180.00 27504500.00 25917310.00 39362540.00 27700240.00 30998370.00 35204660.00 26630500.00 30764570.00 25705670.00 35428960.00 26335140.00 34310750.00 36285510.00 38295540.00 24175790.00 24208990.00 36496240.00 40425600.00 29456680.00 55689200.00 25518010.00 34726840.00 40558280.00 39445740.00 35848310.00 37175060.00 31226210.00 25559890.00 34748980.00 L-tyrosine 16429410.00 7276588.00 14942170.00 11139320.00 16493520.00 28580190.00 18318260.00 16558360.00 16997750.00 27996210.00 10155970.00 14957350.00 15964750.00 17523150.00 20418110.00 15846740.00 18277840.00 19955790.00 21279980.00 9599653.00 22297290.00 21408090.00 10617140.00 20922270.00 26183460.00 34165180.00 36022970.00 32634890.00 16477760.00 20642890.00 24646320.00 17067120.00 22054340.00 26394550.00 27368120.00 18487820.00 32256450.00 19867930.00 13399710.00 19931150.00 41728000.00 24593470.00 19264470.00 20105300.00 14536350.00 11560430.00 23950380.00 22594450.00 14525930.00 19221780.00 16291760.00 19231900.00 24903550.00 30680510.00 16595440.00 18156650.00 20347340.00 21369770.00 6755308.00 10203190.00 15500010.00 17089730.00 15010450.00 19315020.00 18999340.00 10702440.00 16613870.00 35581300.00 10290830.00 17597830.00 29188940.00 22521610.00 10581240.00 11365480.00 18320520.00 11936470.00 15453060.00 14207950.00 15032870.00 28160620.00 28923100.00 18687790.00 19288290.00 10935220.00 15839870.00 18615110.00 14129510.00 28534220.00 15380000.00 18747880.00 24879420.00 13770780.00 20511030.00 10890630.00 36041540.00 10596340.00 30372600.00 12963750.00 L-valine 244649700.00 163059800.00 217595300.00 177806600.00 283480400.00 387243100.00 264499600.00 297956700.00 270576100.00 412705200.00 202954300.00 205517600.00 213123900.00 203775400.00 248310500.00 220600200.00 213540500.00 250572000.00 298393800.00 170863500.00 241576100.00 255418300.00 185454400.00 236179400.00 261628200.00 333583700.00 371287000.00 273526100.00 274735500.00 241076200.00 219589900.00 321333000.00 292844700.00 341531000.00 357655000.00 189390900.00 306553600.00 315994100.00 267544200.00 240358100.00 423100800.00 329176700.00 207895600.00 270645200.00 312185200.00 179033200.00 301244100.00 200085100.00 207904300.00 283377800.00 242964700.00 209639900.00 305974600.00 314804100.00 270163900.00 241631800.00 267813100.00 263609900.00 188222100.00 179800400.00 230209600.00 268737100.00 201257600.00 290112600.00 290353200.00 186991700.00 211714700.00 282941500.00 192493000.00 213192100.00 326235900.00 218277000.00 171855900.00 173141400.00 300759800.00 214271800.00 235069800.00 240711400.00 197337000.00 342332600.00 276039300.00 255215900.00 202101200.00 175594500.00 274901600.00 283973500.00 193494600.00 358071900.00 211639800.00 212166800.00 306013800.00 206159500.00 248077200.00 216332200.00 432944000.00 169362000.00 362884900.00 250901800.00 L-cystine 601777.40 327828.90 357267.80 391233.70 296835.50 390005.20 815844.30 387357.70 203114.50 710614.10 715168.80 809071.20 1057313.00 662868.80 993453.30 742308.20 68256.73 148086.40 173858.50 392517.80 902502.30 423296.50 216037.50 560766.10 505612.50 255612.20 366775.30 285001.20 494588.40 425956.80 318268.10 561316.20 341074.40 474682.80 673887.00 744821.20 901843.20 284337.70 432098.10 315176.50 472213.50 304481.00 756559.80 280584.80 221726.80 231553.90 465834.10 445064.00 439773.20 187940.60 324460.30 492004.40 415097.50 463810.30 573593.20 486645.60 273204.00 464822.00 738393.20 241207.00 624556.90 244355.40 325610.20 591532.00 305606.40 429772.10 468951.50 567883.10 393418.60 586917.10 475594.80 768318.70 164864.60 198900.40 525281.80 713617.50 687549.20 607770.90 599726.30 661354.70 540369.30 158315.40 320947.20 470596.30 579590.40 423973.60 256173.10 368219.90 289954.30 214479.00 334035.80 440840.20 590614.60 603418.10 563104.10 549301.60 362686.90 467411.80 Adenine 1145944.00 1247534.00 1365449.00 1451364.00 1177732.00 1291136.00 1248696.00 1089306.00 1326547.00 1307214.00 1307472.00 1322585.00 1208075.00 1374322.00 1321502.00 1176731.00 1251218.00 1322348.00 1332779.00 1134619.00 1306609.00 1311453.00 1483207.00 1399512.00 1407812.00 1250930.00 1335912.00 1374765.00 1372021.00 1436779.00 1325148.00 1350169.00 1363478.00 1374860.00 1284976.00 1469986.00 1257072.00 1310672.00 1309357.00 1519521.00 1333285.00 1437441.00 1352690.00 1321631.00 1406586.00 1329712.00 1367698.00 1371039.00 1409357.00 1274796.00 1105563.00 1220080.00 1272694.00 1280205.00 1120938.00 1228432.00 1337463.00 1162014.00 1309591.00 1208215.00 1356141.00 1188723.00 1323908.00 1214106.00 1193676.00 717199.20 1033386.00 1229557.00 1241940.00 1135119.00 1157615.00 1435298.00 1059046.00 1433262.00 1354964.00 1243310.00 1336778.00 1152848.00 1287604.00 1167875.00 1327262.00 1521609.00 1375649.00 1265635.00 1311249.00 1406991.00 1402536.00 1388786.00 1121427.00 1314659.00 1170656.00 1347820.00 1382390.00 1365786.00 1444389.00 1316415.00 1425020.00 1508438.00 Uracil 129632.50 136382.70 180226.00 252789.60 311409.30 154118.20 168791.80 184314.80 115408.30 172146.00 223468.90 105542.90 198377.30 157536.20 281432.80 229757.40 207457.20 189206.40 143325.80 235619.00 262615.50 259475.00 205426.90 119386.90 139187.90 157746.60 162403.70 304129.20 271654.40 205508.90 248182.50 247013.40 186036.70 209257.40 213303.70 243615.30 140117.00 166978.10 200265.60 160406.60 239115.20 230606.30 172195.10 218396.70 181369.80 223416.00 145744.20 184920.80 187805.60 134467.60 152927.50 399844.50 116678.10 208194.60 190676.70 214471.70 203316.50 144626.60 230954.10 345784.00 187872.60 206945.80 189147.10 95907.84 219178.50 173610.00 140590.60 160474.60 284698.90 149629.90 237039.70 169786.70 258392.90 233526.40 200037.00 204118.30 137838.90 208074.30 198891.40 115973.90 223034.60 238043.90 235891.20 366889.30 306730.20 256638.80 317839.20 263927.60 209812.80 292867.80 326564.30 392806.10 222850.70 317867.00 150248.60 263326.80 223927.90 229142.30 Inosine 139525.50 314326.20 94599.59 121639.90 18070990.00 70416.59 46441.79 145160.40 147722.00 139869.50 199436.30 93992.90 80566.65 188530.90 117248.30 223743.90 139794.10 154450.50 136195.40 459584.90 188366.60 230047.40 188119.40 74368.99 13928.20 120193.60 84875.58 131025.00 38358.89 81124.52 67145.37 128389.80 140519.40 66016.64 239792.60 98232.99 53422.68 25006.05 147124.10 15047.21 67648.15 149089.40 277155.50 103345.90 141129.10 153519.60 45388.26 19399.44 19194.46 82285.23 363191.00 60597.57 146001.20 120983.20 62074.32 116645.30 160539.30 NA 90360.00 78736.75 157524.20 130501.70 19773.23 59989.64 46071.63 110854.90 11275.33 13198.01 37433.31 68649.81 77276.25 49559.71 110804.80 419477.40 44061.56 10944030.00 86487.23 96010.19 35457.56 9177.39 NA 62396.86 118616.30 115458.10 119233.70 30034.85 66234.40 56009.28 48506.67 109733.90 35996.94 745516.70 62011.79 80954.05 55482.07 51872.80 17928.89 NA Hypoxanthine 5316608.00 4639299.00 3586389.00 3136013.00 136387400.00 4977212.00 2095318.00 3728629.00 2676315.00 2048132.00 3322487.00 2305738.00 5393866.00 4540886.00 3979387.00 5023451.00 3815797.00 3059837.00 6021344.00 7567250.00 4101879.00 12411840.00 11257800.00 3669535.00 4391424.00 10695880.00 7759680.00 11823820.00 8340066.00 8988443.00 7296066.00 10175790.00 9930125.00 9089925.00 13894440.00 7371542.00 3222997.00 3925973.00 4416678.00 4470432.00 8690561.00 6620630.00 7492748.00 10899870.00 3431563.00 3438560.00 6767292.00 3018172.00 5700520.00 4272172.00 23618510.00 7307752.00 2721836.00 4381536.00 3864659.00 3880024.00 7199412.00 3821863.00 3953974.00 3820377.00 9016977.00 5818634.00 2509090.00 2389510.00 5150188.00 3152365.00 3363897.00 3639234.00 3521986.00 3478827.00 2057873.00 3995454.00 3248219.00 15970700.00 4668626.00 90380900.00 10443780.00 9296189.00 3856388.00 3893601.00 3810831.00 3964220.00 5374914.00 4819548.00 7612918.00 2657977.00 17910540.00 3191870.00 5509848.00 5367076.00 2960601.00 22670210.00 4007914.00 4150318.00 5065612.00 6377002.00 3690549.00 3580689.00 Xanthine 235691.30 158018.00 169544.40 179462.30 704763.30 223019.20 589402.20 237829.10 137775.20 150100.00 194361.00 141064.90 205751.60 209782.70 345987.90 338619.70 179474.50 128553.20 200668.10 296426.80 257496.70 342618.00 297493.80 223240.90 255928.00 482303.70 319193.30 547796.10 421729.70 296236.20 391274.70 387308.80 391307.60 399617.10 604491.20 373494.40 187376.60 247047.50 181022.80 282593.50 415750.20 343586.30 329227.10 427836.10 262971.00 242873.20 344971.20 339059.90 213060.30 243438.40 307475.40 497265.40 153913.60 248604.90 255787.30 199530.20 429686.70 219112.80 330747.20 453616.20 324235.20 285046.30 148493.50 149328.40 232317.10 206511.70 185427.10 213534.50 237069.80 213339.50 209103.80 228329.70 281298.60 268493.80 198051.40 582022.40 394164.10 462069.30 293458.20 303919.30 219281.10 283732.90 374263.50 529924.60 342748.50 265960.90 570836.10 286274.20 277306.20 440813.50 214615.20 672248.60 216134.60 343339.80 333160.30 410048.80 264541.30 228772.20 Allantoate 1019025.00 354938.60 1163040.00 797672.80 1370588.00 989955.90 1166773.00 884276.20 1031682.00 891785.00 607326.60 1119717.00 866774.80 1019151.00 1270563.00 1147954.00 726133.80 1274815.00 1907065.00 741644.50 1164170.00 732764.70 494917.70 1212475.00 1214181.00 996154.00 1211511.00 1126391.00 847588.50 1421690.00 1074374.00 1174250.00 1488443.00 1447772.00 1395765.00 880010.10 1243241.00 1034630.00 949400.20 742047.30 1469356.00 1029916.00 1159114.00 1009566.00 946629.60 667884.00 1741054.00 887199.20 1258048.00 995799.90 934120.20 1311199.00 891282.80 678105.00 750779.10 534183.60 1135055.00 762383.50 638072.80 440861.90 752624.20 1209016.00 986412.70 745339.20 1480033.00 485829.90 728938.30 934916.40 800336.30 569143.40 560200.30 720532.60 451016.20 649242.40 1055532.00 1086127.00 914137.80 465662.20 797999.50 1350048.00 963953.70 1183817.00 618981.50 495100.50 860879.80 619186.90 967295.90 875871.50 746549.10 617382.60 771489.20 699958.10 880154.00 768249.80 1241170.00 490847.50 893867.00 1156638.00 Pyridoxal 161130.50 105808.10 340094.70 NA 126609.70 173150.10 NA 68417.04 NA 143446.30 178371.30 87078.38 135243.80 NA 141427.60 325806.30 80382.72 84017.21 253070.10 137603.80 55014.21 77374.26 127786.50 62387.75 NA NA 200029.10 72968.00 237925.60 223807.40 83338.65 NA 187586.20 75167.87 80206.41 110295.40 85974.03 122196.90 66510.50 69045.67 109755.90 67379.41 334483.00 176257.40 211366.40 203978.40 129204.80 127002.60 129260.20 112036.00 115819.60 238696.00 164450.70 76873.95 269424.90 491662.30 375196.10 NA NA 337110.20 183978.70 122065.60 191004.10 94916.66 62857.34 NA 86372.84 105258.10 763567.30 256647.20 280590.00 95694.32 296625.80 134536.50 345464.60 395736.50 567866.90 342105.80 198985.60 164102.50 515878.80 467144.60 200129.90 329731.70 118816.90 187883.10 98864.12 130997.70 85882.88 485458.30 104816.90 231051.90 385571.30 126519.70 122560.90 319441.10 147383.90 336289.20 Pyridoxamine phosphate 2002185.00 2161413.00 1627505.00 1943980.00 1835055.00 1875990.00 2419442.00 2155849.00 1973566.00 1745596.00 2754574.00 2264263.00 2412918.00 1932382.00 2051635.00 2290440.00 2400281.00 2714363.00 1426713.00 1628130.00 1677900.00 1824942.00 2265117.00 1257219.00 2281832.00 1682453.00 3005500.00 3823189.00 3147851.00 2786560.00 2200289.00 2448143.00 2663619.00 2993836.00 3674572.00 3405340.00 2311586.00 2315055.00 2265544.00 1999119.00 2556859.00 4123178.00 2308440.00 2315442.00 2302290.00 1425682.00 2650342.00 2410720.00 1526345.00 2286524.00 2317714.00 1724097.00 2329215.00 2655606.00 2664645.00 1627603.00 2507012.00 2312426.00 1741614.00 1427025.00 1144609.00 2544670.00 2192438.00 1664212.00 2240744.00 1504688.00 2026615.00 1998180.00 2162434.00 1910080.00 2138662.00 3014339.00 1994444.00 1758801.00 2421437.00 1744296.00 1944899.00 1610101.00 2365922.00 1775960.00 2029133.00 2252291.00 2106399.00 1587150.00 1605232.00 2186334.00 2414396.00 2333128.00 3519028.00 2040458.00 2373775.00 2470675.00 2310322.00 2173506.00 2356423.00 1960340.00 2021295.00 2050160.00 5-Oxoproline 13337980.00 13284800.00 14889170.00 13667670.00 22967630.00 14404690.00 14466460.00 15291040.00 15040440.00 15655880.00 17522040.00 16007240.00 16602860.00 15708710.00 16282240.00 16793700.00 13394890.00 15915840.00 18281630.00 15303000.00 16908870.00 14094250.00 15150320.00 17200700.00 15937730.00 14492240.00 15814460.00 15756970.00 18924600.00 18430440.00 16894400.00 17012550.00 15909460.00 16718760.00 17974350.00 15583810.00 13848560.00 15140660.00 16261410.00 15874240.00 15381970.00 16024790.00 15388460.00 18890420.00 13533740.00 15321560.00 17439300.00 15606460.00 18339270.00 14215330.00 19281370.00 15870920.00 17584990.00 12566980.00 14685260.00 13952720.00 15737330.00 12726220.00 14187800.00 12472880.00 17455290.00 13855300.00 14919990.00 13496370.00 21015580.00 12338760.00 14192310.00 13365050.00 13805030.00 14748810.00 10390960.00 13045220.00 12335620.00 17458410.00 13938460.00 22053440.00 15985610.00 11615420.00 15136260.00 15535160.00 13787530.00 15801440.00 16274350.00 14861970.00 16392000.00 15222710.00 18311700.00 15059640.00 15019470.00 14618020.00 15696000.00 14835140.00 18292150.00 15801300.00 13686160.00 18277590.00 13545110.00 18873550.00 Cys-Gly 584558.80 1100920.00 888273.90 1104480.00 1495397.00 1378756.00 1176825.00 1136760.00 1018574.00 1390561.00 657006.20 446815.40 565304.20 1288518.00 801304.30 1352218.00 688481.40 519880.00 916406.80 1370334.00 732491.90 918664.00 1231318.00 1357716.00 975480.00 642636.10 785280.00 1193517.00 1129314.00 971276.00 925742.70 1352038.00 1173658.00 223287.00 627127.20 609488.20 708253.60 1220889.00 1147148.00 1256479.00 692307.60 1246833.00 1053687.00 635894.90 910863.30 725200.50 1383970.00 414901.00 829273.80 1193375.00 782149.40 775600.60 998595.20 682557.70 766424.80 1803780.00 1304664.00 975786.60 1006267.00 864102.80 759949.30 1131872.00 771904.70 456767.10 901421.80 817933.80 1433214.00 789260.70 1256183.00 743182.30 828912.00 150857.30 1263252.00 752713.50 726314.80 903496.50 1135445.00 913071.70 939086.80 646616.40 1054113.00 1147325.00 966079.30 1174814.00 1160471.00 877248.40 883831.30 969296.50 555587.80 531090.60 664381.90 499797.80 689506.40 849889.30 723529.30 652312.90 841593.30 906006.20 gamma-L-Glutamyl-D-alanine 313568.10 210715.40 349286.70 243633.90 667110.00 442177.80 306150.80 545972.20 430914.60 523871.20 762945.50 473048.20 307924.20 527909.00 391084.00 393136.60 357102.00 597222.40 1198632.00 558104.70 418099.30 427723.70 205167.50 559279.60 545841.90 640620.00 590358.20 848388.30 529104.20 818194.50 440017.10 429008.80 727102.70 635568.90 838361.60 405274.70 395863.60 395967.90 410340.70 359442.50 479722.80 308205.10 301277.70 540744.50 499261.70 253041.90 576337.20 321912.80 662743.30 517688.30 417875.70 476425.10 752811.30 440679.80 353962.10 478237.70 309567.00 314212.50 296593.10 166584.70 570983.70 763839.80 360570.30 323674.80 1153301.00 382173.10 340220.70 344966.60 349832.90 214313.90 327755.40 355298.30 426813.60 504214.00 451913.20 432471.70 616379.70 283901.10 344380.20 323287.10 309827.90 805420.70 550415.80 283531.30 557396.70 667990.20 517555.80 508040.70 537351.40 322930.50 399705.00 429220.50 638591.20 272470.70 572398.90 118653.30 370847.60 510583.70 (5-L-Glutamyl)-L-glutamine 390870.80 271508.20 709946.80 277197.00 710687.30 304675.30 278999.50 470208.40 295881.00 395704.20 316892.70 339321.10 368941.10 342437.90 301010.70 415349.80 424993.00 442069.60 537588.80 431375.20 NA 456658.30 303244.40 567711.80 360986.20 380581.90 652356.00 667708.80 444813.00 573816.20 557724.60 563214.80 597385.80 529504.30 651666.40 256784.80 296658.60 366915.00 494836.90 306334.00 486774.10 350703.80 308332.60 586890.80 394505.30 321777.20 440463.20 392749.70 534485.60 380209.40 416791.20 543043.50 432124.40 322122.40 344773.40 319990.80 359596.80 455569.00 308496.20 230363.30 532112.30 458680.20 367388.00 318168.00 523387.50 455530.50 323592.00 300687.90 418153.10 307307.00 221688.40 275670.40 289419.80 353425.90 427479.50 516367.60 445550.80 311436.30 383711.70 509524.10 275075.70 483897.20 458465.80 472071.70 323681.40 386585.50 341273.60 595296.40 328592.30 486565.10 408541.80 267720.10 436170.00 269621.60 336619.20 292938.30 357455.40 339517.00 L-Homocysteine 666803.30 453123.10 856202.70 631396.20 1778830.00 567026.20 596131.20 1139914.00 570297.90 650447.80 2005936.00 539214.90 924781.80 891961.10 701834.80 723013.40 227585.30 464545.70 956368.20 1495448.00 713969.00 470797.70 340408.70 472932.30 514838.50 474791.80 986351.00 635913.20 692730.60 527244.10 472010.10 1251754.00 422263.20 599152.20 710444.20 340960.30 451842.10 905541.40 990119.30 378781.70 675796.60 610259.40 511770.40 556055.80 1666116.00 523996.30 361353.80 336125.00 448281.80 692860.60 371320.90 477943.80 580337.40 506548.80 450376.50 402735.90 680664.10 249548.30 405226.80 324744.80 686497.80 708741.30 402695.60 576646.10 551200.10 392449.00 519890.20 425167.60 1694157.00 1297420.00 337177.90 346658.70 467645.90 547502.30 480796.70 622179.70 666016.40 418748.80 381737.80 1180698.00 304754.20 438757.50 979575.00 1110531.00 448777.20 326023.80 3513606.00 1068689.00 686671.20 401053.50 436042.40 450546.00 593209.90 262486.00 288194.40 451329.90 418101.30 474862.40 Dimethylglycine 4385714.00 4461802.00 4100425.00 3752535.00 6582740.00 5921030.00 4281220.00 6177762.00 7167998.00 8121956.00 7902950.00 6402664.00 4550102.00 5700192.00 9548861.00 5851788.00 6636000.00 6333314.00 7413812.00 4454072.00 8403336.00 8292864.00 7459888.00 6110022.00 5850690.00 7326858.00 7366604.00 7873542.00 8669904.00 5794020.00 5979730.00 8470385.00 7997622.00 6372550.00 7104798.00 4080364.00 7645092.00 9812395.00 6513746.00 7016142.00 10817660.00 10369240.00 7808990.00 6740174.00 7807258.00 6265800.00 8860029.00 9097895.00 6027210.00 6983924.00 7179850.00 9787321.00 10796060.00 8425401.00 9102834.00 7071720.00 9898339.00 5667756.00 7494074.00 5158490.00 5423924.00 8124578.00 7315166.00 10775440.00 12918140.00 5196552.00 5590878.00 7112214.00 5992624.00 7135968.00 6341724.00 7007124.00 5283058.00 6316044.00 5159270.00 6289448.00 6916594.00 4506872.00 4979882.00 9499777.00 6229546.00 9118853.00 7945118.00 7244478.00 9152399.00 8400435.00 8369636.00 10981130.00 7691198.00 10939000.00 11084320.00 5680124.00 7546306.00 5574524.00 8375786.00 5885608.00 6905732.00 6858412.00 Sarcosine 13900000.00 10600000.00 14700000.00 10600000.00 16600000.00 20200000.00 15700000.00 24600000.00 15900000.00 24000000.00 25800000.00 24900000.00 15600000.00 21800000.00 18400000.00 15300000.00 16900000.00 22500000.00 30300000.00 21500000.00 23800000.00 17400000.00 9065835.00 18600000.00 20900000.00 21000000.00 21900000.00 28200000.00 17600000.00 28300000.00 18000000.00 19100000.00 25400000.00 25300000.00 24600000.00 18100000.00 19200000.00 21400000.00 16500000.00 15700000.00 21400000.00 15700000.00 14100000.00 20100000.00 18600000.00 11900000.00 24000000.00 20300000.00 22500000.00 26200000.00 18200000.00 16600000.00 26700000.00 22500000.00 16700000.00 19500000.00 18600000.00 17600000.00 13700000.00 11500000.00 22600000.00 25100000.00 19400000.00 18900000.00 47100000.00 20300000.00 17500000.00 18300000.00 17500000.00 11800000.00 17500000.00 16700000.00 15500000.00 18000000.00 22000000.00 20400000.00 22000000.00 14100000.00 16800000.00 17500000.00 17400000.00 22900000.00 20900000.00 14600000.00 20200000.00 23800000.00 18700000.00 23000000.00 16500000.00 14500000.00 16700000.00 19200000.00 26300000.00 14100000.00 24200000.00 10400000.00 19900000.00 27600000.00 Ornithine 3219473.00 837874.20 3273245.00 2151146.00 4081381.00 3142162.00 3302694.00 2882653.00 3134989.00 3301234.00 2039034.00 3524742.00 2470716.00 2994873.00 4126425.00 3286018.00 1952319.00 3517276.00 5198958.00 1922077.00 3591659.00 2298292.00 986255.70 3063162.00 3238329.00 2792596.00 3174969.00 3318999.00 2099093.00 3735130.00 3028216.00 3743963.00 4065583.00 4120474.00 3618012.00 1931168.00 3784798.00 2700971.00 2719336.00 1737788.00 4451642.00 2954253.00 3193002.00 2523548.00 2534519.00 1828645.00 4890612.00 2252267.00 2951731.00 2526988.00 2590118.00 3857540.00 2239646.00 1944133.00 2168499.00 1609268.00 3564580.00 1858448.00 1662890.00 1166865.00 2048410.00 3779931.00 2528116.00 2322330.00 4812636.00 1397665.00 2187833.00 2394791.00 2477964.00 1663473.00 1694849.00 2201751.00 1095644.00 2017540.00 3275975.00 2961621.00 3017570.00 1383043.00 2541876.00 3866943.00 2688556.00 3226503.00 1736831.00 1292971.00 2372638.00 1846296.00 2643939.00 2630695.00 1753372.00 1777513.00 2225088.00 2020823.00 2588002.00 1844731.00 3214873.00 1243784.00 2780719.00 2884011.00 L-Citrulline 1254364.00 937140.20 2484162.00 1334853.00 1641859.00 1314360.00 802253.80 2342540.00 1466456.00 1694128.00 1019909.00 1276181.00 1265788.00 1415259.00 1763052.00 1821957.00 1780630.00 1169008.00 2010239.00 1077908.00 1614758.00 1980156.00 883296.00 2380142.00 1586174.00 1811146.00 2261468.00 1460040.00 952738.20 1523206.00 1548212.00 1245564.00 1654472.00 2544341.00 1427352.00 1574784.00 2449569.00 1194934.00 1527682.00 1065496.00 1717883.00 1426223.00 1320236.00 1402796.00 1259075.00 1267840.00 1742207.00 1725292.00 1344334.00 1714744.00 1868394.00 1450054.00 2275260.00 1938912.00 2806323.00 1822906.00 2427005.00 3097256.00 1121214.00 1829791.00 1296652.00 1546020.00 1918922.00 1219807.00 3776095.00 1326811.00 1998513.00 1379463.00 2103286.00 1231946.00 1537838.00 2262216.00 833340.30 1343450.00 2750666.00 1593084.00 1594814.00 1912380.00 1506497.00 1657070.00 1490611.00 1398958.00 1687893.00 1663441.00 950814.70 1625576.00 1914905.00 2027697.00 1516020.00 1693347.00 1413058.00 1292360.00 1867207.00 1391687.00 2784478.00 1168527.00 2984811.00 1759734.00 5-Guanidino-2-oxopentanoate 154399.40 63672.20 92979.75 17333.64 NA 175351.10 50595.20 123347.50 223425.00 375874.30 136139.10 NA 74311.58 64016.59 16043.75 45319.94 72379.45 93244.26 102344.20 34615.53 176187.00 64991.24 20718.36 82121.68 156336.50 55861.25 161954.80 54964.01 92696.59 51431.11 125560.40 25971.54 NA 97920.18 60611.18 134870.80 325943.10 103221.00 55021.50 112738.00 84468.01 68360.71 67873.74 131567.90 88700.07 NA 169430.60 35291.62 98899.19 374910.90 88514.50 140818.60 38580.05 169825.30 76983.97 125664.60 82625.05 234290.90 21087.21 42651.05 48203.88 153876.50 199865.60 149650.70 172309.50 78603.12 56650.96 297153.70 117750.60 92781.13 345471.30 184875.80 39583.27 78080.57 249108.60 65064.41 96780.98 1071416.00 33169.11 153002.00 266492.20 50690.23 103885.80 NA 74943.20 169235.20 NA 159667.60 66257.49 20419.17 28224.06 154968.00 92735.52 112292.90 162529.80 NA 457648.30 178143.00 Creatine 88946020.00 49509500.00 38574420.00 36417320.00 38465340.00 59458760.00 68231420.00 22828820.00 100795800.00 105655800.00 37883030.00 75538180.00 70398920.00 83276900.00 152597300.00 33874320.00 135352300.00 46705850.00 58605300.00 59353680.00 130751400.00 178304800.00 86990550.00 41189500.00 59409090.00 116377200.00 85211060.00 141344100.00 162160800.00 80274750.00 92352380.00 105497900.00 97297500.00 124745500.00 43544050.00 127992800.00 97838040.00 64286430.00 70479930.00 26320560.00 179709000.00 141693800.00 71550890.00 111547600.00 120186200.00 49118000.00 137223600.00 102530900.00 120611100.00 127737400.00 108012000.00 149384200.00 122459300.00 155402500.00 99074690.00 110959500.00 146278000.00 128389700.00 45882900.00 104522500.00 69271810.00 74178820.00 103337200.00 124504500.00 111122900.00 91970140.00 30343580.00 91445500.00 97122560.00 62410500.00 157899500.00 104514900.00 132909700.00 33959450.00 153346400.00 44073310.00 113761900.00 134775700.00 103759700.00 238520600.00 125062000.00 157947600.00 86490420.00 117227000.00 48669580.00 145805900.00 100440100.00 139462700.00 126889100.00 54785870.00 185633300.00 168608700.00 42134220.00 159695100.00 161534800.00 74582020.00 118049700.00 108693500.00 Creatinine 52598120.00 47789670.00 104232100.00 66971260.00 93003260.00 89651930.00 93037000.00 76492590.00 65128680.00 100787400.00 64303880.00 74810070.00 81466390.00 75738910.00 73263520.00 73146090.00 34896590.00 67120260.00 83722330.00 80692760.00 56943070.00 44207020.00 26122080.00 96798070.00 67734540.00 21343550.00 48122110.00 48343410.00 27609980.00 48744380.00 54425600.00 62644840.00 32677250.00 40680700.00 64186540.00 37772400.00 97340680.00 44147130.00 75538050.00 53079440.00 33717670.00 46780160.00 84886650.00 49015290.00 69771620.00 58821280.00 61102460.00 54839920.00 36491520.00 34310540.00 22854300.00 17531540.00 38034970.00 34672450.00 33747320.00 35719840.00 33038290.00 36106670.00 99118890.00 21136140.00 50725170.00 75364580.00 60349570.00 82694460.00 45602370.00 51737970.00 79632460.00 47679210.00 59797790.00 52256980.00 25792930.00 56329520.00 38554570.00 82647070.00 40363110.00 114448400.00 52309840.00 63022610.00 51948340.00 41063580.00 46149960.00 75960820.00 61824720.00 48807900.00 74623080.00 50750660.00 46344610.00 42430760.00 46835900.00 54110020.00 25889980.00 37854410.00 74950490.00 59691220.00 39709000.00 35906360.00 49037330.00 54399080.00 4-Acetamidobutanoate 214450.70 218730.40 2488324.00 253621.80 174776.20 671299.80 241539.80 559498.40 264892.10 431741.30 377539.70 440054.20 449464.70 296316.10 273506.30 2946586.00 218235.90 284205.50 400737.20 1007620.00 109959.80 330967.60 307436.60 669661.00 390321.30 169700.20 322809.10 273176.30 270626.20 299989.90 330013.20 293842.90 577581.10 302494.00 396097.50 450347.40 653119.20 334366.80 308841.40 294654.60 624990.60 576621.60 2657186.00 580626.10 398964.90 427467.20 1058224.00 680559.20 267321.30 492264.80 437275.90 362812.40 494007.30 557156.80 357198.90 500169.10 363272.80 341708.50 351622.90 255769.30 373872.40 549388.90 588565.70 627992.10 399109.20 309848.00 1234864.00 256689.00 7715582.00 412819.30 433274.80 318408.80 704152.80 934633.80 3269177.00 616751.90 2668135.00 430297.10 1450461.00 494301.80 3682683.00 524599.20 1141075.00 297804.60 317855.70 1556750.00 637188.80 602725.60 277208.20 973234.20 269856.70 776999.70 1185463.00 717339.20 412857.70 294045.60 299396.20 579530.20 N-Acetylornithine 589480.70 168458.60 809965.20 519451.40 1042606.00 1065917.00 523476.30 1149115.00 780134.30 554260.70 1094762.00 504928.10 714788.10 687076.30 1478939.00 378418.70 462214.70 698084.20 416127.30 1221543.00 275175.80 667660.10 213021.00 1371949.00 659761.10 472919.00 1017263.00 892706.00 792806.80 801555.90 583112.20 1246114.00 613471.00 581169.80 1123562.00 1111966.00 582731.30 942633.70 586988.10 491651.70 566334.30 771454.30 375469.90 701430.30 1287850.00 346510.50 529483.50 512446.70 502506.40 1685298.00 1075854.00 795940.90 1864948.00 964730.30 1443036.00 1158000.00 2520132.00 655420.20 4037226.00 272478.00 1362425.00 573121.20 1117920.00 663019.40 869544.00 1375277.00 640969.10 1278921.00 3106349.00 854601.00 1199733.00 975097.30 650430.50 1667099.00 1326106.00 1222000.00 1227121.00 1098724.00 497243.70 1384068.00 718526.40 1674465.00 1660379.00 1742024.00 480010.50 954892.00 3551803.00 1263795.00 1085960.00 1124085.00 525691.30 1493309.00 1018529.00 840705.80 1865622.00 879432.20 678777.90 964275.80 trans-4-Hydroxy-L-proline 553951.90 821682.70 1177542.00 749143.50 1214922.00 929681.50 1173518.00 1768544.00 1308737.00 858957.00 990463.70 1409689.00 1456684.00 1091772.00 1313751.00 1150092.00 2646406.00 1235465.00 1294629.00 1208378.00 760281.80 1030767.00 1142369.00 2677185.00 3364801.00 1325447.00 1956277.00 1737016.00 2366508.00 1812972.00 1318619.00 1029648.00 1296254.00 1438282.00 1908143.00 1315300.00 1237164.00 2642635.00 1605088.00 1787070.00 2324512.00 2084660.00 1450780.00 3198503.00 670127.50 698704.60 2686551.00 1192143.00 2319868.00 1886290.00 1427629.00 2637123.00 2473814.00 773940.60 1471355.00 1751574.00 2022250.00 727932.10 1099981.00 1266321.00 2555968.00 2303884.00 3220936.00 1144496.00 2321939.00 1618451.00 2024471.00 1509734.00 2298731.00 942108.00 1286230.00 1601768.00 668415.80 1228202.00 2892171.00 1268327.00 2799030.00 1078484.00 1564820.00 959763.70 1521542.00 3689378.00 2677456.00 1304720.00 1496941.00 4147077.00 1862559.00 1529041.00 2003719.00 1360590.00 1107609.00 2636439.00 1365883.00 1110610.00 2837417.00 1529182.00 660517.30 2985952.00 Taurine 518953.90 373869.80 465205.80 500807.30 1152262.00 541973.10 404964.80 484333.20 519495.10 454080.50 547746.80 417637.60 435542.60 666960.80 443072.20 1033870.00 468349.60 516403.60 791365.80 652787.20 596677.50 604083.20 605264.80 574137.30 624846.10 810179.10 688736.80 770130.80 836246.60 720854.50 733550.20 739621.00 702451.20 654986.40 983749.30 771118.50 488054.60 501739.90 375255.00 548294.50 630254.50 661288.20 654405.00 781679.60 479536.30 567872.70 625219.80 472400.30 598423.80 541266.70 943058.00 980478.20 520809.00 459729.50 558976.60 513760.80 798893.50 396186.60 651519.10 676710.90 706732.80 454007.80 423940.60 528701.20 678968.80 392029.20 452674.10 609074.00 449363.70 443738.90 322200.90 393616.70 454384.40 654745.70 396041.50 746912.90 683707.40 572091.20 377131.20 623052.20 448554.50 468633.20 622893.20 635905.60 510925.10 568431.80 902218.70 536197.00 463116.60 493599.20 330721.50 989803.30 469665.60 605477.40 524922.10 617986.00 393040.10 610982.20 L-Methionine S-oxide 3092730.00 2467929.00 2869019.00 2060745.00 3193632.00 3378426.00 3117376.00 2598497.00 2124876.00 4575875.00 2730289.00 2973902.00 1524302.00 1868107.00 3177034.00 1475166.00 2900198.00 2362673.00 2319338.00 2076801.00 3071883.00 3028473.00 1717313.00 2864455.00 3106589.00 3811387.00 3703045.00 4084003.00 3386571.00 3667947.00 4211544.00 3417238.00 3868587.00 5161620.00 4223482.00 3547489.00 4516034.00 3543420.00 2443370.00 2952012.00 6262096.00 4626116.00 3504245.00 3991573.00 3303717.00 2826990.00 4106318.00 3221264.00 2512078.00 2376761.00 2380856.00 3602130.00 3771405.00 4303228.00 3612172.00 2681788.00 3560491.00 2992341.00 3120497.00 2302765.00 2818055.00 3826939.00 2255218.00 2745494.00 2828032.00 2283786.00 2169628.00 3104278.00 2315822.00 2445387.00 3138158.00 2860951.00 2300621.00 2171122.00 2921378.00 2839747.00 2867281.00 2578347.00 2576874.00 2840555.00 2183246.00 3227272.00 2487712.00 2305139.00 2468375.00 3510017.00 2783325.00 3173886.00 2129554.00 2471334.00 2157097.00 2365118.00 2796534.00 2274403.00 5637554.00 2606541.00 4404131.00 2221238.00 5-Hydroxyindoleacetate 95288.20 49699.50 152214.80 125843.50 64266.59 125323.10 123171.10 221633.80 119746.00 82942.88 125310.40 71212.54 105308.00 178661.50 183218.60 140636.00 174748.70 148991.90 153559.30 201806.70 181042.70 147210.50 104763.20 277294.60 335539.10 121875.30 214007.50 216721.90 210821.60 181976.50 126079.80 130815.70 200417.60 150439.40 181560.20 206487.90 58478.52 141292.40 125558.60 129643.50 161237.90 79581.95 149475.50 210247.30 110728.50 97768.66 132442.00 144740.20 81859.29 193998.50 204350.40 224341.00 283609.00 183325.90 180765.70 163766.60 192371.00 132117.40 179084.60 124373.50 133700.40 205011.40 139790.20 144022.50 113932.00 186866.50 267468.40 130355.40 188761.30 155338.00 98368.66 201550.30 266981.70 151621.00 194164.80 132016.80 87516.98 173828.60 242358.20 257494.90 126334.50 276721.40 287532.10 106157.80 158324.10 126501.90 122870.00 147001.20 331664.90 171235.30 194621.10 191173.20 226635.20 134855.80 247957.10 122557.00 150521.70 139840.50 3-Methyleneoxindole 798874.20 924264.50 994705.80 1019155.00 834574.70 780085.30 1085781.00 764639.20 862832.20 567013.50 1257661.00 1059643.00 1172391.00 808250.40 782290.40 1063216.00 1086516.00 981653.60 886511.80 774628.40 831514.00 842961.50 1292060.00 843403.20 1219562.00 784411.00 1339678.00 1364468.00 1454450.00 1227671.00 1010645.00 966730.70 1123987.00 1322902.00 1616858.00 1618816.00 914401.60 978976.40 901551.30 1199517.00 1085870.00 1881786.00 1117078.00 1398335.00 965691.40 773787.40 1334634.00 1167002.00 709008.90 708488.30 1070295.00 723086.00 1075643.00 958019.80 855412.80 611554.20 905268.20 966148.70 751801.00 499065.20 613226.80 858793.20 1070508.00 651537.10 709780.20 504967.90 801552.80 785903.50 800643.90 863690.10 757279.20 1122538.00 840406.80 895151.20 1075228.00 758314.50 808920.50 702835.10 1087058.00 774263.90 1043890.00 1125104.00 821440.70 793734.00 756596.70 1040864.00 1338935.00 892212.50 1602014.00 834637.20 1089260.00 1209472.00 1142310.00 1146865.00 1286618.00 1035904.00 811244.60 1061385.00 Indole 1743848.00 853716.20 1708184.00 1026867.00 1773883.00 1707230.00 1465300.00 1603796.00 1252928.00 1830228.00 1536590.00 1136137.00 1599322.00 1126502.00 1309660.00 1308852.00 1279147.00 1493935.00 1188684.00 856916.30 1600002.00 1594683.00 648494.40 1396947.00 1445596.00 1675037.00 3277304.00 2106829.00 1675145.00 1623041.00 1844563.00 1805196.00 1752574.00 2305200.00 1969903.00 1353432.00 1507675.00 1396821.00 1309466.00 1441974.00 3133627.00 1809889.00 1543040.00 1460034.00 1385998.00 1315606.00 1658369.00 1286743.00 1007457.00 1951309.00 1165701.00 1335014.00 1718216.00 2431017.00 1859549.00 1512023.00 1583721.00 1524706.00 1017605.00 747019.70 1203418.00 1248218.00 897575.20 1263186.00 1035727.00 1151082.00 1226925.00 1582073.00 1205551.00 1249688.00 1955484.00 2216291.00 1137781.00 958675.50 1543815.00 1442425.00 1205943.00 1107012.00 1382130.00 1173939.00 1726654.00 1629162.00 1487326.00 990294.00 1502788.00 1657900.00 1232336.00 2246883.00 1643568.00 955187.50 1751794.00 939776.80 1362571.00 1037035.00 2048707.00 745717.40 1990200.00 899372.00 Indole-3-acetaldehyde 37420.12 87885.71 30403.32 64977.82 180364.50 29306.87 55569.68 76385.51 71503.66 30262.66 164061.60 55234.95 57302.11 79099.25 93206.41 86384.04 101195.40 103767.60 55857.02 145486.60 10345.87 56017.80 135201.50 64024.45 46231.18 98087.28 79044.90 119842.20 88335.81 95035.96 36479.18 61762.55 93012.98 68595.52 80903.16 133904.90 58296.52 81215.79 64512.41 48776.89 103914.90 155410.00 104295.80 88086.10 75166.41 67319.38 107872.00 83158.27 60156.89 60476.79 61863.62 106570.00 119546.60 30314.25 186967.40 61593.72 43673.21 49861.21 31711.06 44879.43 23847.53 30691.24 75392.58 26038.48 39082.33 21731.40 72479.45 41619.23 36174.49 42890.18 33013.84 51944.33 54469.96 44326.08 49639.14 156862.30 50147.43 45916.21 88456.23 59547.03 76666.30 61595.87 95585.59 56005.66 33193.34 30964.74 79591.24 25568.78 103512.20 69110.45 55356.23 682086.80 68692.98 53101.18 32186.78 67949.18 60449.48 51588.48 Indole-3-acetate 775245.50 511815.80 961363.20 762979.80 964566.20 506368.00 1245548.00 2245300.00 722916.20 1418631.00 782267.20 1596154.00 497316.60 755484.00 853691.60 1281255.00 503015.00 900843.80 831494.80 430955.90 1585001.00 1461036.00 459985.20 708448.30 793775.60 1148185.00 1137270.00 1401026.00 998064.20 1610829.00 1692960.00 1242827.00 937246.90 1542193.00 1039924.00 858246.00 887630.80 1244690.00 532432.20 932476.80 1282074.00 1540146.00 1468511.00 895306.90 1059362.00 1297519.00 1043952.00 880907.60 846609.70 894304.80 592607.80 857331.30 915584.40 949420.40 1974960.00 1086026.00 864409.10 782096.40 536064.60 1052870.00 340973.20 568711.50 580115.40 592834.80 826206.70 1494960.00 885801.20 640128.80 1438314.00 1139317.00 1071026.00 1316527.00 5480132.00 529512.80 2978647.00 698976.60 641388.10 1224137.00 717743.10 803308.80 838493.80 2836770.00 538231.30 1102023.00 1385841.00 530349.20 717588.30 1379465.00 843140.70 597577.20 953862.20 1273450.00 1542715.00 1373048.00 846136.30 1019637.00 1633012.00 565930.40 kynurenine 734485.90 488922.90 1044781.00 1029799.00 1057162.00 1183195.00 1031220.00 1098749.00 706617.70 788295.30 1015095.00 566381.60 927748.90 1488926.00 1279883.00 908190.60 1102779.00 924549.20 871241.70 1315458.00 1140428.00 1177960.00 790389.10 1917287.00 2011828.00 916682.50 1526579.00 1454309.00 1687494.00 1157887.00 1252555.00 1175605.00 1108892.00 1266027.00 1778949.00 1459392.00 683253.30 1052376.00 991211.50 1066690.00 1203470.00 845182.50 1047564.00 1588067.00 1082831.00 672968.00 1188219.00 1084012.00 834539.60 1367599.00 1287425.00 1749642.00 1869336.00 1618652.00 1465720.00 1574244.00 1300122.00 1225175.00 1079270.00 992520.70 4574090.00 1340710.00 1142857.00 900415.50 850740.00 1137202.00 1889709.00 1073498.00 1371958.00 1199865.00 829533.40 1366447.00 2143555.00 1045020.00 1376910.00 1089486.00 1016931.00 1097207.00 1564076.00 1843634.00 1463132.00 1961690.00 1564861.00 790939.40 1466812.00 1207086.00 1336083.00 1088920.00 2260463.00 1503757.00 1466031.00 1371086.00 1629100.00 1012528.00 1594158.00 1107517.00 1404198.00 1168374.00 Picolinic acid 881725.20 512922.90 641057.10 651449.10 552904.60 645153.20 590007.30 603183.90 417389.30 740740.20 598082.30 500612.60 436448.10 575790.80 583036.80 584999.80 494176.60 405398.50 469828.40 629255.80 568893.90 454534.60 450837.80 617442.20 438457.10 481119.80 626147.90 639873.10 589569.80 666652.30 575606.00 597536.60 419145.80 376382.60 476832.30 630449.30 487071.10 671735.40 612027.20 567498.70 567343.20 757751.70 553360.80 571788.20 541710.20 637233.80 652081.90 406791.30 355863.30 635723.50 626747.10 1003152.00 581465.20 496451.80 683081.40 694743.80 609711.20 625342.80 804041.50 588371.70 614325.70 705415.80 470010.00 722340.70 665892.80 688809.50 587898.80 508934.50 752771.40 705094.20 775549.40 632219.50 665326.30 841698.60 653254.10 540620.80 768424.20 601801.40 440048.90 482651.90 681351.20 837808.70 535317.70 530823.40 480027.20 642366.60 618156.60 512023.20 406809.40 928877.20 513154.80 422326.20 577713.50 458717.50 512267.50 642945.20 567611.30 582837.80 g-Oxalo-crotonate 2654984.00 2038399.00 1963210.00 1761832.00 43571650.00 3261881.00 1338695.00 2109369.00 1464051.00 1340782.00 1750396.00 1095478.00 2488253.00 2348698.00 2427194.00 2452798.00 1918097.00 1822153.00 3364226.00 3555828.00 2305052.00 6875452.00 4876848.00 1887896.00 2458678.00 6442598.00 4633450.00 7417418.00 5032706.00 4535936.00 4581974.00 6464974.00 5543006.00 5799726.00 8049968.00 4032114.00 1814710.00 2315177.00 2783659.00 2472240.00 5407596.00 4287710.00 4073615.00 6368470.00 1781006.00 1591952.00 4043886.00 1535078.00 3406604.00 2177253.00 10963960.00 4631182.00 1535796.00 3072863.00 2215147.00 2141756.00 4157400.00 1976652.00 2081428.00 2090058.00 5090992.00 3055997.00 1236190.00 1354085.00 2732018.00 1666019.00 1921096.00 2309873.00 2093924.00 2071848.00 1461996.00 2326806.00 1618470.00 8312254.00 2910089.00 33035390.00 5012948.00 5352820.00 1845898.00 2237917.00 2402312.00 2040647.00 2692155.00 2676489.00 4493686.00 1428393.00 9228410.00 2261157.00 3338189.00 3373443.00 1833342.00 12454700.00 2144101.00 2441947.00 3292340.00 3551461.00 2507668.00 2477552.00 L-Adrenaline 5535650.00 1956287.00 14600000.00 8425548.00 6303222.00 8090976.00 13300000.00 4424066.00 14500000.00 8480879.00 10000000.00 6762650.00 3498016.00 9812537.00 11700000.00 11300000.00 9444274.00 11800000.00 10600000.00 8206990.00 12600000.00 6688040.00 6938088.00 14600000.00 17100000.00 8579819.00 12000000.00 12200000.00 11700000.00 12400000.00 12900000.00 12400000.00 12900000.00 12100000.00 3437670.00 14700000.00 10200000.00 11500000.00 12500000.00 12800000.00 14000000.00 17800000.00 13800000.00 16300000.00 13200000.00 8103324.00 14300000.00 10100000.00 10400000.00 8262510.00 7593026.00 13000000.00 10300000.00 11200000.00 9235361.00 12300000.00 10900000.00 9226368.00 9214423.00 9755056.00 10400000.00 5512940.00 9684437.00 11000000.00 14900000.00 9816055.00 9852904.00 9849741.00 7897196.00 11200000.00 14100000.00 16500000.00 12300000.00 14400000.00 10500000.00 10200000.00 12700000.00 2496240.00 12300000.00 9680827.00 14500000.00 12100000.00 14900000.00 10500000.00 16500000.00 11800000.00 8917157.00 15200000.00 16000000.00 8507052.00 13000000.00 21300000.00 9933341.00 13400000.00 15200000.00 7298164.00 13100000.00 10100000.00 Sphingosine 1-phosphate 44969.93 172391.60 227078.00 233247.10 434407.10 399023.90 251419.60 292235.90 232890.70 241651.90 338615.20 236626.80 238872.10 255934.10 327779.10 363748.00 242068.00 273607.40 367841.30 339464.70 210810.90 412385.20 264340.70 333281.40 431240.20 448372.70 468558.00 681584.60 576584.60 500127.90 506796.20 527222.60 660138.90 611675.50 510726.10 301584.00 231660.30 430108.10 273303.30 287474.00 451554.10 361977.80 247129.90 449734.70 272254.10 254335.00 341331.30 346784.60 277791.70 3270.30 85610.85 96965.38 84158.72 127768.20 171968.50 217195.70 278977.70 174674.80 190766.90 134070.10 269091.50 322937.80 157997.00 165796.40 240106.30 167918.40 258203.70 261253.80 312584.70 303794.20 212969.40 314169.20 197527.40 276900.60 296353.10 332274.20 361458.10 266016.40 363719.00 353993.70 289291.40 283846.30 322640.00 273463.80 271439.80 250705.10 381183.80 353494.40 271421.20 350466.80 282696.70 448291.60 275570.20 223221.20 334879.10 270946.50 268352.40 298675.80 Acetylcholine 4526464.00 3186181.00 10180390.00 4381250.00 6367498.00 5199074.00 5473730.00 8247650.00 6304632.00 6807382.00 6248880.00 5895384.00 5244746.00 7803826.00 6653568.00 7564620.00 4505283.00 6662392.00 6029898.00 6523766.00 6303396.00 6968234.00 3228832.00 8779563.00 6213310.00 3873122.00 4580823.00 5112162.00 6310078.00 6165722.00 5823066.00 6011620.00 5079612.00 4792186.00 5691902.00 4727158.00 4510612.00 4336312.00 6824702.00 4379218.00 4868836.00 6024314.00 5388849.00 6576914.00 5785288.00 3954863.00 6856870.00 4525412.00 6162874.00 4662988.00 3042977.00 4135864.00 4652260.00 4213548.00 4537046.00 3941696.00 4507764.00 3393323.00 7509060.00 2867818.00 7988970.00 6189146.00 5477499.00 7719450.00 6458114.00 6720278.00 5823976.00 4410726.00 4655298.00 5105698.00 4334676.00 5955222.00 3380415.00 7298038.00 4210922.00 6011858.00 3817553.00 3917644.00 4993262.00 5153202.00 6961706.00 4404906.00 6878498.00 4559344.00 8498883.00 5816494.00 5306242.00 3575913.00 6699856.00 4366195.00 4645204.00 6024138.00 5041568.00 5166196.00 4306463.00 3975062.00 4815902.00 5724258.00 Choline 87701.62 84804.36 72209.09 56180.31 64036.36 132773.10 68766.13 84527.79 49344.68 100080.50 69573.18 49115.71 14128.93 79094.06 21516.19 34284.84 76571.20 56733.98 92573.66 35431.98 61386.30 84627.15 27710.51 70400.90 64764.21 78178.60 60830.86 130936.60 78509.73 105081.60 105460.40 88525.71 56694.20 90429.16 96409.87 44164.84 54586.08 73472.44 31408.99 70028.21 116639.80 86650.68 50635.85 94266.90 87399.41 61619.75 123223.20 69138.12 55389.84 78149.44 67696.10 72058.52 77536.35 65705.90 114493.30 59089.57 67296.84 35973.73 44835.42 69866.27 43544.24 89255.18 77971.66 43613.58 84718.99 35899.75 51757.61 60225.37 77200.12 60967.80 79760.62 59624.31 60840.25 33236.68 45371.53 100470.20 35555.90 57021.18 57958.88 47249.70 82104.84 90156.12 67891.29 55584.34 52952.30 50527.29 84425.44 91071.69 101062.40 78904.59 76340.34 87087.08 54436.41 60877.44 63894.68 40023.43 62784.70 18628.73 L-Carnitine 40327.81 16288.01 4315.47 12698.77 5062.99 3430.36 38109.11 343228.90 17868.22 2757.48 29587.12 77498.09 NA NA 7363.37 NA 11490.30 3978.74 351457.90 21994.86 2881.21 4989.32 6187.06 2147.30 4142.67 4219.30 4526.06 3455.69 2327.21 1620.20 2105.23 4275.18 5623.76 2807.40 2067.05 3063.05 3065.61 3279.59 6419.26 1886.96 2076.23 19015.80 3879.33 6896.72 NA NA 4038.84 2267.33 2936.23 15116.16 21678.58 7283.26 4876.77 4281.05 6634.22 3175.50 17696.08 10660.13 9070.10 9946.89 4314.96 4148.10 2138.99 2791.60 6081.99 4014.04 1706.45 NA 53290.31 2468.05 5687.06 1856.90 5138.98 NA 23126.07 60022.30 38866.41 2604.27 4698.02 3193.21 5047.40 4472.35 10324.98 2447.18 3476.52 3439.02 2642.93 28143.06 2976.68 36400.19 4832.63 5534.73 25481.99 2794.23 123845.70 3357.45 3604.65 4165.36 Hydroxybutyrylcarnitine 607695.80 90299.76 944711.00 427780.10 126651.50 2292924.00 237846.50 1338689.00 900979.70 407926.30 1022972.00 1053060.00 435662.50 495280.20 294381.10 925997.40 273230.20 700376.50 348650.80 277804.40 513985.40 1551699.00 869450.70 862511.30 705888.50 1046743.00 2483222.00 1913316.00 225232.80 2783687.00 2068545.00 2798345.00 1855662.00 2812630.00 2026450.00 11348.17 1126512.00 321530.10 450727.00 291444.20 900904.30 536985.20 2681742.00 944977.00 905046.40 61697.52 2710574.00 732842.00 336774.50 1232991.00 2285.95 7402.05 4320.53 16437.58 3387.89 1252.56 125993.30 2204.80 95000.06 401427.30 35160.02 7898.82 65262.06 359555.20 611710.10 150017.50 792882.70 420768.80 509832.80 723157.30 20680.95 1325.11 709689.10 330715.80 245114.70 100872.30 2682901.00 388133.00 291183.10 64687.59 1522879.00 476289.10 2064.42 715746.80 648140.60 949370.70 348215.20 1246276.00 2205815.00 142003.60 443790.40 792484.80 618721.90 91452.79 159685.60 899054.50 428673.80 419607.00 Tiglylcarnitine 100759.90 103664.00 263892.30 116356.70 87936.44 164931.70 212101.90 304683.10 195967.90 154467.00 238694.50 80756.02 104965.90 111429.10 162163.00 131417.20 139017.20 177549.00 143827.40 69722.70 153761.20 205334.40 135781.50 225787.60 155173.50 132083.10 143727.40 148195.40 116655.60 119740.30 179346.10 118792.90 175643.30 158179.80 109108.60 98173.00 204062.40 127332.00 108409.30 113802.60 133291.20 216094.30 183172.50 158092.30 190068.40 145284.30 158555.20 251755.40 135447.20 282497.70 128474.20 113176.00 254375.70 340905.40 435352.50 214689.90 184776.20 297110.00 313322.20 145805.60 83106.65 289126.10 350469.70 181115.20 372412.00 320282.60 173833.30 397605.90 248861.60 245583.50 352567.00 452723.10 191191.80 281928.50 325222.60 194600.40 154881.20 183673.90 174792.80 208673.20 385688.60 152186.30 204286.50 407138.10 323388.00 248165.60 120833.70 325924.00 156216.50 509261.10 322664.00 214244.90 351052.80 88904.76 317002.00 138278.40 319876.80 186426.30 hexanoyl-L-carnitine 289654.20 500663.80 798216.80 551120.80 577379.70 531628.80 501016.80 413977.60 686143.20 1470305.00 403537.80 786955.60 579429.90 606578.10 875413.60 1003225.00 518651.20 931783.00 583961.20 238574.20 988098.50 457848.50 847189.20 622020.80 539855.30 553998.80 677032.00 586068.80 1686520.00 362034.40 508109.60 1018049.00 982265.20 667405.80 1175568.00 369899.80 1024426.00 484905.80 481458.90 346736.00 704868.80 1288321.00 975958.70 700938.90 1169814.00 1246580.00 1246728.00 579268.90 922639.80 180337.70 691679.10 1007188.00 541231.60 704928.80 1707809.00 609695.20 1987332.00 479580.50 770786.30 1229090.00 1168648.00 480032.80 538728.40 698380.30 387677.50 715371.40 565642.90 1009840.00 1487703.00 1476555.00 626527.20 982644.90 2250802.00 1512271.00 952358.70 1909957.00 834804.10 699443.80 757161.00 1037297.00 848509.10 1154238.00 1328202.00 1797329.00 1749058.00 1276783.00 1095773.00 701726.50 1028555.00 1800280.00 1946880.00 729316.60 626022.90 1131794.00 1372300.00 2385150.00 418549.20 1690101.00 octenoyl-l-carnitine 1740635.00 1515225.00 5145430.00 3812589.00 5136536.00 4850272.00 5508052.00 2462947.00 3487706.00 4592170.00 3343578.00 6010298.00 1263388.00 5170612.00 4306446.00 5777358.00 3540904.00 4270696.00 3709283.00 4258182.00 4609700.00 7905908.00 5312434.00 3605837.00 3906417.00 1549668.00 2058880.00 2818128.00 9642585.00 1382159.00 2894946.00 2838025.00 3305822.00 1947277.00 2611936.00 1944460.00 1703947.00 5549714.00 2470704.00 2239499.00 2657406.00 2946591.00 3917290.00 2703427.00 10881840.00 4840095.00 6368294.00 4839772.00 5245666.00 3024072.00 3739717.00 6784810.00 15570170.00 2500260.00 41666520.00 852432.00 13642660.00 159134.10 11603930.00 1585169.00 4925519.00 2658703.00 5591966.00 6529326.00 7372834.00 6781810.00 10010020.00 6435522.00 11778820.00 6376742.00 3168305.00 1559109.00 9537021.00 9369561.00 3233493.00 9286315.00 8324244.00 3206682.00 4321258.00 11917270.00 1202399.00 17092900.00 1794206.00 4012715.00 7026108.00 3531014.00 6202914.00 1797705.00 15626370.00 4355619.00 2364786.00 4454170.00 6836456.00 4456788.00 6673278.00 4275224.00 1527520.00 7512828.00 O-Decanoyl-L-carnitine 1087309.00 2199016.00 2594810.00 2079652.00 1468124.00 1516276.00 1046922.00 1371987.00 1640326.00 3241621.00 1852703.00 2614855.00 1273071.00 1678657.00 2184043.00 2364710.00 851777.20 2384929.00 847120.10 1155091.00 1948131.00 970604.20 2065534.00 1915079.00 1299777.00 1577655.00 2000339.00 1629492.00 3717606.00 886921.80 1720726.00 2487535.00 4585186.00 1961057.00 4967929.00 551931.00 3426265.00 1196274.00 1303316.00 904163.30 1830185.00 4933558.00 3161603.00 1429845.00 2349190.00 6922196.00 3696087.00 2925698.00 761061.40 599376.20 1647071.00 2968944.00 2043223.00 1632468.00 6229248.00 1584164.00 5565998.00 638019.40 2451420.00 1328234.00 3138853.00 827867.20 1028392.00 1048170.00 406188.20 2074612.00 1401776.00 1890152.00 4085521.00 4117451.00 775193.20 3610361.00 7058230.00 5529286.00 997801.20 3618772.00 2347500.00 1435986.00 2887281.00 2403733.00 3393780.00 3334129.00 3745188.00 3928356.00 7038650.00 5230324.00 4343100.00 2527693.00 2656065.00 3145158.00 5973292.00 885373.30 2907119.00 1818561.00 2725609.00 7177554.00 364283.60 2738457.00 O-Decenoyl-L-carnitine 1063235.00 1522090.00 4708002.00 2434877.00 2524950.00 1329178.00 1249081.00 1634853.00 1950469.00 3488180.00 2026119.00 2522660.00 1682930.00 2134173.00 2836998.00 2565573.00 1528307.00 2364072.00 1096710.00 1242827.00 1656340.00 2216183.00 1669089.00 1908383.00 1630615.00 944433.50 1487782.00 1213597.00 3059664.00 495773.00 1132894.00 2002011.00 2009092.00 1175596.00 2892765.00 530782.10 3023307.00 1561583.00 1582939.00 1385456.00 2102304.00 2997074.00 2879209.00 1388901.00 3108092.00 4373106.00 3616627.00 2862760.00 939071.80 1248696.00 1766116.00 3480805.00 3677863.00 1587994.00 10225910.00 1356640.00 6196634.00 292506.20 3367281.00 1169876.00 4610880.00 1119628.00 2196812.00 1531954.00 937487.00 2577829.00 3183153.00 2681698.00 4532138.00 3726896.00 706828.80 2200883.00 6321238.00 5280641.00 1837586.00 6961344.00 3307524.00 1439729.00 4132562.00 5586526.00 3884892.00 3639907.00 3390254.00 3727681.00 6392064.00 2754903.00 5546950.00 2194214.00 3523021.00 4034599.00 2644556.00 996789.30 3816513.00 2793385.00 3000719.00 5741094.00 363999.80 2963011.00 O-dodecenoyl-carnitine 187959.80 429720.40 470783.70 537953.80 302737.70 193192.90 260953.80 222278.40 217464.20 292653.60 475665.80 249449.10 277062.10 274479.60 420903.20 326863.90 137514.40 409816.20 178522.70 187925.00 251195.00 165091.60 528932.90 273424.70 266066.00 148876.00 246838.00 162239.50 374633.20 114400.50 218361.70 439073.90 417016.50 232257.50 537372.80 95711.81 489544.30 151676.10 330396.20 180656.00 344791.50 728119.80 328589.50 191865.80 437217.20 571885.10 627525.80 399897.60 249994.30 139961.90 173002.80 424347.30 252555.50 208452.70 619476.20 189459.40 1304956.00 128489.00 604897.30 180381.90 562961.80 122876.70 148328.40 160517.00 55771.89 541870.40 322172.30 316297.50 614441.30 524278.60 191298.60 405192.20 1511122.00 1073214.00 155725.50 685680.20 284201.30 280674.20 505989.00 407616.10 648106.10 319025.50 714031.00 1796452.00 910916.70 490494.90 562163.20 381513.00 380805.40 941160.20 915595.80 191486.40 482856.80 412448.00 383716.80 1998386.00 68341.05 527769.40 Isovalerylcarnitine 2445422.00 904784.50 2298898.00 1531766.00 2192630.00 3191262.00 2120900.00 4053689.00 2469641.00 3838784.00 1600307.00 1929324.00 1266051.00 2059934.00 2647056.00 2911563.00 2575370.00 1830336.00 2985302.00 1086704.00 2657447.00 4806284.00 1289603.00 2629452.00 2559863.00 2956306.00 3748040.00 3823273.00 2520447.00 2114286.00 4495916.00 3042200.00 2690912.00 3459974.00 2578295.00 2617009.00 4963854.00 1459184.00 1145517.00 1723655.00 3721747.00 2311909.00 2468188.00 3669950.00 3478886.00 1446211.00 5109446.00 2502087.00 2561647.00 4361792.00 1955764.00 2109267.00 3630383.00 6449400.00 3253519.00 3242696.00 4017691.00 3389614.00 1940048.00 3953826.00 1642458.00 2857990.00 2610559.00 5254496.00 1597225.00 4402976.00 3341484.00 6836708.00 2466361.00 3468652.00 5173015.00 3606585.00 3192903.00 1985862.00 3844714.00 2940239.00 2084539.00 3062986.00 2886168.00 4798208.00 4349202.00 2613392.00 2157043.00 2555818.00 4904056.00 4204930.00 1088719.00 5356572.00 3669840.00 4478838.00 4617608.00 2639726.00 2178628.00 2220982.00 7466244.00 1999463.00 4792234.00 2835766.00 Hexanoic acid 9337.40 14514.66 29018.58 17548.81 133106.70 20135.90 8417.55 183813.40 19997.03 35972.45 65600.84 19617.67 9270.75 11532.26 45386.39 15569.79 3802.77 1847.46 210356.50 4717.30 3010.84 4218.17 2536.16 85172.20 32215.33 21076.67 14450.00 7264.67 18424.84 2528.89 6906.76 15522.16 18145.97 13268.55 4193.87 6845.27 6563.86 16006.17 2899.52 4271.44 3232.32 17583.68 5880.48 13932.86 2774.47 2151.12 17343.02 12390.44 19231.99 5179.75 24954.68 6293.60 14396.92 31230.98 15334.77 8071.83 9868.81 43207.14 11238.61 12295.27 15979.21 33623.25 16397.96 20753.31 62255.67 199634.50 42129.83 9507.70 23833.34 4027.26 11308.69 26847.96 30752.40 21032.42 17420.71 31308.31 2815.93 24526.21 18303.41 88056.09 4559.61 14820.48 16765.24 7490.28 267819.80 31508.15 8622.05 11238.11 3318.69 4744.97 5423.40 5237.31 18245.54 16250.24 13382.71 11223.65 5230.68 17644.58 Serotonin 16922.62 8291.16 9799.42 8344.62 9988.00 6744.04 3833.16 7991744.00 3726362.00 9201.14 11897.73 7600.38 661609.40 4997710.00 6726.46 7441036.00 11255.37 3410.21 1635267.00 12678.39 3077.61 4386.07 5708.25 9531.86 7020.17 4761.00 6950.90 5541.65 3420.91 5203.13 8276.37 4465.89 6107.60 7725.12 8074.03 6300.88 7255.11 2698.08 2146.25 4806.99 2475.91 7602.77 6736.30 7774.82 5970.22 3165.57 3123.76 2697.28 2587.24 14548.07 16637.01 22904.44 22557.21 16819.43 10636.83 8481.83 13826.52 7031.09 11625.92 6220.55 45901.84 3427.82 9295.77 5999.91 1985.29 2854.90 55807.59 6729.25 2863.10 5673.94 3931.03 5577.35 20376.36 12451.29 6753.57 7930.88 8608.69 14607.25 27125.59 9340.98 11705.55 6969.50 5878.33 8146.98 47652.86 2811.35 7927.78 3266.28 41073.80 6087.39 5598.10 76160.09 2695.83 3593.16 61698.84 24358.67 6716.28 2923.53 Anthranilate 5747008.00 5556688.00 3510857.00 415523.70 759236.70 1619943.00 1108974.00 10429380.00 2557593.00 1061197.00 5040874.00 235437.40 350410.80 12399300.00 503093.50 258897.80 185980.50 208064.40 5544028.00 4310678.00 268192.20 895600.00 NA 351219.00 339029.90 386244.50 331011.50 644139.10 167373.00 812478.00 235329.30 680677.80 288012.60 325892.60 219991.20 1160912.00 7199900.00 185471.90 1190248.00 618593.20 712576.20 613607.30 196346.70 273885.60 2561386.00 239318.80 260229.70 658344.90 347497.90 1067160.00 242477.00 127994.00 590961.00 508725.40 131833.10 1416973.00 414822.30 1043226.00 2372114.00 673968.70 427785.20 1147156.00 1035525.00 563983.60 542276.60 824115.20 1156495.00 295901.80 2926871.00 1771135.00 2294636.00 215200.20 348769.80 1035359.00 1385965.00 706938.10 460360.50 584142.90 683379.60 560527.60 595270.50 164030.30 1288456.00 1927334.00 1006820.00 1014960.00 4758733.00 1507024.00 411639.00 1008651.00 978590.90 287770.80 651905.20 247128.70 343263.90 308947.30 1679520.00 807817.60 Quinolinic acid 16851.92 18453.76 9480.52 41246.69 21495.51 32069.23 21537.83 42383.89 3611.24 20663.08 25093.78 NA 16394.33 47918.34 41970.92 23262.79 19371.30 21710.81 6856.33 38737.39 29063.63 93978.04 31400.08 23273.47 39925.53 16856.76 22591.16 22435.18 61238.25 26099.43 23423.53 21123.91 54845.03 25923.69 23835.39 17274.70 15734.01 20234.27 32709.38 22615.97 11773.62 20276.23 31487.13 21157.15 26724.68 15907.60 36238.13 42585.78 25101.65 31717.99 84838.35 108406.70 53205.95 54078.39 71206.25 39046.52 69525.41 42513.83 66732.83 49362.91 49939.81 58731.88 45258.88 10806.42 46760.02 23305.35 71910.50 58129.88 84848.07 28755.63 24694.15 55035.75 114670.60 16226.67 64466.50 27054.44 65132.68 98420.73 46500.68 75028.27 49737.09 95850.04 44384.70 26069.94 38120.30 58721.25 25278.54 24171.70 67393.41 48390.22 37881.99 54807.61 27069.18 19903.65 92103.79 57278.58 43820.95 39394.89 metabolite_name KEGG ID HMDB ID PubChem ID quantitated m/z Rtmed L-Alanine C00041 90.05525 1.172497 L-arginine C00062 175.1182 1.131099 L-asparagine C00152 133.0603 1.208767 L-Aspartate C00049 134.0442 1.210024 L-cysteine C00097 122.0267 1.178241 L-glutamate C00025 148.0596 1.177738 L-glutamine C00064 147.0759 1.190049 L-histidine C00135 156.0762 1.076767 L-leucine C00123 132.1015 1.198759 L-lysine C00047 147.1122 1.057103 L-methionine C00073 150.0576 1.19574 L-phenylalanine C00079 166.0857 1.202894 L-proline C00148 116.0704 1.186393 L-serine C00065 106.0498 1.205352 L-threonine C00188 120.0654 1.174713 L-tryptophan C00078 205.0962 1.209776 L-tyrosine C00082 182.0803 0.8328939 L-valine C00183 118.086 1.19413 L-cystine C00491 241.0295 1.20877 Adenine C00147 136.0614 1.520419 Uracil C00106 113.0343 1.514714 Inosine C00294 269.0866 1.198923 Hypoxanthine C00262 137.0451 1.196344 Xanthine C00385 153.0401 1.514396 Allantoate C00499 177.0603 1.126862 Pyridoxal C00250 168.0627 1.201758 Pyridoxamine phosphate C00647 249.06 1.269841 5-Oxoproline C01879 130.0496 1.203804 Cys-Gly C01419 179.0476 1.191016 gamma-L-Glutamyl-D-alanine C03738 219.0969 1.195941 (5-L-Glutamyl)-L-glutamine C05283 276.1174 1.180897 L-Homocysteine C00155 136.042 1.194834 Dimethylglycine C01026 104.0706 1.183175 Sarcosine C00213 90.05527 1.172497 Ornithine C00077 133.0967 1.056568 L-Citrulline C00327 176.1022 1.17572 5-Guanidino-2-oxopentanoate C03771 174.0869 1.192489 Creatine C00300 132.0762 1.182571 Creatinine C00791 114.0661 1.178141 4-Acetamidobutanoate C02946 146.0807 1.187697 N-Acetylornithine C00437 175.1072 1.192925 trans-4-Hydroxy-L-proline C01157 132.0653 1.181563 Taurine C00245 126.0215 1.217114 L-Methionine S-oxide C02989 166.0527 1.507652 5-Hydroxyindoleacetate C05635 192.0645 1.20381 3-Methyleneoxindole C02796 146.0595 1.20998 Indole C00463 118.0651 1.692711 Indole-3-acetaldehyde C00637 160.0751 1.209203 Indole-3-acetate C00954 176.0702 1.873623 kynurenine C00328 209.0912 1.201079 Picolinic acid C10164 124.0402 0.5588402 g-Oxalo-crotonate C03453 159.0272 1.194332 L-Adrenaline C00788 184.0937 1.167146 Sphingosine 1-phosphate C06124 380.2541 2.132608 Acetylcholine C01996 146.117 1.1879 Choline C00114 105.1133 1.166843 L-Carnitine C00318 163.1187 0.7082207 Hydroxybutyrylcarnitine HMDB13127 248.1467 1.716663 Tiglylcarnitine HMDB02366 244.1538 1.710118 hexanoyl-L-carnitine HMDB00756 260.1851 1.76589 octenoyl-l-carnitine 70679121 286.2006 1.802437 O-Decanoyl-L-carnitine HMDB00651 316.2469 1.935037 O-Decenoyl-L-carnitine 57357170 314.231 1.891939 O-dodecenoyl-carnitine HMDB13326 342.2622 1.986728 Isovalerylcarnitine HMDB00688 246.1694 1.725164 Hexanoic acid C01585 117.0909 1.688335 Serotonin C00780 177.1016 1.515249 Anthranilate C00108 138.0545 1.184177 Quinolinic acid C03722 168.0292 1.217425