metabolite_name	NIST SRM 1950_1a	Q-Std Plasma pool_1a_1	chearplasma_1a_1	chearplasma_1b_1	C-1GUX4-CB-00_1	C-1GVV8-CB-00_1	C-1GVR7-CB-00_1	C-1GV27-CB-00_1	C-1GY57-CB-00_1	C-1H1Q4-CB-00_1	C-1GV01-CB-00_1	C-1GYL7-CB-00_1	C-1H270-CB-00_1	C-1H5X4-CB-00_1	C-1GVU0-CB-00_1	C-1H320-CB-00_1	C-1H098-CB-00_1	C-1H6J4-CB-00_1	C-1H0U6-CB-00_1	C-1H5V9-CB-00_1	C-1H726-CB-00_1	C-1H007-CB-00_1	C-1H239-CB-00_1	C-1GZB8-CB-00_1	chearplasma_1c_1	chearplasma_1d_1	C-1GZ56-CB-00_1	C-1GU28-CB-00_1	C-1H0G7-CB-00_1	C-1GWP0-CB-00_1	C-1H7B1-CB-00_1	C-1GYN2-CB-00_1	C-1H8R5-CB-00_1	C-1GUQ0-CB-00_1	C-1H0T8-CB-00_1	C-1GUM9-CB-00_1	C-1H2N9-CB-00_1	C-1GYF0-CB-00_1	C-1H5D8-CB-00_1	C-1GVK2-CB-00_1	C-1H7F2-CB-00_1	C-1GZV4-CB-00_1	C-1GWY0-CB-00_1	C-1H858-CB-00_1	C-1GYX0-CB-00_1	C-1H5W7-CB-00_1	chearplasma_1e_1	chearplasma_1f_1	Q-Std Plasma pool_1b_1	Q-Std Plasma pool_2a_1	chearplasma_2a_1	chearplasma_2b_1	C-1GXY9-CB-00_1	C-1GUH0-CB-00_1	C-1H478-CB-00_1	C-1GXJ2-CB-00_1	C-1H544-CB-00_1	C-1H1M3-CB-00_1	C-1GY99-CB-00_1	C-1H023-CB-00_1	C-1H6B2-CB-00_1	C-1GYM5-CB-00_1	C-1GXR5-CB-00_1	C-1GWT1-CB-00_1	C-1H6T2-CB-00_1	C-1H1D2-CB-00_1	C-1GYQ6-CB-00_1	C-1GZC6-CB-00_1	C-1GVY1-CB-00_1	C-1H8K0-CB-00_1	C-1H2B6-CB-00_1	C-1H1B7-CB-00_1	chearplasma_2c_1	chearplasma_2d_1	C-1GZ64-CB-00_1	C-1H734-CB-00_1	C-1GW26-CB-00_1	C-1GZA0-CB-00_1	C-1H4S6-CB-00_1	C-1GZY7-CB-00_1	C-1H2U4-CB-00_1	C-1H7S3-CB-00_1	C-1GWQ8-CB-00_1	C-1H6D7-CB-00_1	C-1H7Y0-CB-00_1	C-1GV68-CB-00_1	C-1H2V2-CB-00_1	C-1GYT9-CB-00_1	C-1H1U5-CB-00_1	C-1H171-CB-00_1	C-1H031-CB-00_1	C-1GZU6-CB-00_1	C-1H2C4-CB-00_1	C-1GYY8-CB-00_1	chearplasma_2e_1	chearplasma_2f_1	Q-Std Plasma pool_2b_1	Q-Std Plasma pool_3a_1	chearplasma_3a_1	chearplasma_3b_1	C-1H064-CB-00_1	C-1H3Q2-CB-00_1	C-1H6W6-CB-00_1	C-1H6F3-CB-00_1	C-1GV19-CB-00_1	C-1H3L3-CB-00_1	C-1H6H9-CB-00_1	C-1GWD6-CB-00_1	C-1H585-CB-00_1	C-1GW67-CB-00_1	C-1H5S5-CB-00_1	C-1H1H4-CB-00_1	C-1H2L4-CB-00_1	C-1H5Q0-CB-00_1	C-1GU77-CB-00_1	C-1GU44-CB-00_1	C-1H130-CB-00_1	C-1GV50-CB-00_1	C-1H6G1-CB-00_1	C-1GW59-CB-00_1	chearplasma_3c_1	chearplasma_3d_1	C-1GWG0-CB-00_1	C-1H650-CB-00_1	C-1H2W0-CB-00_1	C-1GX25-CB-00_1	C-1H114-CB-00_1	C-1GZG7-CB-00_1	C-1H2X7-CB-00_1	C-1H0Q5-CB-00_1	C-1H1L5-CB-00_1	C-1H7P0-CB-00_1	C-1GUA5-CB-00_1	C-1GWS3-CB-00_1	C-1GWA3-CB-00_1	C-1H3J7-CB-00_1	C-1GVW6-CB-00_1	C-1H8E3-CB-00_1	C-1H4X5-CB-00_1	C-1H783-CB-00_1	C-1H4N7-CB-00_1	C-1GUR8-CB-00_1	chearplasma_3e_1	chearplasma_3f_1	Q-Std Plasma pool_3b_1	Q-Std Plasma pool_4a_1	chearplasma_4a_1	chearplasma_4b_1	C-1GYE2-CB-00_1	C-1GX09-CB-00_1	C-1H8L8-CB-00_1	C-1GZ15-CB-00_1	C-1H3N8-CB-00_1	C-1H452-CB-00_1	C-1H890-CB-00_1	C-1GYU7-CB-00_1	C-1H0W2-CB-00_1	C-1H6U0-CB-00_1	C-1GYD4-CB-00_1	C-1GY73-CB-00_1	C-1GXS2-CB-00_1	C-1H7K1-CB-00_1	C-1GYJ1-CB-00_1	C-1GZ72-CB-00_1	C-1GZR3-CB-00_1	C-1GX74-CB-00_1	C-1H627-CB-00_1	C-1H2A8-CB-00_1	chearplasma_4c_1	chearplasma_4d_1	C-1H7X2-CB-00_1	C-1GTW8-CB-00_1	C-1GZQ5-CB-00_1	C-1GX82-CB-00_1	C-1H5A5-CB-00_1	C-1GUC1-CB-00_1	C-1H619-CB-00_1	chearplasma_4e_1	chearplasma_4f_1	Q-Std Plasma pool_4b_1	NIST SRM 1950_2b
Hydroxypyruvic acid	786917.3	426361.3	538901.4	747554.5	622302.6	424295	469851.4	127333.4	890670.7	454825.5	829433.1	349902.6	395927	599165.6	404827.9	311091.6	406042.1	498800.5	372653.6	2637016.3	362338.9	510827.7	529849.9	557860.3	727345.8	704376.4	881265.2	642303.6	479272	435951.3	595647.1	650198.9	524149.2	5953395.5	382248.1	446296.3	385609.6	323245.3	515668.1	411142.8	424474.1	550087.1	842365.1	524028	1585559.6	1563573.4	758597.5	709153.6	423177.1	380113.3	774533.5	832852.2	403928.2	286739.3	219331.7	364153.1	296224.6	290555.4	451082.9	868839.5	482020.7	241624.8	165383.9	2455785.3	180673.8	1222410.5	424052.5	691246.2	1128991.7	1576704.2	355865.7	330103.7	737739.6	672300.6	459754.1	460818.2	480747.3	220066	219040.1	701878.6	494650.8	631927.4	275776.4	1050140	2709113.6	5038668.8	363233.6	600597.6	438953.7	1191128	713769.4	3083615.5	399778.3	428156.8	779629.6	430067.3	286120.5	325588.5	623784	888313.8	296528.8	140302.8	190366.4	597769.9	174237.1	282971	322811.5	617951.8	477403	73439.7	405364.1	2295152.3	784780.5	1768731.5	664474	54389.5	906658.5	307849.4	336009	269931	489989.5	1432557.3	393066.7	222330.6	908228.5	4736949.3	576228.9	660680.3	1814183.6	409255	142981.2	179539.1	1431290	392477.6	1820313.1	684564.1	772372.1	163641.2	342611.2	299236	118682.3	646807.4	1257601.6	1749892.2	380777.5	306418.4	968190.7	1257502.8	1151849.8	2025239.1	378764.5	309080.1	277970.9	3050885.8	3042304.9	152232.3	1234612.5	1240118.1	223565.1	2538776.5	214296.4	546700.6	1223396.7	22291.3	0	41705	2361.2	211286	692623.9	1140227.7	448182.1	278373.5	18623.7	298251	322246.5	149530.3	369635.2	993713.4	932454.6	276667.6	235901.8
Serine	15576052.3	22019384.8	12721379.5	12460444.9	19798402	28935364.2	21955998.8	25772396.1	19586259.9	29412089.3	22730936.4	26581467.2	17903428.3	27552551.5	30716367	19884103.5	20447359.8	22782715.2	25162696	21286089.9	31104273.2	16490747.7	31392040.7	22679323.4	12825971.9	12017229.6	27019512.4	22336227.9	23145618.3	29972790	26458379.1	19774725	25836362.8	26612922.3	21733743.1	24963683.8	27028729.8	23358102.2	17591494	27888078.6	21206288.9	23201873.3	23827668.2	29471049.7	16999273.5	21447416.8	13052454.7	13148945.9	28929194	27203991.8	15038348.7	14622786.3	20776663.2	20420013.7	19596674.7	27975624.7	20928849.9	28809362.7	22768294.3	27592811.7	23615569.9	32290026.1	18696995.3	18747300.8	30640877.2	17920757	24110501.6	32869550.3	18376735.9	20985352	26596528	33146916.3	14406561.8	14026463.1	19336616.7	22854735.1	29998275.7	19828830.1	25035191.2	26927797.6	18981428.9	14763715.5	27853442	23096896.3	16335183.7	26272773.8	19444912.4	22222748.7	19788821.4	20319368.5	20577079.1	16835904.2	21180185.8	31865618.9	13537260.9	13323986.3	25527984.6	30228058.3	13058705.8	12349739.7	24746864.6	20994859.7	21281368.6	30227362.7	24541161.1	19852473.5	20866185.4	26422809.7	28414926.1	23919271.8	24800027.7	25165559.9	31732035.6	27633267.3	23522029.5	26107505.5	22985150	24944178.4	26914903.4	17530462.7	13907993.6	15005683.5	23254430.5	22849933.4	16958485.5	24371850.5	19230925.9	21838901.2	12765117.9	17640251.7	23223868.7	22846467.3	20252078.5	15182044	22332659.6	19861805.3	18245148.9	25260736.1	26820096.8	26652448.6	15297013	30672294.5	14469043.8	13873668.8	32917723.1	27396576.8	14548719.9	15732522.1	27747851.7	19445320.7	24668309.8	19776987.6	17535355.3	34583404.4	23456644.6	24861834.4	25872304.4	20142757.9	29189746.7	35503358.9	22212018.7	20805507.5	25202382.5	23649945.5	20580143.7	21068161.7	20635772.8	19378433.4	14662850.5	14664637.4	23509367.2	30083136.6	21126580.3	17736015.3	23762438.1	18317875.6	26312101.2	15018344.4	15675753.5	29095283.1	18333664.3
Glyceric acid	168286039.6	17622511.1	18493631.1	19145127.4	59637130.7	63571637.4	60135778.6	61215723.1	62648708	97378678.6	74252682.9	58927727.6	55890751	69972946	56000564.9	60400647.9	40512482.3	49460881.4	53637991	70994948.2	56384745.8	55684650.4	42217857.2	73525512	19166159.4	17960271.7	67847222.7	62418306	38035084.1	52409611.5	57438894.3	55413666.7	52955795.4	311292150.3	79737929.1	53379044.6	30264467.9	65940669.5	69164568.1	50995947.7	52870758	74738098.5	56711537.9	73957585.5	86511253.2	90715403.7	18413666.8	17905495.5	24223651	1341190	0	0	73341827	16046921.1	91174374.9	54644172.4	61298643.6	57610387	59721287.8	97733159	41903908.2	28937205.1	112463927	126457313.7	63317697.2	100407292.8	66709244.3	59553245	121455667.3	134506659.5	72281967	82910016	0	0	48620006.2	42831943.3	44326234.8	79656367.3	61298045.1	82560407.9	75793850.1	70759800.1	72331064.2	64394276.3	138724380.6	179435203.4	44218603.7	60858228.3	41426398.6	108328333	93081405	147632995.5	34120811.2	38149627	0	0	1782742.5	691460.1	0	0	49456792.8	76197900.3	31995964	73442023.6	40921678.2	47127611	61019651.1	23129882.7	49691947.4	85686477.1	33474627.2	113214180	61216017.6	97469751.7	82885391.1	127112964	102996558	72250858.5	45941055	73709503.9	0	0	46582135.3	51849550.3	87143972.7	140453419	115380632.9	75494498.6	100812756.6	69043511.5	37142224.3	100120692.9	86001120.2	88267553.4	96774902	128630117.2	88841642.7	17330856.5	34437079.5	53118282	77952208.3	128881970.4	0	0	1732895.4	12912672.2	6088994.9	5428583.8	108499821.8	126168750.5	116536651.9	60930946.8	101761585.2	114194203.9	127696996.6	54990739.2	118239435.5	91785774.4	56572090.2	128737040.6	74374043.9	61011970.2	103322714.2	37433603.2	51448539.2	79079397.2	73941468	28380942.9	1545429.4	1092989.6	57371552.6	89335490.5	61723489.8	38651253.2	78319772	38359618.2	92458630.2	3215565.5	2066962.5	10220514	773173.8
Uracil	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	3211441.2	0	78832.2	0	0	0	0	0	0	0	0	163252793.8	118342.6	0	0	198805.9	0	145902.4	0	0	0	0	0	298971.1	121213	204193.5	1244.8	4237930.8	4184269.1	3905733.6	878391.5	227056.8	3962589.5	3115834.5	2351026.2	1296203.1	4535076.4	2975280.7	3881281.6	4256126.2	2660839.1	2803724	3023470.3	1644967.8	3035221.4	3749438.8	2817520.5	3656236.9	4140691.3	661901	3745813.2	4356366.5	2962680.6	3425440	3156288.1	4115533.2	3215746.9	3064218.1	1462637.9	467391.3	3132329.2	1840063.1	4251758.1	3272176.9	3456546.5	3269403	2994664.1	3245500.1	3063853.9	689365.1	3058219.3	2757882.4	2820952.8	3997310.5	3648957.6	7057780.9	3662481.2	4843743	3930239	3433748.1	3503687.7	3288866.4	3698406.7	3657756.6	3518914.2	3599018.3	3671347.1	4194668.1	2663219.8	3333863	4112868.6	2667895.8	2711161.9	3015350	4102193.8	2644613.2	2594530.3	1409415.9	3598186.8	3285194.8	3328774	3796115.8	2541623.4	702561	1251421.5	2719525.7	1149606.1	2477547.7	984433.1	2722295.6	2786274.1	1066402.7	1897394.5	2995458.3	1025879.5	3608405.3	1429029.5	3204000	896613.1	2953498.9	3037865.9	3052166.4	5777789.4	4132538.7	2637960	2116321.2	2645448.7	2627816.2	5010843.4	2501830.9	3161430.4	3582121.1	4046893.1	1346664.7	2131835	3040395.1	1113605.4	2974462.7	1638595.7	2041247.5	14618120.6	528391.4	1699618.7	1397966.5	1739438.2	5978616.5	2616805.3	2544991	2235392.2	2887909.5	2152439.7	2072074.6	1918372.5	1770847.8	2686381.7	2719121.7	2551639.8	4675180.5	2126183.3
Acetylglycine	4328736.3	1462108.9	2963768.6	3061225.5	3846804	3147529.6	3009364	2904990.2	6879553.3	6658073.5	4161504.7	7941893.7	841713.6	3457397.8	3109410	5019062.9	4032669.3	2722710.4	2020666.9	3752850	3043525.7	2770523.3	2919167.9	350186.2	2270816.2	2336374	2762476.1	2879568.8	3412104	6331864.2	4719311.3	2411825.9	5217087.4	5865240	3083043.1	4633093.9	3540600.4	8109326.9	3033081.8	3247284.9	3765700.7	1226822.9	2825754.6	4193318.1	5136015.7	3223479.7	3386302.7	2977208.2	578783.7	2155114.8	2974596.8	3364757.5	3811379.4	295876	5313920.5	4716468	1084529.4	3105816.9	4145328.5	9201500.6	4444875.6	4037782.5	3802465.5	5862189.5	5478740.2	3780597.8	4098179.6	4846846.5	3464661	3576158.7	2896592.4	5555385.9	2869163.7	2919217.8	3500313.1	2783091.5	5802817.5	5669768.7	1788886.6	2608375.3	3668217.1	2330598.6	6538752	3326723.9	2334564.8	3582565.7	1106575.1	2401446.2	4486855.3	2663846.1	3171646.2	633972.6	1477766.6	3712170.9	2913522.6	2513040.1	1441012.2	1367259.3	2953189.1	2591247.4	3408599.7	6606593	3122550.5	2430002.6	4695595	3175798.1	8026240.1	3824704.4	4770426.1	5858570.6	2967346.5	4286487.2	2024694.8	3222874.2	6503994.2	6185613	4394323.1	3030399.4	3505727.7	3401030.3	3765564.5	2458045.8	2130971.6	5382259.5	3028816.2	4628016	3082333	3437242.2	3661134.9	3201208.2	4325491	4985309.5	4071484.4	1014343.3	2259336	2191759.5	3170459.4	857215.9	1194434.3	2464000.3	913562.6	6221883.4	2827595	3033996.2	1685985.8	2843166.9	3528406.1	3576047.6	3195700.5	2895321.8	5075691.2	4213586.8	3956610.4	1212303.8	5075064.4	2493463.5	11402517.5	3620228.5	3014222.2	3420479.6	3934513.6	3184321.7	2839625	1803622.4	3682442.6	1802618.1	3428447.1	2057156.4	2364258	2240626.7	3562680.4	5470621.9	2699321.3	4000007.3	4503684.2	3109876.3	3236862.1	3026609.9	2849198.1	2240631.3	4953374
Pyrrolidonecarboxylic acid	48366438.2	199701624.6	93916537.1	92264271	99362641.9	154244389.8	95053304.2	90797700.3	79884980.9	97160249.8	88672943.9	118662572.5	99720593.3	72560518.2	113007871	130860187.9	88229371.2	125479038.9	151645652.4	63283296.3	132971365.5	85220101.2	320075370.8	97368038.6	100549223.1	97594106.7	72286921.3	111831569.9	91427877.4	118559777.9	90200333.3	75562046.1	71765927.3	238003860.8	81943211.1	72910028	138454931.5	68524133.7	50889785.8	108682059.7	128068772.4	91584451.1	218044928.5	88539746.2	60487837.4	145716643.2	110306316.3	106194915.5	258515857.4	200457547.6	107991567.1	105399458	96439222.4	308234084.7	73540738.9	93731417.6	56550580.9	140014001.4	162079104.4	143525897.6	75176545.9	291999225.7	82586346.7	73347835.3	91137807.1	71330001.1	162537351.5	118775959.4	78106705.9	79276058.7	249992345	142915375.2	106771589.9	104376644.4	98780344.9	120392472.7	89024587.9	72658134.9	122341622.6	110002344	83445707.4	67002314.8	72107314	59120998.8	75918567.9	84167155.6	58789123.8	111330280.1	79615731.6	88656442.8	98645042.6	57361505.8	96014299.7	97151628.4	101567921.4	100646455.5	195121351.3	283567822.3	124625927.5	121225766.9	86263930.4	93261908.5	98486133.9	74737634.8	79575729.8	107851905.7	85363729.9	57750735.4	91754625.5	94832411.2	115411370.6	74388407.6	166843447.6	74296827.4	77150634.4	85576819.7	111560480.5	105360311.9	174465486.4	63980051	136434373.7	126320599.2	119394180.6	114689147.4	64575508.5	113067032.7	80883645	66294639.8	64528707.1	80676536.9	77491696.9	115797479.9	65818169.3	64031908.2	107819352.8	51092602.3	74689943.5	148605735.9	176408701.3	163921601.1	60675791.6	154622155.3	124681173.5	123562582	308797248	218149462.8	111370702	107904246.9	141475105	116140851.2	64884822.9	142475907.2	70281458.1	110731024.2	83115879.9	80010428	66799703	94482792.6	330652197.8	125257441	88726714.6	75985243.6	175322925.5	101502672.2	64239625.1	70809351.3	72250184.9	91357710.5	100765616.4	101466354	183891664.1	115143012.7	70899102.2	76771693.7	79395906.5	77792598.5	120942224.4	107615035.3	101511937	213472936.8	67627528.9
Heptanoic acid	994718	534066	320416.2	444757.9	2034892.3	1095312	498636.3	456627.3	4576024.2	2226095.5	1414641.2	1601057.6	503526.4	2828589.5	829117.2	1852986.1	1925126.6	330802.9	670945.7	3660582.6	716656.8	1079954.9	769367.3	1086485.1	344351.4	0	640466.3	996013.2	1326143.2	1120558.4	2268042.3	465019.1	2478785.8	2322980.2	2508896.3	1249751.2	609150.8	1471353.6	1657724.8	985274.6	1673639.2	405471.7	1180468.7	3082058.8	3099486	715750.6	99032.3	1103722.8	3149224.1	764155.6	1959486.3	2321286.7	787774	1527534.7	802814.4	626510.1	1023533.4	1035148.4	962838.9	718411.1	3305637.8	868273	665731.3	1112600	1176926.8	1463999.7	2106880.6	2029428.2	2394540.1	1040127.1	1386947	1034808.5	810875.3	505419.2	882527.7	1592788.1	986149.6	1350774	1403420.7	1136042	807863.5	7327645.2	798693.6	1379944.8	1507772.8	1232948.6	867923.6	918118.3	792980.4	1062912.9	2470647.1	1038877.2	1009197	1887514.1	1194315.8	499269.7	561944.2	286676.8	593409.5	1174503.6	683159	1377723.9	1518426.8	1143223.4	1281013.1	634419.1	402937.2	485525.7	415529.8	1342424.9	849878.2	1110049.4	345029.2	2080435.3	1428398.3	2871558	846855.1	1323649.9	798183.3	1200673.2	2615438.5	444171.3	823730.3	1652258.9	443454.7	1778908.6	1328329.8	1613664.6	1703064.9	409627.5	977945.4	1334344.3	2057984	1091821	2001897.2	361873.1	876213.3	574896.5	1493759.7	834141.1	600131.6	4796658.4	4495767.9	3680498.7	2794385.3	2546299	2097287.1	1709244.8	1085677	2386687.7	2001356	799575.5	831844.8	2064733.8	2478520.9	1111213.7	2650273	2065086.1	792742.1	638884.7	1641549.1	606922.2	891182.2	131797	1425828	320885.7	4953698.8	533712	206641.5	102173.3	445611.4	2428929.1	611210.8	2450400.4	2355773.1	875251.3	681400.4	952837.9	856008.3	788657.2	1027553.5
cis-4-Hydroxy-D-proline	5633942.8	5379483	5748918.2	6049396.8	10108951.8	10956147	12138187.4	10777807.7	9545897.9	12630305.6	10145547.7	13799299.6	8134905.7	10547834.6	10344272.6	10334312.3	11037771.8	9207912.1	11893934.6	9973826.9	11590824.2	8502270.7	10752678	9867200.3	5781848.6	5648773.3	10465854.8	11388191.4	11981219.2	12729137.8	9735638.2	9074188.5	12483301.3	11725291	12385628.1	8574714	9947318.2	10076460.5	10126694.9	9332029.6	8858497.7	9447321.5	10831827.5	11356013.1	11799656.1	13074062.2	6174202.9	5861956.6	7070061.2	7231831.2	6241896.3	6307189.1	9854747.1	10089944.1	10230303.7	9695427.3	10099389.4	13320627.8	10062850	9763023.9	10697554.5	10209224.9	10802343.5	9146050.6	11218253.8	9151225.6	10392019.3	12673647.5	9295886.6	17595878.9	11752940.7	11672745	6456921.2	5903259.2	10488232.3	12886327.9	10127318.5	11599747.5	10946917.8	9494393.2	10126698.6	8073975.9	10291237.3	7630141.9	8693332.2	10411149.7	8168415.1	7667895.3	8314633.7	10091147.3	10102382.6	7193095.1	9063478.3	10356508.7	5780389.9	5419424.7	7166348.9	7312192.5	5990916.2	5791211.2	10750109.8	10207079	10803992.2	10902536.4	10675999	9296198.8	9443635.8	8632612.1	13226667.9	10867081.9	9335062.5	15126938	11544699.9	11595299.4	10117013.7	10596235.6	10028559.5	12599784.8	11503200.4	9589992.7	6428909.2	6445095.9	12563776.7	8833899.9	10088451.9	11635885.7	9876000.9	13924804	8656047.7	8216110.1	9627208.2	11694113.1	9466165.1	8046811.3	9797248.8	7839487.5	9571563.6	10180917.3	9387365.6	8799527.6	7636756.7	12284459.4	5873693.8	5513756.3	5893002.2	7729997.6	6827664.4	6694585.4	16523616.7	9517742.2	9617094.4	9718773.3	9757272.4	14236088.2	12742258.1	9228675.4	12212068.5	11280630.9	9889147.9	13312390.7	11512196.9	9555946.4	9386593.3	10056337.2	8955822.7	9474625.3	10364648.8	10265603	6631259.6	6438514.1	8997599.6	9744923.2	9289291.9	8781371.3	10572991.1	9206111.4	9859553.6	6796910.9	6611163.7	7515918	7428188.6
Hypoxanthine	64465876.2	185629202.7	84577935.1	82817670.5	227629004.6	266734975.2	353616968.2	185200526.7	157742049.6	165959660.8	222392443.1	207350259.5	181787210.9	188357522.8	194738803.3	245880101.3	134106913.4	148122675.5	191593691.9	216591891.8	160067001.5	158701227.8	259154132.2	187991416.4	84837216.5	87012720.3	185269235.9	229876073.5	222533084.1	193641740.6	158969281.4	219409723.9	124580395.3	691627067.1	233482445.7	161757944.3	132819658.3	194317751.4	199623405.1	190574359.9	235749558	170008283.7	325264197.5	316787948.6	212629511.1	415728579.8	91383032.9	90446999.3	203141998.4	194343562.1	49185534	44298711.1	366714099.8	147896961	218411065.9	138672976.3	172273464.8	416766518.7	295316702.3	179723725.9	123676490.6	195380178.8	258332404.8	269483031.5	182845707.9	177332401.9	240761640.1	205704914.6	213609428.6	264079224.7	210585335.6	172364130.6	41464413.4	39482265	181047005	209694871.8	180693515.7	199451654.5	252860540.4	163681305.8	199613258.7	212803802.6	202682595.9	147795391.5	229934885.1	436544436	122798479	398405022.4	169596734.6	215993980	296035616.1	188062817.6	107623900	407557491.3	35953687.4	32153798.5	197227813.6	213051153	52147448.8	48537840.9	150372214.1	172708330.7	379499122.5	185731994.7	248748629.4	170156815.6	156974866.7	145499542.6	179377595.4	544091747.9	175640691.2	241074585	242342012.9	205819721.1	167516444	350491260.2	292108761.8	180524380.4	171790135.4	168880077.1	53952482.7	53661296.6	152870572.5	180673657	211655081.8	366425505.6	176191232.3	227726701.6	353712877.6	141720785.9	210632546.9	220083084.7	156476490.2	177488792	242346707	146470407.1	227742195.2	173852674.1	227226302.7	200484295.4	130136485.9	271361677.5	50445884.6	45874176.2	227795986.7	195039223.6	72631516.7	72600146.2	215256908.7	445056524.2	191539552.6	384810673.4	156788451.4	200200063.8	300266353.7	249240808.3	194223195.4	209832634.7	245801974.4	205919776.2	181669339.7	159425178.4	413726899.9	144524089.3	325549533.1	205970914.6	303830561.8	216523935.5	70070282.3	70530487.2	332524114	145294996.1	165971456.2	136475631.9	297231747.8	125917878.7	194547613.4	74206665.7	70735488.9	189327302.5	51647967.7
O-Phosphoethanolamine	1133001.3	4194355.8	5345744.7	0	1567255	6220163.4	3006445.2	4218649.7	1137108.9	7349627.8	4677169.3	5457046	2595558.4	1230090.2	5210210.1	384332.5	5331358.6	4776678.9	7123001.5	6679122.8	3979901.2	1956861.5	5769886.1	5362960.4	1654393.1	0	5033010	5347081.5	5428620.2	4401953.4	4472548.8	4983523.1	4511535.1	0	3722377.9	7362931	5450359.9	4251256.9	2948824.3	7111380.6	4388557.8	5086773.5	5709242.4	6017479.1	4455007.3	3699767.2	4707823.1	2151260.5	5668713	4667260.4	785643.4	4075920	1780754.2	4870385.5	2250035.5	3964033	6366052.3	6014298.4	6405049.8	6443478.9	4577112.1	6588025.4	2344037.9	4838961.7	3603821.2	4330606.8	5627990.2	7367017.3	4972009.5	4572951.4	4587266.5	1629200.3	6628835.2	2556323.7	5471262.1	3919565.2	6268867.4	3822240.5	7476728	4310153.9	2201280.8	5491501.2	5237147	4396196.9	4512406.2	4746081.8	1983016.9	6077181.5	1935019.3	7768748	3070591.1	3362208.6	2268154.6	2409520.7	6452192.3	5321658.2	1610888.3	4562451.2	1712297.9	5300695.8	8163770.4	3955923.4	3009618.8	1415957.7	3306742.6	5593728.6	4746983.2	5093594.2	5727325.9	4556347.5	6477686.2	6525766.3	5559144.2	3185940.7	4850194.2	4706235.8	3021807.4	4857042	5809795.8	7600251.4	5345587.2	7400166.7	4336743.1	4327601.6	4420964.5	5082417.1	5218166.5	4093152.6	0	3669216.9	3703883.5	6884256.9	4920620.2	3083750.6	4632680.5	1987180	848933.6	4138655.5	2053527.4	5545268.6	3556120.3	4878159.8	3072827	7690110.2	2388812.5	2624846.7	6486218.2	2386461.6	3867605.3	5039611.1	4868537.2	5456539.5	6168967.4	7123373.9	6812987.5	3652301.6	4290839.9	2077971.3	1070813.7	6246729.6	7482519.5	4973763	5331783.2	4464494.3	5183849.2	4155285.9	5411420.7	5786231.9	2135973.6	1943874.4	5348527.5	2456667.1	3671659.2	6499120.7	5296584.1	5313143.7	2502565.6	4317245.7	1499455.6	3158901.2	1706035.6
4-Acetamidobutanoic acid	1308624	1075810.7	1006919.5	1023820.3	2801042.4	2837063.2	410236	3606154.4	4349104.4	3399696.4	4421356.8	1733761.7	992498.8	4030634.4	2127108	4560417.2	2479228.9	1251713.3	1263704.5	4513452.1	547657.6	2680132.5	1335512.3	2209833.4	904968.7	995174.3	2819373.3	3251377.7	2990470.4	1897805.9	2070780.4	3279563.6	1285658.6	5757723.4	4446155.3	4060504.9	2814008.5	3824999	3627765.7	2596745.2	2856592.8	2700652.1	495546.7	1474016.6	3172290.7	4458473	500516.2	491204.6	1047272.9	1436633.5	1355657.7	1385181.5	2849715	1274401.8	1856640.7	1600879.6	1746235.3	3086130.9	4737362.5	6863501.9	692475.4	1688060.6	1836846	2503590.9	5156675.6	559939.9	3490377.4	4744671.5	3321862.1	2546844.2	2582554.4	795948.1	1342486.3	1268911.6	1801406.6	3501260.5	635989	3406628.3	3215619.2	3769262.6	4966007.2	2382159.1	1915634.9	1529707.1	2453001.3	4709362.8	1704330.4	1486999.4	1702062	1544833.3	2215888.1	1664089.7	1649901.2	3535668.1	1429048.5	1386871.8	1366934.9	1109637.6	1016427.6	1141713	1524479.7	2579244.9	1780082.6	3004468.9	3865398.5	1412137	4613971	1826620	3441692.6	3593485.3	1831099	4137147.7	1708278	2812200.2	3324806.6	3272973.5	2933673.7	3109901.4	1319660.5	408523.4	960860.1	1154922.9	4113925	5320127.2	1519838.9	4122901.8	2777138.4	3741051.6	3819845.1	1501676.9	1537132.1	5709893.7	3036261.8	1374454.5	3209837.7	1844016.3	621038.4	1385177.7	1764608.9	1604052.2	1109991.1	5037622.6	1611331.4	567040.1	1311375.1	1834202.8	616004.5	1583842.9	5155124.7	3393572.5	2537441	1271207	1715699.3	5004164.9	4620109.2	2027832.5	3104419.5	2870973.4	3753490.1	4384223.1	5458500.2	2069428.8	445355.1	1964596.2	1812721.4	2103442.2	3103865.6	1653331.5	1256432.9	1449782.6	2105629.6	3608633.6	1759992.9	1427184.8	3643354.6	1574178.6	1527398.6	1332964.8	1508645.4	1644087.7	1157812
Oxoglutaric acid	10263010.6	37679935.4	36344688	35887800.5	3979932.9	3914413.6	2320752.9	3468513.8	6223150.1	4268609.3	4538234.4	5018312.1	4403510.8	4871991.3	5860908	9515321.4	4014880.7	4475028.9	5281821.1	2135863	6777958.5	3614999.2	22166676.7	4388293.2	36141423.3	35733393	3457728.7	3652314.5	3631503.5	5369080.2	4092003.1	5981976.2	4266549.4	8053760.5	2383204.3	2664423.2	6841189.7	3246508.7	2415707.6	2857362.6	5679086.2	7982210.1	9257055.3	3189115.8	5096168	3869121.4	38855744	38021746.7	57037498.7	48071724.5	39825082	39366709.6	3339057.6	43368947.9	2044633.3	3161160.8	1392877.8	6501552.8	9490019.4	8515118.1	5818585	15914650.3	2639455.5	4528146	4948484.5	3845650.9	14679491.3	7748314.6	2999514.9	2274670.4	13148272	4177153.4	33699725.1	30523671.6	5925689	6069078.5	3655962.4	2980835.7	6242642.4	5102177	3530546.5	2106770.6	3763330.5	2870303.6	1760076.2	3182732.9	1213244.4	1924711.2	3987300.4	2781896.2	4473254.2	2412629.9	2563780.5	2278813.3	26820436.2	26242282	36347203.2	53626978.9	35279632.3	34499446.4	3908930.9	5208310.3	3170692.1	3349929.4	4451976.8	5807956	4708959.7	6546471.8	3397203.9	4096821.7	6821949.6	5979876.1	6377815.4	3817803.3	5005820.5	4703783.6	4061029.6	5488097.1	12487748.9	4437511.9	40778433.3	39921824.1	5620248.8	4751869.5	3658596.7	5598437.6	3912263.3	3116101.3	3111070.1	4139002.7	3951022.9	5157054.1	3552554.4	4001190.8	4287975	2667483.2	3392095.4	7555762.5	3176049.6	11853961.7	2946790.3	8401989.4	34923924.4	33574695.8	39891783.4	45945701	30186810.6	29933065.3	3578067.4	2935106.8	2410698.3	4700705.1	1282023.3	6114063.6	4281831	2473304.6	3178660.1	3820745	32154572.3	5657819	5505723.7	2027483.2	4484393.7	1609097.1	1717733.5	1374427.9	2763049.1	2619300.3	23461407.2	23993950.8	5919950.9	5773223	1703996.9	3919448.8	2372781.7	2347863.8	5695788.4	29589586.9	27297251.8	44035531.9	7845835.6
Glutamine	242208643.3	115250765.7	135802811.3	133832923.5	221974335.4	257417813.6	305670096.3	271464186.7	194498378.2	332781293	234321216.9	289785969.4	224080409	253879317.6	256390903.5	216742489.8	245529955.1	284395308.8	300514992	251533915.9	301114312.8	243391721.1	248516504.7	263316319.3	134132037.2	134437736.9	253728848.9	297905359.7	273016808	287369770.4	229129861.1	248618060.8	284919716.6	301331062.5	317570624.2	242413622.7	300675111.5	254756014.4	223452653.4	314119493	223420014.3	231864686.4	289846590.1	275060866.1	260040752.5	280596764.8	143901703.1	136903080.2	136547272.1	131253389.6	145313042.2	144633428.3	213851528.6	226635305.8	346397823.3	262280297	196800578.8	249782675.7	303767163.8	293995494.9	254458586.6	252579203.5	287543211.6	252868399	292860316.8	274947431.8	246997775.2	265200878.6	279119108	251582191.4	245285452.7	286109098.6	134828192	136138964.8	222503360.7	233711362.5	313171533	318011924.7	293228644.6	307103652.8	269375231.5	198063469.9	220408615.7	231788918	256780919.9	259855179.8	259557044	247757285.4	228229790.9	232401303.2	304470950	219004045.7	256208152.3	327359877	135986878.4	138894775.8	124384613.3	129561569.3	135852061.8	132556911.6	275249431.4	257364415.7	271352154	303298431.3	236939756.7	295742055	265003640.6	236109682.6	312513476.4	304412633.3	254334220	252394110.4	260670107.7	245325115.8	246855791	306277849.8	248654417	270069421.3	304310294.7	271586438.4	146726670.6	142768213.9	221170525.2	265078287.6	240444407.7	371664172.9	307416351.8	208488275.1	218468343	241268664.7	274139104.7	278676986.8	257178320	196973286.6	210151274.5	276479776.3	258531299.9	253161901.3	268014697.5	257472883.7	229327360.2	303168423.2	141380985.2	136927701.3	129024104.4	142370368.3	164168899.1	152539986.9	327163067.4	297048359.8	292686766.6	239325810.7	257507690.5	305868970.3	279873543.6	250383829.6	271742574.7	290198510.3	252449923	326649421.4	223635149.9	234222473.7	225514301.6	294574008.2	224913167.6	225254475	174279998.2	226526000.5	168152133.5	158161381.3	317416019	310733794	226508394.4	256227251.6	223648955	281159046.8	307494522.5	163491562.6	163699607.5	155393350.1	280619046.9
Mevalonic acid	2555957.6	0	4640225.7	1757942	5916115.8	0	0	6067309.9	0	0	0	0	0	3063801.4	0	8232539.7	4018719.3	0	0	2547202.3	3838848.4	3982018.8	0	3601173	2050147	1560751.8	3110802.8	678905.7	3148483	4502699	2213695.7	4246016.4	0	4271484.7	4562254.2	3186911.3	4323348.9	4679195.3	3517791.1	0	2346277.2	0	5670003.1	0	4605680.4	3829743.4	2201453.3	1709586.3	0	2646793.1	2109561.5	1028321.4	2576557.8	5298824.4	3325178	2211892.5	1704447.5	4662655	5733673.8	4172706.4	3442387.8	0	2025436.4	2036493.9	6361951.2	2001765.2	4400440.1	4223292.1	5619127.5	4459000.7	0	3818712.6	1890412	2937656.1	4508538.1	3565840.9	5692391.3	5668766.9	7626283.7	5553969.7	0	1275466.1	2658721.4	4274309.7	2887993.5	4855873	3021058.4	2545454.6	2683973.3	4145032.5	2406835.3	2951304.2	0	5363157.8	1768522	2287309	0	0	1213816.6	4559232.4	2793383.4	0	4076718.8	4311118.2	4736399.7	2290176.1	4429844	2017832.9	3951476.1	4431973	3169674.9	5063290.1	4796501.8	4558224	4665175.1	4488300.4	5398276.1	3137703	3553108	4502532.8	3139245.6	34687.8	4981689.2	3926587.4	4643391.2	3281928.4	1440552.8	3468858.8	4026339.6	4250636.5	3002771.7	7243597	4711917	3425848	2373107.7	4360633.3	567858.9	782230.6	2370456.5	5250595.5	5367628.1	6385530	3239107.2	1618446.2	2898371.6	0	1957256.1	0	3893929.9	0	0	3569974.4	0	0	4664199.7	0	3138697.7	3592994	0	4782265.6	3429937	2860700.3	3374285.5	6733168.9	3089981.2	2583863.9	2525501.4	0	1671122.6	2517940.2	3696777	7283073.6	1896200.2	0	5557750.9	5728284.3	2300998.6	2345563.1	2310308.1	0	3181264.8
Ribose	10625158.1	8299574.8	8872157	8929303.4	12356648.7	10434687.5	9568839	7146550.7	8779385.9	11297419.9	10961914.8	12640161.6	9860087.3	8801274.2	10465368.1	20334524.6	12065538.3	6760236.2	7615693.7	8264601.9	6436211.1	10319899.3	4880115.4	9520163.2	9393804.1	8994717.1	11996014.9	11342106.7	8301496	12123461.7	12470233.8	9423318.1	8247838.1	21170085	11051106.5	8551414.9	8438194.7	10303058	11484525.7	8906208.4	7587201.6	8550123.2	7388715.6	8026753.9	12671561.8	11679874.9	9824734.5	9484404.4	10049011.4	9155534.5	11010894.1	11479463.2	11514767.4	5252919.6	8954768.3	6560428.6	9559465.8	8124156.3	11635570.7	20528475.8	9579586.8	4713055.1	10568672.5	9899406.6	13021347.5	8476077.5	11336809.7	17939474.8	9609512.9	10013499.8	8603750.9	10153503.3	9108795.9	9576371.4	9634036.8	12225092.8	9712073	12674631.9	14909076.5	9207990.8	8939207	9610288.3	6791542	7408657	8423967.5	7600923.8	8709016.6	8036211.8	6640851.3	9778075.4	8706993.4	8286776.3	8190206.4	8466808.3	8191919.6	8920404.1	8978043.4	10567905.3	11726638.6	10628622.8	13036689.6	8929668.6	10866053.6	9704627.8	9940953.2	6885262.7	7850633.5	6462779.7	8442603.5	14624256.9	7437111.6	9257448.1	6630766.4	18046539.5	11058698.6	11008704.1	8373349.8	7702360.7	9538361.7	10376001.9	13441891.1	11342567.6	9986183.7	7614094.9	7346294	17003300.6	8747421.1	9434060.6	11620730.5	7162703.9	6557763.1	10584399.7	7909658.7	8285528.8	7627413.7	8513403.1	8792215.4	7898898.8	7605396.7	8841772.2	6967109.2	13092500.9	12285362.9	10373656.2	7734279.5	11519602	10412879.7	10584842.6	22029942.2	8726692.1	9269734.3	7318262.4	9403768.5	9846799.3	10925477.3	8486275.1	12573588	11113132.2	6807625.5	11182718.7	7059308.1	8350394.2	7495542.3	7507823	6809405.8	7430822.9	10744895	8120524.2	10289607.3	9776721.4	12262965.5	14093452.3	7743741.1	7468769.3	8480758.9	9366391.4	8104608.3	10458236.6	10078044.2	9803407.3	11742794.6
24-Dihydroxyacetophenone	5217221.3	690763.2	1070054	896950.8	38074001.9	3011348.2	8691206.7	5420692	15285440.3	54211832.1	4547031.4	53439357.6	765519.9	3982109.3	5574547.3	21188180.7	3163894.9	2353021.4	796807.6	4188953.2	1106468	15030926.2	1437760.5	108539727.9	1085685	1104432.9	1593896	20030950.9	3306304.8	39474238.8	45865363.4	2338209.9	7911662.4	3314652.7	5837192.8	1211717.9	12706996.2	4025250.1	2732060	47022900.3	7635849.7	90686625	20125741.4	2014620	1181153.6	53106220.7	952204.1	1487069.7	1491046.7	2905480.9	3099995.4	2320362.4	28641230	3230872.3	14488641.4	4210052.4	11070091.8	1631306.7	20925146.4	3228246.4	4610329	10738641.5	93033523.3	4776046.9	7484883.9	5369875	5588863.7	89421377	6455949.6	34396024.5	1226682.6	779724.1	2166655	2624880.1	2223117	5898534.8	8293776	34997187.7	16556591	4891053	82356903.8	25505026.5	2823586.2	1577567.8	6108599.1	2268428.8	53393822.3	4976311.8	5622858	3195844.8	62262674.8	3568717.3	2712422.2	8191396.3	2923058.5	2719770.9	3383162.2	2180617.7	2695063.1	2046814.9	17788437.9	12549032.5	11396363.7	4753968.2	1774517.6	5828988.4	22315730.7	12746268.6	6287149.1	27301898	3043044.4	5816763.4	4365839.7	68303230.6	7109392	4441461.4	11436454.6	4267500.5	9571069	5256496.3	2587119.1	2325890	3974631.3	3573668.8	7450820.8	9708498.5	49891128	7988696.7	23398204	3161522.5	5577050.5	13013772.4	2714593.9	3356179	3023245.6	5717931.8	7282105.1	58148109.3	13235751.1	78044207.4	123414769.9	42967867.8	3090696.3	3174825.2	3568850.6	4699655.1	3716875.1	3191887.7	9228169.2	7985441.6	8386899	7548882.7	20086545.5	3808425	13750124.5	6418642.1	10657014.3	14631800.5	17608072	3714379.2	5424511.1	9137923	82024245.7	6186562.1	68030684	9616103.8	83828391.3	9354665.7	4061354.2	4582952.1	13558948.3	7688737.8	9950893.1	29886931.4	3980284	7604565.3	5536474.6	4832767.9	4119069.8	4640919.8	13573738.2
Histidine	33200043.1	43570871.5	31877570.9	31971229.5	63037481.4	65311621.9	69993938.5	62942559.1	67448883.3	79742864	64487357	75858493.6	56748854.7	75128831.9	60023051	56958093.3	56709582.9	60925281.2	66983866.1	66692603.2	68148203.8	53936857.4	97533420.2	46778756	31243147.8	30881289.5	62247337.2	63127848.5	66674663.8	68055766	63570535	65416942.7	58554929.4	63002366	64811768.9	51539605.7	75377252.9	59218106.5	73781866.3	73703914.1	96860448.3	49315334.4	58857227.1	67893181.5	55729515.4	77403864.5	33722544	32042331.3	54948185.3	49893018.7	31982886.2	31906591.8	55741159.1	53030965.3	73237468.1	57359201	51279619.7	61506344.6	67327268.6	71539334	58209306.7	75710586.4	53422616.7	65874488.1	61625344.8	66007831.3	55970435	45893462.4	72871069.9	98426415.2	60207464.1	72153153.1	30744518.7	29759135.4	60256866.9	67184922.1	95752733	71991205.5	62734302	66563170.7	64731344.5	58803823	58795735.9	50144123.2	56082475.1	71572125.8	51373175.8	51062895.9	59829042.8	69827414.6	60792517.4	56724185.4	78931032.6	75143054.9	30793257.6	28073833.2	49287738.9	53422733.8	32499801.4	31236739.8	64819636.8	72184467.1	62177894.8	69120667.7	48947025.4	63723929.7	48134313	53095978.6	73412927.6	68966982.8	54310739	60663156.3	59722143.3	76659629.3	61287369.3	80737768.4	57186029.9	62238257.3	57028914.9	55384723.3	35307918.2	34312870.1	55303535.4	63721877.8	52378938.7	85959161.8	65726720.3	44063299.3	64177013.8	55585237.7	78954010.6	83725572.9	59254773.4	45403903.2	58221846.4	77480841.9	58137983.4	64737699.4	102481565.7	57628827.1	49843756.5	74067869.2	32683020.9	32454286.9	52504865.7	56385286.9	38740553.2	37017146.5	86440554.8	67775646.5	62585530.4	61610637.6	62924245.5	87661253.3	88477607.4	60683132.5	70329770.2	57710416.2	77384441.3	82674715.9	63986390.2	56549044.9	60588413.2	61637104.2	60678820.5	57267622.1	42567599.4	58930222.5	35090643.8	34660933.7	74732031.4	59690862.7	51266559.9	57275034.4	70010026.9	56241492.4	76620094.9	36048669.6	36814055.2	52819162.2	37663413.1
Indoleacetaldehyde	20852761.2	10282730	5570450.1	5357697.3	6799612.1	15171995.3	11376761.6	6881816.2	9187239.5	7200309.4	9358025.3	9041039.8	7594304.4	7599577.1	6136222.2	9387703.1	8473122.4	7078924	11660125	7590498.2	7470680.3	12061450.6	10151286.4	6395776.5	6073305.4	6412619.7	5411175.1	8880111.5	5947762.8	5780884.5	7409027.6	8377216.4	7985558.1	9826054.1	9692086.8	9416464.7	7345739.9	10870342.2	6437844.7	7308307	7508683.2	9607864.7	6505350.8	11512377.7	8219608.5	11412297.6	6008488.4	5842682.7	6286759.9	8070680.2	5949502.7	6104094.9	7225115.7	8594342.5	8582072	9086163.6	11047558.9	6765624.4	6195989.3	5379434.8	6286941.2	7311999.5	5443851	8440820.9	6214650.4	8512996.5	6920131.4	5241364.4	6042623.3	6561882.4	11425939.5	9218896.6	6101029.5	6373828.6	7853500.2	5757493.3	7478936.2	11425490.2	8272625.1	4208932	7451742.5	8041161.4	8781030.1	10333527.9	12315533.3	9648498.6	15686120.1	14675031.6	13091771.6	15800682.5	9488724.6	20035844.5	12269627.2	5404171.7	7725771.4	7474622.8	8835230.9	5882330.4	5934141.5	5498725.2	12798013.1	5228468.1	8392839.9	11005868.2	3953884.6	7282728.4	8804201.2	6248065.9	4956098.7	7438503.8	4962272.2	8030787.1	7042771	6598477.3	7414878.9	9438732	9447413.6	5805294	5789553.8	8885830	5792617.9	5732512.4	6379384.9	5727153.1	7930695.8	5778852.3	9038683.2	5804976.8	10158932.5	16838715.7	8789770.9	6117265.2	7749159.6	11916046.6	12387945.7	17092742	13594940.2	8821802.1	10058538	9505020.7	14954110.3	6469406.1	11072479.5	8984761.9	12539010.3	6385813	4787634.4	4670603.8	9436823.9	6407774.3	8280031.4	10514985.8	12081333.6	8804742.3	10679755.8	7691808.9	8739065.6	7598495.3	4695853.9	5287044.7	2269258.4	11019208.8	12124244.1	12008544.6	13380543.8	13416260.9	11453684.4	11704187.5	6759125.6	8214402.2	11163811.4	7764191.7	10162018.8	8969998	9452030.9	16628782.8	11997361.6	6023041.5	6345497.4	5700537.5	13846244.4
Aminoadipic acid	2158869.8	2016089	3078370.9	1533311	5642842.7	3590752.1	5652952	3639037.7	5427825.4	5533887	5589153.7	5134715.5	3321325.9	6847196.8	6230653.6	4225116.1	4478245.5	2892032.1	3033605.1	3449600	4699885.3	5531270.2	3195956.3	3301620.6	3083098.6	1631996	4747548.1	4673245.1	3960891.3	4594128.6	5893294	3505195.1	4837254.8	9692373.3	4625734.2	4264868.3	4320861.7	4755668.2	5351363.3	4589443.3	3772347.2	3663580.2	3860316.1	4324321.1	6533487.9	4763926.1	3558743.5	3112567.8	2428995.3	3791977.2	1963908.3	2333361.7	3855531.8	4046286.7	4491030.6	3793287.7	1947210.2	5688650.9	3735440.7	5002271.8	5653688.9	5191827.7	5221294.4	5179645.7	6532032.7	4793454.6	3524668.5	9818859.8	4916832.7	3460761	4199228.1	5300690.2	2422849.2	2318901.8	4442566.4	6478128.1	4706698.6	5863981.8	5571047.9	4740829.4	4183981	4012735.1	4631203.3	3717343.1	2779187.6	5510524.1	3380814	3350554.8	3382992.2	4002523.2	4235858.8	2730368.5	3407070.9	4688387.5	1653934.2	1952557.4	3285063.3	3006498	2294063	1699408.9	4665526.3	4210591.7	5529771.6	3769396.3	4715590.5	3365953.6	4858110.4	3604100.3	6347009.6	5577331	4008712	5767671.2	4713036.1	3978202.1	4146407.2	6351255.7	4151183.3	4566783.3	5847714.1	6133846.9	2356782.9	3404733.7	3971397.5	3538704.6	4316565.9	11378965.6	4105347.2	4061626.2	3358732.9	4297626.2	3668070.5	3927617.3	4163977.4	4050456.2	3879860.4	3418463.4	4667196.8	3715777.7	3877520.4	4711118.5	3056278.1	4316272.3	3138108.8	2244682	3381871.1	3978131.6	2616928.5	2677630.8	5374288	4161724.9	5402614.7	5047656.3	5451394.8	6846647.7	5487599.6	3871374.7	6668405.3	4945303.8	8704130.4	6277809.8	4344281	4051602.8	3525899.3	3835813.4	3509950.4	3912279.4	4912697.1	3601067.1	2084941.6	2153632.5	3478158.4	4919293.8	3667950	3554763.8	5098163.8	4801881	3529618.1	1977703	2488047.8	3373293.6	2403224.8
Fucose	2360389.2	1501529.2	1740562	1311479.2	679378.5	1641497.4	1465914.3	1111579.2	1151377	210596.5	799430.2	663201.9	17189.5	2630249	1051351.6	2549563.4	2252115.8	1558159.5	1524729	2521562.1	630915.7	531002.5	449211.2	1066890.3	1091732.9	1401898.1	1454117.8	1659799.4	2649451.7	879970.7	1546500.1	2619467.6	1376973.9	995620.9	1194281.4	1145101.5	0	563227.6	3250291.5	1355518.9	828857.9	782996.5	1359632.7	347634.8	1680843.1	1024197.8	1674184.7	1335142.4	2094890.3	1287321.2	1203108.8	1065912.1	1334127.8	681145.5	1221987.3	610110.4	563227.2	1071348.5	1679860.9	2926524.5	657270.1	724535.3	1122840.3	609405.9	678240.3	1130327.9	1040618.8	4116582.4	1493301	2479348.2	641640.9	1878492.8	2698867.4	2201030.7	931865.5	774229.1	1490627.4	2348264.4	2376067.3	672467	497332.1	954895.8	647495.3	818474.7	875521.8	2148262.4	493053.2	1014496.8	621466.1	854163.4	1335827.6	793821	806400.1	1551628.2	1552184.9	2151518.9	2607041.3	1998036.9	1146246.8	1553055.2	2267655.8	2682216.6	3420502.3	861039.2	976458.3	3195371.3	1916587.3	921946.3	1066188.3	694439	667768.1	531226.2	837022.1	699850	1480135.2	751687.6	1076381.2	558060.5	1173518.6	690451.7	1392593.1	2827777.9	1003049.8	686792.1	1612110.7	1767024.6	1559682.1	643266.6	2337669.4	588202.7	854525.5	757583	428793.2	611501.4	585028.5	559126.1	1423827.1	1495966.7	177758.6	620459.9	2291159.1	1201858.2	2023797.8	1355222.1	1627670	2329824.4	1868912.5	1813279.9	425648.5	831519.3	2324922.2	1640336.5	396019.6	1158582.1	904265.9	981410.9	1530789.5	799755.6	215176	2411425.7	2222768.6	903175.1	858936.2	1441131.5	1540168.3	243400.9	1057290.9	453403.6	2349645.2	2472277.4	729905.6	471938.3	779378.4	375474.6	956338.6	1531792.8	1053542.1	2207338.7	1465235.4	1175048.5	3323834.7
3-(2-Hydroxyphenyl)propanoic acid	2035170.6	3290978	1293049.8	2520872	6949940.9	7917173.9	5164119.4	6190197.7	5760504.2	6515817.5	5288672.1	6456205.4	3438142.5	5817272.2	5994048.8	4766757.4	7461216.2	4838501.5	5892088.8	5477922.3	4476751.9	5611756.9	4381696.3	1937329.5	2336403.9	2049976.7	6427040.5	5370717.5	5556798.2	1702051.2	2245676.3	6269699.4	6330294.5	2933127.4	7831433.9	4398659.7	261890.9	2950027	4792873.8	1773616.8	4827194.1	5844589.3	5188011.7	1323466.3	2116747.7	3649302.8	1585492.5	2108193.2	3246332.2	3138212.2	2702010.3	2068792.5	6769946.1	7982545.6	3585046.8	5382874.8	6488110.3	3439931.4	332257.9	3486063.1	5187139.8	6572393.3	5267124.2	540102.4	4600763	6390417	3899644.9	6217889.3	6042034.6	5963860.6	4356000.7	5065861.2	2881657.4	1998604	122061	5610983.8	3994097.5	6047181.5	7181123.9	2768090.7	2835841.5	3085975.9	2583730.4	5198068.3	3672749.5	5535500.1	5966200.3	4051486	5138188.4	5866760.9	33026.9	7120831.4	7280216	5080311.5	4695365	2242048.5	2320918.3	2881964.4	2735151.4	2114901.9	4195364.2	351013.2	8010740.2	5278314.1	6145000	2879519.6	5058707.6	3544919.8	5304783.1	4206625.8	5341999.4	4503003.3	509615.4	7441546.3	6304004	6450169.8	4106167	5101753	3305904.6	6859437.4	2045980.5	4829262.8	4550479.1	2896379.3	4575081.1	914696.9	398200.7	3494136.3	7771146.2	5275681.2	3675017.3	6370187.2	511015.1	4542320.8	2337787.5	6026906.5	5453316.9	6967316.3	7408815.6	5572032.1	3837561.2	3433184.1	3598528.5	2393549.6	4441380.4	3845260.2	2362354.4	1370755	8154269	3551392.4	5504811.7	5484365	149570.6	3436553.4	5060843.1	6734432.7	5133686.8	5905489.2	3998768.5	3732968.3	6787801.7	4513575	5900004.1	5531878.3	4492992.5	3091065.5	6971264.1	6586008	4201579.7	2905785.3	5113656.2	3265286.2	5543267.6	2322744.3	6360741.3	101516.1	7306781.9	837995.5	3530472.4	2890703.4	3972593.2
Homogentisic acid	3008951.9	816752.3	2203050.1	2105360.1	5940015.9	1546610	2317246.7	5843179.6	5524299.1	2304249.2	2664088.4	3181799.6	639103.1	2797436.5	8828605.5	4808443	4176359.1	626711.2	4919744.1	465299.7	2977437.7	4237357.5	1836872.7	4482445.5	2355344.5	3581694.5	4399681.9	7202107.1	2823324.8	5250629.9	5023495	4522877	472392.2	3321175.9	6931151	3027849.9	3656646.1	2676909.8	6100340.3	5014864.1	3903432.2	4197587.2	6897048.5	3004274.4	6844247	4648771.6	4775932.9	2902675.8	3312236.7	2851587.5	3399098	3996840.5	3023176	3576638.2	2380658.5	4199585.2	5048548.2	4258753.3	3272766.4	4516764.2	3438968.2	6529320.6	7736219.9	2275525.3	4732932.9	3184442.5	4481184.2	5989631.8	9693019.6	5009879.7	2813687.2	5345776.8	4639171.8	4268078.7	4422663.2	7854591.9	368231.5	2756441.6	4278299.6	4730497.9	249229.2	4609209.9	2214606.1	3877545.6	2896599.2	4024888.3	3816520.2	2108342.8	186707.4	4939037.5	2977244.6	194957.3	158294.5	4085640.1	3664470.7	3472043.8	2974705.4	3473648.4	1983090.6	3662151.4	6161783.1	2849112.3	3337579.1	955592.3	5922521.2	3896149.8	2536296.8	4505972	6675684.8	5207706.7	5972668.6	5348804.5	4616595.4	7355829.9	1578318.7	4826040.9	5147880.9	5525247.6	4646348.3	746321.2	3812829.5	2178779.5	5343917.7	5189919.6	5375627.9	4213744.2	4074293.5	7316017	0	6659628	0	96889.3	3179258.2	3183904.1	3436523.2	2013250.8	3150899.7	2744838.5	6396934.1	5197350.4	5409371.7	4936074.7	2386294.6	2083457.7	2770894.8	2417824.5	3609866.7	4438939.7	8539329.3	2420105.3	8574797.3	0	2579777.4	5039059.6	1694570.4	3579878.1	5038374.3	6916488.1	2349722.4	5348300	4137465	2844928	1970643.4	3995607.3	3945423.2	2273733.4	3491445	2312299.8	2484536.1	2682444	3076572.9	3452229.6	7311829.1	2478586.2	5572763.2	2999887.6	3824478.4	5073204.3	3513118	3409276.9	2844335.2
N-Acetyl-L-aspartic acid	0	2286016.5	2907143.2	3480822.4	7970791.9	4657243.3	6952145.9	8882520.2	9738089.2	8126738.7	9009362.3	5718023.5	5066520.9	6968880.9	6960935.8	8053747.1	9307232.6	7651124.2	4739645.9	7278440.2	7029081.6	3803787.6	4608879	8755027.2	3080421.5	2638582.9	6500040.3	6860648.3	8915409.3	7855814.3	6523248.3	7584204.7	6781950.3	11994178.8	4803202.9	6770747.2	7464482.2	7027378.9	7636271.8	6332584.2	8938386.6	7353857.4	7166390.8	7109989.4	7931881.5	8501794.7	3307053.8	3144032.9	4213507.3	3458953.7	4296844.8	4040754.7	7103248.2	4176390	5830102.3	4075418.4	7382104.2	9305946.8	8495094.1	9159742.2	10652697.7	7921905.9	5932561.1	7335203.2	9081150.9	7971221.2	6909344.1	9153128.7	5659453.3	6756183.2	3794636.2	5741644	3140301.4	3660133.9	6641302	8702639.2	8839154.4	5028458.2	5778830.6	10756795.2	7198335.7	3623930.8	6438543.7	3861416.6	4962001.9	8052089.8	7772454.1	4275492.9	3772872.6	3517677.1	6050246.4	2570024.9	8477737.7	9456831.5	2674513.4	2483310.9	3416493.4	5411255.1	2646517	2684766.1	5128128	7280645.1	5664660	5237091.3	8697515.4	7294680.6	6143522.2	7564246.5	8250458.1	6617209.1	8461801.5	10872321.3	8182260	6839598.7	8256678.9	7546319.3	7524552.8	9031089.9	8363885.4	6915915.4	4024184.4	3513417.1	6973144.5	8931113.1	7753321	9193736.5	6186018.2	8192186.6	8392762.7	3787708.1	7352168.8	8441090.9	9437689	3872556.9	5575178	2073557.3	4021504.3	5174082.1	4912413.5	3736595.3	3104649.7	11227247.8	3254908.9	3238847.2	3235830.8	5666246.2	4319885.6	4468648	8043704.2	8971606.3	6899143.4	7142961	4483618.5	7482831	9967436.7	6826471.6	8700069.1	8607875.3	9340063	8184004.7	10658376.7	6383329.1	4280539.6	9692183.1	3665013.8	6643938.4	4679614.8	5930119.1	3048419.2	2765252.2	8661784.1	6171874.1	4973926.7	6040167.9	8007899.5	4311687	6076428.9	4090990	3690658.7	5807529.4	1362158.9
Citrulline	14566437.1	8033396.8	8775549.4	10255634.7	6326131.7	5574221.7	0	3896841	3163202.7	4025008.2	5602713.6	5487345.8	1503520.5	6644644.5	2769383.5	3452204.3	4497063.6	6142490.2	3918268.8	2937972.6	2853288.4	3378799.3	3523355.4	5676689.3	9963847.2	9993172.2	7036195	7104858	5937180.9	7254577.5	4351623.8	5536666.5	6807539.9	6812208.5	5861009.6	4098066.5	7007025.7	6692934.7	2238291.2	3307760.8	0	3282841.9	2619399.6	5757128.6	1830577.5	6862064	10655725	10453088.9	10584725.7	10659608.2	10409772.3	10933836.8	3566994.6	4692146.7	5508651.1	3790077.2	1793172.7	2944412.2	5039333	7588786.1	4980754.3	2214716.3	3625552.1	4827263.3	5431806	5010560.2	3865703.8	4076174.7	4740261.4	5404151	5498327	13062786.8	11060273.6	11159436.8	5046253.9	4523038.1	5918824.8	5675198.9	4223270.4	5050582.1	2942698.9	3401744.8	3464517.2	2033079.1	6165185.4	5166049.5	5382912.6	5029563	2904693.3	4337419.7	3521152.7	3208301.8	4757298.8	5809194.4	10573943.5	10133759.4	10799295.6	10811935.5	10594524.9	10803476	5518877.3	2866175.7	4367566.3	5777069.3	2974132.2	6079112.4	4262887.6	6270574.1	4456584.4	4887562.8	2629713.9	4391106	6817498.3	4660382.4	4240047	5903148.3	5226426.7	3711212.2	5019474.2	5729282.9	12279590.4	12120063.1	5613345.8	3241887	0	7835577.8	5407026.3	3885329.8	2727536.7	3949738	4380402.5	8567712.9	2335418.4	4683316.6	2234213.7	4010698.7	5350113.2	3567061.4	7653527	4341973	2571717.8	4527818.1	10461129.3	10747068.2	10803544.2	8869090.5	9438120.8	9385891.7	7789992.1	6137237.3	2091759.6	3775814.2	3672863.2	4311453.1	3392013.6	3623987.2	5717702.9	4188145.9	2625282.3	4310369.9	0	0	4727455.1	3869212.9	4774289.5	3994348.4	2813140	4200071.2	9183423.8	9623616.8	7177900.3	5295019.5	3933013.6	3154050.6	0	4838286.3	3401114.9	9415219.8	9918425.5	9422395.9	13815249.4
Gulonolactone	1105518.1	3183857.9	2754755.4	0	3830002.1	3247176.5	1911186.3	2929514.3	3033937.4	3223186.2	2515509.3	2770953.9	3135149.4	2059750.5	3110685.4	2644905.8	2338586.4	2052204.2	1171865.4	4159469.8	2179014.5	2413393.8	4241035.5	2837730.2	1831470.3	2609227.8	3110862.1	2759449.1	2293670.7	3478159.5	2880348	2347417.8	3061800.2	3484277	2253630.5	0	3334203.1	2296058.1	3059031.1	2384612.8	3659008.9	2888072.3	2681525.2	2438496.1	2494953.4	3524221.5	2468241.9	2602823.1	2630820.9	1283476.7	2827250.5	2798683.7	3360198.9	4886785.5	1178645.2	1940411.5	1404735	3258025.7	1751499.7	3367160.8	2832404.9	2573117.5	1108279.5	2782150.8	2875644	2697365.2	3650460.7	3535992.4	3326015.1	3045891.1	2995504.4	2857323.2	2721541.8	2858540.3	2937001.6	3771329.6	3057319.8	2730638.3	4111494.3	378789.4	1564217.6	2887794.7	2773977.6	2105460	3213008.5	2268083.1	1952131.9	3315687.7	3392864	2739850.8	2512779.1	2881258.1	1025219.8	2843816.8	482118.8	534792.4	2890283	2759456.3	2455530.9	2155541.8	3898806.8	3234820.4	2697708.9	10004.6	1013472	3519500.3	3318892.6	3331713.8	3318757.1	2532252.2	3097921.3	3486735.3	1906799.9	2016458.4	3470836	3348287.9	3012107.2	3654935.8	2827046.2	1689900.4	2419515.5	2842123	3261965.2	2448910.8	2217672.5	1948574.5	1757359.8	2274919	2741215.8	2616945.7	3101655.8	2989252.4	2909191	2475497.1	2817239.9	0	2550599.8	2566831.5	2742501	3001189.9	648560.5	5062771.2	3719376.1	3281562.4	3856993.9	1443886.9	3271343.1	549978.8	2204959.7	3677704.1	1576300	2893515.1	3045878.1	2404153	1992971.5	3492079.9	3718401.6	3596478.8	5436318.7	3460914.5	3517387.1	2928251.4	1827579.5	1947109.5	2655682.3	1962441.2	3433881	2539812.3	2893959.6	2559581.6	2727044.1	2445795.5	2921360.3	2749670.8	2690118.1	1319596.3	3081251.4	2751804.7	3158408.7	1018424.3	867948.7
Hippuric acid	31707591.4	43114716.6	31615096.7	31839098.7	35815352.1	66062292.8	26761770.7	99125879.2	36012011.3	23974295.9	18764194.2	56454647.7	26287452.5	20001519.9	28904754	72540858.1	11108350.7	17436172.1	28629378.8	94476051.2	19238107.6	71394969.4	33372505.9	15000388.1	34916587.5	34442591	15615190.2	19364750.1	16222198.1	45069345.2	13971775.9	54015414.4	10072237	108973758.6	49940453.7	11784441.9	51571989.4	217979160.3	20793972.7	81309367.8	18562023.7	42392930.3	21537568.7	15365787.3	8604882.9	49390249.8	35323817.4	35058992.4	48196615.2	59099315.6	38642719.1	40092475.6	23159793.3	13027670.2	52926658.8	23667022.7	81245331.4	25664825.4	30416031	34563831.7	17535056.1	16127004.9	7477232.1	40095055.4	21351811.4	46156337.1	36247203	48685039.9	7570521.2	55505496.9	32695720.7	7842170.4	39708870.6	39588542.6	45765529.2	110453466.1	9525356.5	57710621.9	61371544	27321783.7	32189767.9	3637263.2	7577970.1	17226598.5	63687067.2	26063002	84890398.3	39511431	21469180.9	38639370.4	23609649.4	55019571.7	226711174	35102143.6	41229512.7	39862788	57973025.8	51881057.9	37303327.7	37484523.1	70266526.7	31312069.2	14476669	24893783.4	1404997	43137281.2	21864154.1	16108394.2	33711121.2	23896503	13226309.6	30919341.4	22290627.5	59356856.4	37171470.1	27362531.3	49531784.4	19914177.8	20585503.4	40818414.2	38229724.5	36823850.9	37510536	60619034.5	228618735.6	68838500	7800757.2	25417705.1	37009420.5	10723477.9	39631310.4	30804238.1	79249892.3	30429643.4	42661100.9	35107150.3	14632046.7	10020478.1	110499085.3	54361381.1	8282000.2	57686960.2	40223507.5	37881720.1	59669601	68646870.4	39738780.4	36421594.5	35126572.6	41068535.1	34843821.4	14853107.6	10333245.3	15188292.8	30649477.7	158318924.4	24995059.6	73675380.7	17507688.8	16035658.8	25737255	2747715.8	34310651.6	8634589.6	21750267	21074636.2	10787077.4	25795918.6	41401811.3	42149397.8	64260093.7	119384586.2	78848103.6	40621450.3	74896722.1	6918006.2	29944728.9	40422102.5	37150167.2	62067965.9	39495501.7
3-Phosphoglyceric acid	0	755981.3	0	0	7538884.6	0	0	5701929.7	6611641.2	110265.2	7956465.6	96511.9	0	3106927.8	8723541.6	6024894.6	53845.7	184380.4	0	179586.2	230488.2	92564.1	1496772.4	29096.3	0	0	39908	65612.1	0	0	0	249072.2	60778.2	1395442.2	0	50582.1	0	1225918.4	0	2076883.7	4029826.9	119731.8	10261187.2	78834.7	0	0	0	0	1392455.4	962505.5	317602.6	161707.6	367816.9	208863.9	0	0	211075.7	3027379.1	2141662.3	616566.3	927169.7	1224475.2	1014748.1	591030	5461367.1	294312.5	666091	11885394.6	330499.1	148833.5	363448.5	397935.1	347806.6	2167756.8	1446383.1	10543486.4	354196.6	345864.1	319365.2	339007.7	221622.3	335645.1	3562280.7	170281.9	2101053.6	169374.5	0	299175	130947.7	906267.6	656492.9	1472751.4	322052.4	268534.5	79114	0	495020.6	1106561.7	140141.4	201369.7	1613619.4	252122	288305.4	0	355867	111782.3	8799574	502504.5	998641.4	2534638.1	3781261.3	230553	329389.1	53580.8	380365.7	162168.6	401422.5	505526.4	308343.6	0	570742.7	0	511197.1	2880501.4	736913.4	517326	300703.7	1360618.7	738635	896074.1	141448	860072.3	3032200.9	1580119.5	3513439.8	259498	1109291.4	132623.5	924939.6	14100853.2	250899.1	1044181.4	300401.6	253101.7	782629.3	830210.4	47734.6	241665.2	197984.7	110775.5	111582.6	128877.1	175335.2	7078779.8	2663577	146654.8	256080.1	2636516.1	564458.5	6787545.4	233149	861997.9	10310709.3	234013.5	192933.6	158168.6	1127040.3	152329.3	168272.4	0	89812.8	8163416.6	134146.5	1290954.7	487808.6	32511.4	124371.5	118787.9	53285.6	567569.8	0
Quinic acid	3065793.5	3292632.1	2803975.4	3214796.5	1790902.5	441183.7	1516284.2	344249.7	899514.2	571633.2	367151.2	670133.6	429345.9	214103.4	734124	8290828.5	367822.8	779254	647220.4	3045955.4	433563.5	493817.4	2015674.3	344560.2	2700979.7	2893722	2937910.9	392260.1	360940.1	404636.2	12010188	2322858.3	1075506	12254966.4	2982044.9	784132.9	369931.2	2548602.7	1885971.8	343351.8	3748848.3	2291590.3	395694.1	311235.8	904217.4	2241736.6	2848817.5	2693358.8	4745005.2	6614870.8	3964683.1	4061247.1	79101.8	1836028.8	267892.5	42913.2	13369.4	0	7653408.9	2688348.5	298294.2	1693372.7	180784.2	7918775.1	493046.6	585286.3	393606.4	749136.8	1562955.5	3892699.8	642314.8	36734.2	4345539.4	3791623.7	134956.9	58129.6	1971026.8	411823.2	175920.7	3964490.3	1191148	1519589.3	230254.3	3216940.1	2146828.5	3585090.1	3361893.8	633042.1	57330.5	12348	946193.5	79232.6	5539970.9	0	4289998.2	3626774.7	6236464.2	4815935.7	3011465.1	2748875.4	16968462.8	640735.3	613013.4	1608175.1	494151.9	3493777.4	475814.1	631935.3	3994668.5	4306708	567511.8	3338969.7	762816.3	2431213.7	514437.4	4109626.5	635922.3	1657900.2	1177666.3	593031.1	3628711.2	3103459.5	516978.3	2608077.5	2805083	980563.4	469040.5	498112.1	700237.4	396733.8	514563.5	2937646.5	1286100	928055.5	2435184.1	3154892.1	559332.9	532592.7	1063985.8	1314633.9	434376.4	701083.8	3411879	2971831.4	4655875.6	6523965.3	3308327.9	3755681.7	469574.9	213273.7	4380135.1	1006137.2	6103509.3	22250.6	282567.6	0	4099766	4535428.9	0	48938.5	0	0	0	0	2792539.2	687928.3	3829.3	405606.8	3440208.8	3466692.7	5187692.4	1535552.2	1113512.6	1400118.2	2786455	0	326767.4	3564302.3	2904949.1	7246840.1	4965752.8
Gluconic acid	0	10202836.5	0	0	42762433.2	30852579.3	15752901.6	13444154.7	25086141.8	24592145.7	22776853.3	41397343.5	21791444.7	18582889.4	29159620.6	22159901.9	23871713.7	20413984.3	19170711.5	13415365.3	5447629.4	14983904.2	27849324.5	13406683.5	0	2492658.1	36231612.7	31726706.9	15581344.9	32110914.1	6157746.5	18988290.1	23168465.8	265313361.5	33120881.7	15711702.8	12590245.2	13456307.2	25581431	19342052.7	18448298.3	28301392.3	11689591.2	16813147.8	56978455.9	44693991.3	4737161.3	1771272.8	25655948.1	24559986.1	13035464.1	12384129.6	27106960.4	27736714.1	34322890.9	13575510.8	15410073.8	39300382.8	41352645.9	48597013.7	26783024	22714794.8	32251078.2	20107375	29098152.2	18974924.8	34231714.2	80811607.9	35852715	16242847.9	26094733.2	22568185.2	10305572.2	13674072	33603983.4	35159246.9	28926586.6	32317754.2	62554657.2	25838551.3	30868576.1	26341359.6	18278469.9	12874694.5	20716810.7	15532294.5	7515206.9	16950269.2	12471341.5	24274232.5	23554942.3	17522880	10350044.3	20661411.3	7893844.2	8578058.5	19345423.2	17955151.6	10630195.6	10817196.6	15077214.2	12733406.2	13882842.3	13923399	12417103.4	12473669.7	15067158.7	1083382852	17061941.2	16821833.6	12999159.3	15557040.5	14454108.1	16475324.4	14581847.8	16109503.5	12779917	14610272.6	16207330.5	11692136.3	11758408.6	11294298.4	13897470.3	12544869.5	14055486.6	17900686.3	16130098.3	13713462.8	14298682	13300709.8	13793317.7	13052322.3	12439180.1	12628870.6	15152495.6	24169562.7	13902632.3	12259619	13590548	13805260	12664722.8	19011749.6	11112349.7	10754338.6	13031180.3	23588152.2	9432101.6	9738528.6	45899417.5	37168290.4	27653763.9	27646638	32539355.8	49444816.5	31355847	28296352.2	45204790.1	37542374.8	26530873.4	38462523.4	21412626.4	11708164.5	33261662.3	19077444.6	10515414.9	26536765.5	58270716.1	18160031.9	7141591.8	4695471.5	23169878.4	40159824.1	18431876.3	22174209	29754427.8	17331494.1	15577715.5	9915033.9	7465836.1	25036295.6	4664918.3
Pantothenic acid	0	0	0	0	0	10109036.7	8487619.5	1126917.8	3428076.2	0	0	0	3197143.2	0	3779029.4	24306801.3	3988064.8	10870167.9	0	0	3149606.7	2260229.5	4013784.2	0	0	0	0	0	0	0	0	0	0	54036844.9	0	1442253.1	0	4698254.8	0	2253024.8	0	1623206.8	3975041.3	0	0	0	0	0	0	4549553.3	0	0	0	4793296.7	0	267721.3	0	0	0	7394757.3	0	0	0	0	0	0	7151907.9	0	0	13618070.1	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	13599428	0	0	0	0	0	0	10282316.3	0	6661301	2396679	7510047.3	0	0	0	3977530.1	0	12177586.4	0	0	17757807.4	0	0	0	0	0	14564950.8	0	0	0	1011622.8	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	4341693	0	0	8676778.5	0	0	2689949.8	9189541.5	4259242.9	8660490.3	2745515.7	16858900.5	3237168.3	0	3778188.2	5183465.5	1478060.3	44071091.1	4335571.4	5596409.3	1936431.1	3944621.2	4237441	6557227.3	4603038.2	0	2375402	0	0	16061941.9	0	2876944.7	0	3706135.5	0	0	0	0	7798297	0
Hydroxykynurenine	0	2522722.4	2692705.6	0	4630921.1	4041375.8	8366541.3	0	5535602.1	4107565.1	0	5472294.6	5676293.4	5418469.9	0	4111673.1	5245716.4	0	0	10320939.6	0	0	8445733.4	0	0	3990035.5	0	7618034.8	0	3208853.6	17507889.4	6857209.6	6063653.4	0	0	26340043.7	6103973.5	0	0	14758974.1	0	0	4847637.7	6077464.2	0	0	0	0	0	4667488.9	0	0	15782156.6	4274329.8	6612510.1	0	20023437.6	7697275.9	0	18752509.5	0	5876530.5	0	0	0	0	0	3120952.8	0	0	16355378.9	5194918	0	3279782.1	0	6145093.6	6210205.9	4873675.3	6365357.7	0	5466893.4	5301153.6	0	4621744.1	0	0	0	4207407.3	6150751.3	5598993	0	3639805.1	0	0	0	3231596.9	4550347	0	4037702.8	0	4680645.9	20482417.9	0	0	0	5343640.3	0	18299117	0	4467058.3	0	0	6812921.5	0	0	20208531.1	0	0	5603350.6	0	3821474.5	3480586.9	0	0	7095576.1	0	0	5973051.6	0	5931780.5	6734319.5	0	10644740.4	5294124.6	3619945.3	3646288.2	3768834	0	0	0	0	0	0	3944702.3	3761971.3	4400827	0	1423152.6	0	21527894	0	0	0	5847627.7	6023662	0	6092952.7	0	7361615.5	8135287.9	6267800.7	10224990.8	9913782.1	8164428.3	7212809.8	8125494.9	7041630.9	5668855.2	0	0	0	6157650.1	13282152.1	0	0	0	2050765.6	0	0	2844371.8	348932.5
Myristic acid	123949944.3	101886965	154714152.7	146395198.4	65402072.6	104387501.9	56765818.3	59138430.9	190720246.6	59433629.2	230283129.9	87365831.3	132193098.8	63417715.7	110277920.5	162457607.2	141589813.9	53877275.5	52959224	70910107.1	40518025.9	57329630.9	99458676.3	117987916.6	148991484.9	152025938.9	61023816.1	58925970.4	86184753.2	66520374.3	175444624.3	103923212.8	67442527.2	225646549.3	67044400	158822188.2	82276832.1	110333134.1	82699612.7	45842905.5	70665797.8	86428497.5	118001610.3	108447125	142642339.2	19819480	143662299.6	147982544.9	108128894.3	105615471.8	187871804.3	187275905.1	191318000	96991435.8	105675002.4	56078186.5	56099847.5	126466088.4	142911822.1	144974429.3	70104386.8	141548950.5	71341635.6	88438039.9	52417982.6	73626966.7	48133038.4	102452155.3	57164608.7	59474198.4	63439878.1	126552517.1	176002476.8	183826256.6	47673680.8	52938816.8	44176991.7	73758241.2	91772589.1	47167007.2	50401040	115923758.3	82619053.6	86061872.5	210542861.5	62053111.1	53724152.7	71797563.9	91576000.4	166604669.9	111730663.2	99272530.6	112109473.2	48530096.3	170028219.8	167791530.4	116344343	102883692.5	163467035.3	164673863.4	174133148.8	64121261.1	75539237.7	47928016.8	99254962.7	60601901.6	75992535.3	45090881.4	85795933.5	119777780.6	80415485.4	118874234.7	112812012.1	60453871.1	202153030	88678640.3	93469856.2	65942460.1	101666623.3	49346021.8	163503167.7	155795002.3	57489225.3	76466310.4	105598256.5	138562620.3	61582293.1	49877693.4	65171783	78973151.7	46750699.3	90013588.7	124245318.5	119695984.5	84775239.7	118849124.1	147140921.2	256417781.6	82909322.9	59228966.1	56762202.7	50775582.7	192909102	188256163	116687771.6	106410761.4	171345876.7	168327025.8	129813034.1	98659158.7	129403367.8	117613498.4	73187288.8	89593657.8	140550897.7	98261460.4	94729697.4	71543347	231024612.8	69911412.5	95585399.8	62065804.9	136115835.7	57710643.8	45783674.4	48117400.3	88427585.3	105414812.8	169662762.4	166520628.5	46957621.4	131474644.3	33954866.6	47273946.4	37447659	67081455.2	64806888.2	160912193.1	148682614.2	102869932.4	156500922.1
Ribose 5-phosphate	116083.4	4140465	0	0	1549456.1	10628319.7	11561525.2	2963790	1410358.5	0	2443047.9	0	11329224.3	7018861	2028079.2	1960512.6	0	0	0	0	3246340.7	0	727692.9	0	136224.7	3591102.5	995976	8153696.3	1171133.7	5702937.6	6158776.6	6880650	5860159.3	1738900.1	13011316.2	0	0	1048894.7	7667834	8708532.5	2640756.7	8196593.6	17442318.5	1879175	0	3496698.3	27857.3	903744.1	2352855.4	1531351	0	2046238.4	4218215.8	8629431	2386779.2	0	0	3624500	1595417.9	0	14187416.9	0	15001650.1	10164764.7	2539989.6	0	5348203.1	4076418.5	0	3234085	875245.5	0	859649.2	1267646	0	1396659.9	10129112.9	0	1591124.1	15664212.7	0	1779359.6	0	0	0	4921081	0	2016277.4	0	0	8376206.8	0	0	2716853.7	1162381.9	0	1608369	2365128.5	0	1736875.9	0	0	2524421.6	0	2549457.3	0	0	890910.3	3843457.8	11552857.8	15203452.6	15217633.7	8531630.6	0	0	1989793.5	6232337	0	11056154.9	0	3853485	1847690.1	0	5072309.5	3996256	1389195.3	0	0	12107686.7	0	0	0	0	0	2852733.4	4733994.5	0	0	5224924.3	0	769975.2	1251574	0	1324309.2	1601314.4	2363073.3	1608857.7	7058796.4	0	11286143.7	10227737.7	5285552.3	7183348.8	0	5104131	0	0	2723080.9	12280617.3	0	0	3336860.3	5439839.2	911162.8	3092818.6	0	5851965.9	1522701.3	49363.2	9294070.1	2103821.7	0	0	0	6445271	2397976.3	0	3133827.6	1690925.2	2618501.2	976440.9
Cystine	5133872.6	5474260.8	1608989.4	1530386.5	8394179.9	10915428.5	9591033.9	8898866.7	5011479.7	5668417	0	6750797.7	6765916.8	6748108.2	6493442.1	10720497.4	3516163.7	3233329	9459145.2	6507824.6	8692797.8	8294799.2	13654398.8	4727051	1919969.2	1971669.9	9373224	7808904.8	1493485.2	6583861.6	10709347.8	4173496.3	5793680.9	6307638.9	8758957.4	9561696.1	4266120.8	8675921.9	4938904.1	8051895.7	1844622.7	8377262.8	6473685.4	3568010.5	11019276.1	3700597.6	1355944.2	1625009	4221197	4090090.8	1198671.3	2063764.5	8663176.3	11082072.4	3813374.8	4058021.6	4750352.9	7865558.7	9939381.2	4383476	7226141.9	7355066.1	8220846.1	8299705.1	7031847.9	4264717.7	8353826	16187385.4	7636534.2	3907129.1	6206863.4	3635446.9	2341993.9	1920046.8	7659710	8696188.3	4066692.6	8837139.3	9883916	8885480.6	7746052.9	5525746.2	2159052.9	3868711.9	4472957.7	2008146.3	9076753	6637516.2	5771661.3	10563704.1	7314174.1	7037524.4	9529827.5	6678516.7	1663957	1526801.1	3805504.5	4143112.9	1793354.6	1298170.8	9408066.5	7376562.4	8579063.4	5681503	10648400.3	5873858.8	6123425.1	7197994.8	5121363.7	7883008	6041355.7	6172628.3	8666262	6047778.1	8772371.3	5477779.9	6310379.2	5451792.6	6128757.2	5592863.3	1513249.7	1718882.1	8169334	7052486.4	5266045.4	7513499.2	5386480.5	8009362	6943456.9	8510602.8	5267881.2	2953551.7	3702965.4	6194973.4	6346012.8	9972716	5612729	8768780	20531939.4	7602672.8	9795196.6	4842547	1886013.7	1965540	4293039.4	5364894.6	2586473	1815115.8	7963510.3	6122663.8	7018554.4	5568335.4	5864791	10261336.5	6966042.1	7826309.3	8673092.3	8607109.3	11087321.9	9980634.9	8906590.7	8783337.4	6274050.1	8598998.6	2997964.9	3316315.4	13194813.6	8262128.9	1489616.3	1860418.6	8246366.3	6276504.6	5171816.1	5453731.5	3886208.8	9076842.3	9738315	1349097.2	1374765.2	4510214.4	2320646.3
Palmitoleic acid	422225981.3	289834461	382211383.3	354279457.3	85929045.2	178156646.7	132531671.5	125269123.4	400462484.4	103038440.4	376095195	146229225.4	204848276.8	111480645.3	171935755.3	325755983.3	229498399.4	120342592.3	114683681.9	101707703.3	81041314	106489758.8	225409094.4	205536209.3	380355518.1	364138647.3	96878600	135040969.5	191991158.1	119969410.2	426540744.8	186892290.5	159449874.5	449670696.9	83631340.4	174958735.2	133851630	167430438.1	191303640.5	85304159.4	124263655.9	326385250.9	80608571.3	228881363.9	393656735.3	49956751.1	374805268	368224008.7	297879792.9	271258120.3	459396088.3	443134110.3	292843675.6	175943592.5	166087203.6	86042305.4	86915555.2	299006768.5	285707735.1	303296637.9	129713225.6	243479455.3	175732255	176231628.2	99891385.4	113732118.8	94078044.4	217014984.5	144292677	135902020.6	92236153.3	246376474.2	451101666.8	440288387.2	66282233.1	96307072.7	91741349.3	124217061.2	176690757.9	83654985.3	127585713.3	266569074.9	200631095.8	135299595	428516746.8	126248018	102223663.8	125587924.9	163942228.4	370429776.7	217985185.3	184579069.2	196746260.7	118063363.3	436723961.4	436805789.3	308116590.3	272810443.1	388307757.1	393073685.6	239625860.9	104601227	191958141.1	79306141.1	176859314.4	95565134.8	135665614.1	71376113.9	271350675.5	262481167.9	267305464.8	237062028.2	225515253.5	118586637.8	305136242.9	164604838.7	208565927.8	123762949.2	186696085.2	86435635.5	411865757.5	394167291.1	106058665.1	174711301.6	186045722.7	273460706.6	125358606.7	132819771.7	106747990.1	129407826	78728681.2	133772009.2	187092955.8	253585799.4	152673776.7	220698447.4	297843543.4	601448136.5	107585133	116170552.1	113347233.1	118853596.9	468543682.6	467870850.7	312716615.1	330041906.2	411563856.4	396180416.4	168940628.3	215377706.4	243687879.6	238634244.3	248891776.4	169125005.6	211449610.1	168258006.2	165605173	85929317.4	283771846.4	128054995.4	128610612.3	172427264.4	332222569.6	102121302	57150400.3	103162462.9	177593801.5	170189868.6	387196684	401839075.7	75427619.8	203003663.1	62351469.5	63695336.2	63472886.7	144505786.3	169078112.1	385869499.2	356045024	309791786.8	487449889.8
Palmitic acid	1163014738	1248418883	1612538479	1545009679	651459068	703091897.9	543337556.1	483883530.8	1263364140	506660656.8	1260702764	888894046.6	943975625.1	417756758.1	723187458.7	1025832862	825892156.3	481595498.3	574636620.6	544569075.1	417088352.9	523192748.1	1017008164	1032492301	1516491918	1526452001	585067533.6	661204075	743803235.4	776188430.8	835235569.6	698746914	682033265.1	2054372998	402659392.3	669648671.7	574423896.8	581440341	693890487.5	476932049.7	619330425.9	883646021.9	498292414	748656519.7	1104156636	376290984.3	1322601656	1396167353	1130832858	1111901916	1657171682	1635573919	1078365791	907283139.3	690374643.5	495602230	515746660.7	1196089079	1316933289	767052721.7	510162229.5	1144131131	577573657.8	710844314.7	533240141.4	487061790.5	571748632.8	756666112.8	595044398.5	522700815.3	695361144.7	751247070.6	1678888200	1746489664	410084889.6	536433471.9	513911222.3	460520199.3	732881334.2	462603194.5	574269823.8	743879977.5	723910398.4	524553872.9	1173933131	611200181.7	453787083.9	697924838.2	739381782.8	979347160.5	842995317	644728794	737376305.1	529035821.9	1673003148	1584968040	1192836926	1110674846	1500225137	1551456172	996738126	600183405.7	650532079.6	448207398.5	651053629.5	605873079.9	690208622.2	315035486.9	725172159.2	893379583.2	1017830219	919753873.5	836772903.7	516451319.2	985136503.1	677445973.8	712064003.5	620533983	681013649.8	440806195.7	1560165718	1644088811	527249206.5	574758633.6	621478912.8	1018879182	704169014.2	517985917.1	530673688.8	531165275	377480263.7	649488659.9	643982305.6	815261092.4	826518462.3	854807025.3	1056068350	1414320690	646097298.2	564195616.6	517416926.3	789280959.3	1933492478	1809116950	1157118386	1222947048	1505915111	1601386259	685020313	934313952.6	613662666.5	700807024.5	823551759.4	728152522.2	900493961.3	728756896.6	508681818.6	480797574.8	1312030422	585771161.5	707584273.2	675400642.6	1034645623	502295462	396954389	458783605.1	715185828	671717516.4	1494664605	1456396957	463765602.1	876108062.9	370442462.5	364499094	457976160.5	578658880.5	720790640.2	1531437364	1422610385	1177450390	1380611456
Glucose 6-phosphate	698307.7	898789.6	0	2556211	2129805.4	1341383.5	2849034.1	2039368.3	3064247.9	2369044.1	3562265.1	876949.7	625666.5	1175946.5	1152248.4	6799827.1	1001041	487529.7	3469903	710965.6	759408.3	0	5502354.7	1100479.1	0	0	2581058.1	843763.2	733860.9	1610072.7	1186640.6	1041059.7	794242.2	5916461.6	3612191	1173787.8	885270.2	548198.6	914935.1	1019988.9	7177185.1	2079482.5	10575607.1	828754.7	2541796.9	461476	0	0	4910461.3	1330550.4	0	2605472	3497979	0	1234308.3	300445.6	0	3705289	7137318.4	455859	6871789.4	4509320.6	4091740.2	1523931.9	5955460.7	3811678.1	2740959	3534778.1	959183.5	1572194.1	399414.6	0	0	1759795.6	479436.6	7342803.4	225397.4	2525660.3	32694	72415.8	0	1675760.1	3551868.2	2371672.6	1120697.9	0	0	2683505.6	18928.3	6470230.9	0	170350.3	1355921.8	1893745.1	0	0	2050112.4	3770468.9	800488.7	0	0	4278948.9	4037605.4	0	0	1487689.1	628521.9	1147397.2	415714.1	3820538.6	0	1830620.9	418796.8	0	0	3950245.3	1321184.7	3306491.4	2974775.4	1071695.7	2860753.9	0	75835.7	803126.3	1041659.8	355112.7	134806.2	8702191.2	2328507.7	0	0	378641.4	3299050.6	2022054.6	3875487.6	0	3960544.5	0	0	5238642.6	0	0	0	2512620.1	2005014.2	2802075.7	0	0	0	0	0	0	0	3381443	2047892.6	1134750.8	886059.9	2192152.6	0	1079830.1	953613.7	1840164	11538817	930581	825549.5	1085197.2	3122546.6	0	0	0	1460667.9	1887744.5	0	0	2176384.3	2517654.4	0	0	0	2116711.6	0
Heptadecanoic acid	24758391.7	24430669.1	31309128.3	29281292	10153698.7	10480602.5	8676462.4	7042235.2	19348465.3	8841551.8	21993285.6	13706900.4	20933164.5	7180715.2	14898566	15713243.5	15431374.7	9310635.6	11709604.8	8532103.4	6943863	8033582.2	16149460.7	16300469.8	30643228.5	29433567.8	10455515.8	10227384.4	14178715.8	12317540.3	16863246.4	10356851.7	11047373.7	38393659.5	8920622.8	17293303.7	9406606.6	10482182.2	10343235	7005210.6	10644271	10328431.3	6438519.2	11553945.7	14247593.7	4896914.6	25782519.9	24435060.2	20881281.2	21477294.3	32078944.3	31403801.8	12772977.5	11624735.2	11185188.8	8917862.8	9357433.1	17600141.2	17275191.5	12442186	12207119.4	17083021.2	7522552	12810219.1	10165337.6	10260467.8	8404464.7	13192775.9	10666027.3	10902244	8888960.8	15224401.5	33965627.7	34130719.1	7977052.7	9309214.7	8962124.4	9940566.3	12599666	8176046.3	8863439.6	10856059.4	11271233.6	8971597.8	17973106.1	9499815.4	7991772.2	11725644.1	12677011.3	13923405.7	12399258.2	11968922.1	12679350.6	8637505.1	33286920.9	32868808.5	23257751.2	20871154.3	30770471	31228273.5	16405410.8	18626845.8	10501294.7	8635614.7	15242270.1	9822241.8	11352693.2	7106705	12736838.9	11845901	12694621.6	14432205.6	13446559.8	8903011	18693037.1	10085080.3	9544852	11955650	9964815.6	8013952	31166403.3	30165499.1	7064521.2	11338274.8	9724527.4	16902475.9	10860244.3	10502505.5	9335536.7	11051424.5	7000057.6	11209021	11830875	10491491.5	12303773.7	10448345.6	20741015.1	20321920.7	10809802.2	8236455.4	6810753	15506551.8	35440426.1	35620261.4	23212101.6	24084242.9	31156875.7	30849269.2	8356882.2	15047791.5	11518176.1	9480379.6	12901017.1	10352513.1	14497983.8	16270832.4	9150612.8	9168759	25307448.2	8844615.2	10433389.4	10480900.5	16642207.3	8421069.8	7670961.3	6764488.8	12213575.2	10746619.7	26159526.9	26825464.9	7207530.6	14202396.4	5945925.5	7814800.2	8711422.7	8535487.7	11494935.4	26741512.9	26682161.1	23155767	25433535.8
Gamma-Linolenic acid	149051286.7	171588007.2	233274256.1	221602092.2	41550987.6	91591473.7	39262690.1	31305402.9	104799529.9	35213859.8	157288477.3	62484484.3	80837823.4	25647066.7	65493056.8	82089236.3	137754485.9	47212692.1	39743189.4	37068506	13432995.7	26562239.8	78873409.1	87242958.2	229012664.9	230795227.2	41155748.2	46369204.9	60943201.4	45768600.9	105072553.8	90768005.4	83633996.6	267852250.4	21666006.4	59761771.3	62326921.7	82105544.7	70105986.6	32993233.1	49968025.6	46125651.9	29936527.8	83477351.5	165959448.4	11137365.7	224396235.6	226315639.9	193378591.2	161713525.2	265757478.3	264931872.4	144949417.1	84875726.6	53471450.7	25589913.3	42125144.2	129664157.2	109978075.6	86863967.2	53811900.8	83186299.3	56857633.6	54850518.9	40004952.1	55223672.5	39409335.4	70318521.8	44829876.7	28668705.3	34282730.8	100046481.3	254204341.9	250340579.5	28981566.3	43281630.4	38227868.6	55279436.9	55580629	25288961	32332158.4	113293691	54291937.1	52188707.5	174155010.6	63243847.7	36751827.7	49173065.6	72365334.1	81791691.1	102453880.4	81048972.3	67468311.8	44541686.8	252300132.3	241368917.4	172366291.1	170579523.2	238651152.9	241385343.3	124757282.1	35070076.8	47314602	48111851.8	67057854.9	47099787.6	55037872.4	26629454.1	61681830.3	106346784.4	44633834.5	94031888.4	71091404.4	39014304.7	126434334.7	63721028.9	63837488.1	70840903.6	75437857.4	32598292.8	255421775.3	245438218.6	41878992	35300245.6	76173762.6	102340894	46544110.7	37699844.7	54342317.7	50951577.8	27030336	48197521	58776301.5	82451521.8	98917120.2	91685528.5	84883786.3	171757933.2	47512345.1	41686759.9	35563257.1	47257634.3	271103727.6	267522259.2	189440290	192079460.7	230618054.8	228369671	89415603.7	91519011.4	46216409	57471332.8	52148061.3	51790753.2	90764639.8	50796200.7	50037210.9	24720600.1	105587113.1	43391207.7	86137328.1	53019898.6	85611884.1	28940111.5	29262597.8	41936435.3	73099260	81176408.4	226694207	222136179	20658895.9	86080395.6	21518744.2	18393109.7	26622645.3	65189292.2	45709959.7	215896694.9	202221223.4	179357894.4	185963518.6
Linoleic acid	1649357928	1871315054	2439504282	2275272734	468703354.4	717050871.9	439054828.5	336957493.1	1324550968	400316143.2	1457550352	754522899.6	991083323	328129756.3	543969889.3	1226240725	1035445886	477957750.7	408178448.7	524803178.1	203556665.8	300903352.3	621013139.3	1025236476	2330167507	2320573058	448764679.8	524230643.3	700361515.3	562144500.8	1015222099	870277594.5	907746630.6	2703965312	231387846.2	685926355.5	601482665	639093922.9	600585581.7	291358731.7	647752536.4	508554086.4	364597324.7	720234283	1667211537	201421800.3	2214289588	2200202312	2098016022	1893945586	2555376589	2614121598	993754291.5	829211505.6	637392527.4	343236740.5	495990661.6	1386344005	1173616343	654643528.8	649248448.5	820170958.4	601028459.3	584005671	571152189.4	506417930.4	345491005.1	679215212.7	585565258.8	313346596.5	601803708.2	870137535.4	2659278930	2585876615	356498043.4	471110859.4	417551869.3	428624648.3	535881762.5	311876809.7	413837556.6	954406801.3	584782922.4	585775810.2	1647624789	579345305.1	407047058	583847946.7	839407255.1	802600960.4	924102423.8	835196052.8	837465283.3	536384432.7	2560651831	2556734630	2002752035	1878452590	2278481063	2354201783	1102283688	413101778	572261911.8	475758476.2	691990169.2	486689041.6	631941948.1	293157837.7	757844910.9	851077900.7	550457930.6	980386631.2	770677492.3	418136045.7	1082706736	652570129.2	614240754.4	721383495	550505746.1	404774233.5	2495823187	2436298016	414353604.2	496382971.9	737696393.6	1106193529	626251933.4	544956319.2	681585477.9	482101234	320127762.4	626106377	665851761.2	696587710.6	1091182445	962131724.7	1077584209	1685123748	509647713	452950958.9	355617628.7	635657493.5	2999498527	2894821012	2038179845	2138605617	2333313039	2285970499	675918159.7	1094951198	448148023	573110375.2	536550329.5	584962413.5	894844322	585618989.3	449541494.1	262662665.8	1242957896	496202372.8	893403094.5	595250838.8	1081244933	345488035.6	355616079.5	422472588.9	781660005.9	786591840.1	2281054586	2247246510	265511965	747470668.5	270248223.4	250557631.8	384129749.1	599230431.8	464728733.2	2192328526	1979546459	1952456240	1984335098
Stearic acid	395339276.2	370933721.7	486778222.7	432496651	209103397.1	206549891.1	194799521.4	139125736.4	279841905.3	197067521.1	303377851	267615349.4	270448764.5	154056148	201158042.6	248761467.1	210741967.5	170444614.3	230720745.5	156109436.5	165314153.2	151887474.6	270112292.4	275131902.7	449964639.6	434716033.2	194864390.2	198280734.8	229877392.6	233125072.2	201249568.5	210652062.6	194747101	563683623.9	145798906.5	183873132	178059720	181512842.1	198520197.7	161260330.5	209472109.9	217891500.1	159050543.1	193176263.8	269325312.6	130001884.7	394533167.2	382686434.8	302977257.7	319238554.3	463890643.6	462435198.8	257039638.1	225786210.1	179329521.4	152696244.3	169402143.7	287543944.8	316043661.7	196149271.2	180447456	265573664.2	155053059.1	202988224.6	167377720.4	161593670.1	170026348.6	209018586.3	186453351.3	168456770.9	199845696.7	213837067.5	499040054.5	487012441.9	152249816.9	183853653.9	182202670.6	158344373.6	226202141.3	169910905.3	181919184.8	213556193.1	203061603	169094250.9	270979013.1	190822552.8	147669293.5	221069313.2	223609529.7	235103205.4	219643629.6	192342413.7	196779515.2	169508025.2	495061503.6	471988599.6	342956398.5	321169759.9	427727863.7	426858612.6	287149701.8	156323044.1	181577692.6	142786572.1	192687475.8	197875955.7	197739376.3	124353989.6	213029543.7	213985699	283002881.2	240023040.9	230019144.5	170430775.6	258555009.5	197703163	192629165	191821359.5	203775344.5	163390011.1	470115451.4	468764690.7	168137246.7	163549651.7	174899452.3	258724665.2	233964632	184697507.8	187212329.7	192282849.7	139893322.3	191576415.1	173807931.5	212436924.1	254956780.4	216862975.9	272171366.7	305518861.4	195037016.7	181918462.6	170554931.6	250467849.2	508756372.6	549462070	343430172	348595170.8	474562707.6	472087848.4	191696479.2	271332114.4	177746836	181780217.4	217982824	216147681.3	240925127.2	199293612.2	159831515.9	157178660.2	313193382	202472011.6	207116375.1	190720508.8	231154683	159490377.3	144842836.2	147463942.4	231727125.3	171204314.3	380999822.4	410957893.7	157463499.7	231189660.3	139574743.1	139089280.5	157725636.7	179694102.4	216652680.8	417459477.4	410744672.9	347934386.8	391574130
Arachidic acid	440622.6	180949.8	377260.3	394947.8	150890.7	0	109372.7	0	97765.6	0	150614.5	206365.7	212854.2	103039.5	136431.2	0	112116.2	130532.6	166478.8	91057.4	123138.2	0	171014.8	0	511713.3	431223.3	86601.5	115123.3	143810	179505.2	230213.1	0	166843.6	1024952.1	221184.5	276737.8	222833.8	213380.3	255732.6	115277.4	291421.8	229795.4	212028.4	0	0	97603.1	1014286.4	969711.9	715024	496119.2	885510.2	941662.5	276180.3	198736.4	153098.3	140213.7	176827.2	217082.3	364214.9	137641.3	145995.7	0	106687.6	140922.5	118358.2	129844.8	118930.4	201058.2	121293.5	0	116775.6	162228	778170.8	717733.6	155155.2	152777.7	0	154919.1	129571.5	113035	0	148376.3	154331.4	136809.8	152931.3	181034.8	105118.9	175793.1	176699.9	226966.7	175138.4	138433.1	195279.4	147190.6	1032139.6	901711.6	626305.9	576252.2	852569.7	855048.1	321220.6	0	0	110757.4	181353.6	124124.8	122584.1	0	155680.3	390352	0	96761	179786.9	0	169266.2	107001.6	119277.5	171074.3	223888.7	93784	859547.6	721248.2	0	142031.3	137959.7	123169.8	0	84729.7	138571.9	118000.1	127530.2	102456.4	210726.6	105965.6	172887	203087.7	168269.9	213020.7	189431.6	109715.3	715508.1	111934	831053.6	820225.3	546196.7	483517.8	597700.6	620861.8	96836.1	128823.4	0	0	52970.7	85856.7	66742	31754.8	85202.7	97531.7	266925.4	90215.8	58382.8	0	0	51992.8	477691.9	559531.6	145257.6	0	672647.4	599668.3	89213.2	89093.3	92262.7	0	0	58934.1	0	700079	584578.5	444911	885222.9
Docosahexaenoic acid	84256914.3	142928130.8	145340478.6	140235935.3	283031488.5	137956149.9	229097573.7	120645902.2	270286623.1	182941617.3	502612930.4	151579422.8	285975659.4	131976937.3	178083540.1	284656291.3	134891122.4	68818503.4	199587571.2	218994079	69337138.9	195305242.8	144339877.3	241035077	151004129	145516318.4	220273339.5	196045695.7	201020574.3	102596683.3	164424143.3	179374465.8	246841216.6	531464195.6	107676888.9	131307518.6	189879031.1	177095489.5	274266326.8	175481726.4	134047459.3	160997524.1	149545452.8	325094295.7	286573287.6	119349638.6	147495735.7	146198901.1	158002617.7	135329622.9	175498778.9	171603331.3	553555472.6	148122411.4	163473506.6	93205865.1	239662399.9	237033216.6	496261105	160657573.2	114716507.4	190480726.1	113590414.9	194384378.4	157006717.7	183658480.8	112629532.5	196856566.4	210844648.9	206795231	115754836.5	267750433.1	164465810.6	163846046	180613220.6	269014093	142318663.1	115940205.2	258663510.4	81747839.4	176907712.9	267116600.6	191095714.2	107001203.4	370996758.4	277955522.5	92691281.9	140670809	247312111.8	189519272.2	221213617.5	172344606.4	105172861.9	136440257.7	159877148.7	154485208.9	150145916.5	123788325.9	129323680.1	133126264.9	302545057.9	212110836.2	130323044.4	59291060.3	214587303.3	224918691.3	414513842.9	66012634.8	139444360.1	342510928.2	136026586.6	305252404.9	142396320.4	198708252.1	223790362.7	257113564.7	305718861.3	170054931.4	97321790.4	117213240.6	156171709.9	151964080.6	87870754.7	121833229.9	185877245.7	199078319.7	143783644.2	277091555	142206905.8	260268769.1	80235357.3	180121756.7	177166964	84674615.8	422812848.9	206432813.5	292015875.8	149173045	213149534	175570680.3	101620954.5	331665323.5	176350177.1	175935630.4	168350667.2	191141396.3	133346813.2	134451378.9	155222001.4	448739228.4	133774382.3	219034605.4	313956173.3	225082262.4	322905083.8	148491292.7	199713733	74079136.5	267543445.6	132904251.2	118483227.9	257769996.9	312090864.5	104247310.3	173042377.8	187683185.7	226213026.4	278429473.1	153844091.1	154565519.7	123422181.4	295292017.8	86510151.2	105680633.6	177441053	196873675.9	287019397.4	149246256.4	130899772.4	160927477.4	68483832.6
Adenosine 35-diphosphate	0	289036.5	13381.7	175408	7439058.3	3350647.3	1418209.9	9642101	15196215.5	1541896.1	3705423.6	2396902.1	1679463.8	3903285	4023765.7	2866235.7	821673	1079845.2	818634.7	212522.7	822624.5	298388.9	1401964.9	652001.6	108126.9	113706.6	834086.3	648741.4	378891	911418.6	984630.2	3655853.7	1075802.7	204403	526845.1	1244348.2	378372.9	800204.8	120509.6	6123169.2	9484047.3	2465357.4	6790039.8	1407595.8	340860.4	317286.4	51108.4	22145.4	388261.2	798878.1	570140.1	395373	660926.6	1196109	558696.1	365321.2	0	1727149.2	1723050.4	2885879.1	2095124.7	1768963	6211823.4	2636879.5	8919437.1	777059.9	1287585.1	17462953.9	2392560.2	1859452.6	1386195.2	1448571.2	639132	431922.7	1881365.3	7518383.9	3268428.2	2405962.2	2185301.2	2830407.2	1583959.6	460739.5	2394723.3	429184.4	672827.8	596137.8	143000.3	400093	1272929.5	430347.3	823608.6	354599.1	2050127.7	1417865.9	442443.5	288811.4	468534.5	332803.5	21773	0	255909.5	2232776.6	810870.4	266617.5	406488	4457575.6	2155240.6	813066.8	2188711.2	4570842.7	2833386.5	1820651.3	2687753.9	886969.7	4642717.5	1263104.2	3561314	11043823.3	4606468.3	1713786.7	286476	229778.3	794252.1	1233956	2361700.7	2404109.3	1437874.3	380561.6	1104955.5	2406800.9	674448	14137204.4	1430773.4	893066.6	4555688.5	0	959651.5	303701.2	267696.5	2360785.2	0	4927114	274389.4	299167.9	111536.3	952954.4	695178.5	581548.1	1065875.3	1103194.2	653613.7	2504564.2	2188898.7	5781986.6	3577986.8	1124456.2	860291.6	1251792.6	2846945.5	2167259.1	1496442.1	5772082.9	1359699.3	1287003.3	669460.5	1410486.7	1100169.4	1233635.6	518496	642571.1	875705	17475640	1333648.3	1955282.7	2585065.8	776994.6	908664.3	617783.9	782445.3	1058397.5	0
IDP	0	4430982.6	14106916	13232587.8	21861092.2	18737997.4	32735363	26185300.9	29299796.9	42730028.4	31305717.1	38900698.4	37677585.8	37959540.2	26852118.6	10623928.2	30082626.7	17450270.6	31092585.9	19164190.7	28248329.3	3362601	29583821.3	21607552.1	11398699	10059643.4	33560844.7	17640227	21669253.2	16495030.9	23985664.3	25700821.8	26249453.2	33883261.4	34045140.4	23629056.6	20397783.5	21762260.9	19313839.6	19613075	8108695.2	24753401.5	18079511.8	15471249	12350316.6	17520489.9	12916733.8	10764586.6	24764514	15749793.8	17150748	16217940.7	26257290.2	48008643.8	14364199.4	10241108.9	5418120.9	30638852.5	22944618.6	33136999.4	23757295.3	36050776.2	30905887.8	23404926.6	42334467.8	23295244.4	28096462.5	27151345	19540707	13977966.6	10497462.9	18147829.7	14439011.7	12425680.7	28319518.9	27438107.2	38131184.9	20313075.8	22908317.6	35355000.5	28263425.8	13753896.1	29167744.7	12452545.2	15172276.3	22127517	7976745.9	8544178.2	13723271.1	12972278.3	16383036.9	0	14773540.5	32255645.5	9530790.4	8777391.4	11015669.1	17245351.6	12029598.7	11192919.6	24392674.2	27376062.4	12122673.4	16361525.4	20011064	26114958	30722413.2	22152023.6	41540291.8	28166299.3	32041894.7	54697203.7	28934182.4	20044648.4	24442977.1	30967940.1	23560181.2	30995054.1	26264560.4	28161169.2	16763021.1	14719979.5	22454647.7	25701939	28756288.4	42040478.1	24989206.2	29058363.1	15444887.2	14696747.9	16529617.5	30558242.9	18744658.7	11922144.6	16559648.2	10530342.4	15677169.6	11642612.8	12076264.9	16600732.5	15545606.7	53506526.3	14391935.4	13260439.7	11994782.7	20595496.8	14659217.6	14431295.6	20209186.1	29591936.5	20404729.9	30065456.8	20500830.7	30171981.4	47975160.7	24416367.1	26045778.4	25068412.3	44084440.6	46491953.6	27339499.1	20671246.8	14393893.7	19006159.9	10272482.2	32032877.9	18980206	19259924.3	8743302.7	7161149.4	15203733.8	18927973	17186089	15739436.8	22238250.3	19758877.6	20010654.1	10918909.7	9937543.8	18798994	0
Glycocholic acid	0	2991295.6	1186413.4	1140221.8	3112963.1	2588794.6	4028181.5	3825849.4	1295249.3	2437672.9	3317864.6	8888160.3	3030909.1	395504.8	2548143.7	16398352.3	11664794.4	2670959.5	9654861.5	2832491.5	2276857.3	963735.4	12946411.3	1428924.4	1059810.6	1390384.3	1861732	2392605.4	7910802.6	9244300.4	5206059.2	4811418.2	2419971.4	10150893.3	1929863.2	2863592.8	2384966.4	3528934	7499670.3	6275973.7	911896.3	4377579.9	6661035.1	1810013.7	1397395.3	2385327.5	1118153	835368.8	4472378.3	4364912.7	1642706.6	2205297.3	420516.6	3615608.8	4476164.3	1288298	634275.4	3343377.1	2079080.4	783592.8	3356913.7	4482430.1	6842852.2	4348130.1	4105817.2	3977783	6220797.9	7842069	3464880.2	15111185.6	185925.6	2332908	591724.9	567469.9	3579958	7282248.6	4553525.9	4456021.1	2625004.5	4876671.1	426796.8	627165.5	1267763.2	7301688.3	2294800.2	2263880.5	5441904.4	7721320.1	3696597.8	6076543.8	1671146.1	5791351.3	7700229.8	15292543.9	2113112.6	127957.4	1991879.3	3865745.1	1805331.6	2180230.6	15685072.7	1422027.8	2796350	11106737.2	6684257.3	16876137.8	2094596.5	3601812.3	2257662.6	7246333.1	2457953.8	4823188.7	2999556.9	2845822.7	4137191.6	1115060.2	2345373.5	1213037.7	1637974.3	3753109.4	1732420.1	1945364.6	2226838.1	5560056.7	1695521.4	3422661.7	2371908.9	0	2588124.4	6399010.4	0	13533432.7	3616458.9	7560961.6	1714870.3	1352927	3772565.7	1945083.6	2586323.6	2684433.4	5927123	0	1885383.3	2010604.4	4400606.2	5318417.5	1938254.9	1916441.8	7049543.4	6133425.9	1608395.7	8774844.6	3314707.9	3255951	949750.9	5030169.1	1026290.1	2576782.5	5360392.7	2216869.3	3205241.6	1738807.5	3240038.3	16004830.8	1819460.9	3121418.7	6927408.8	3514669.6	1969152.6	1803250.3	3036795.6	12524781.3	761944.5	3054515.6	4391780.3	4647893.5	2270405.6	1895277.6	1434226	4496908.9	0
Adenosine triphosphate	0	0	0	0	2380160.6	2151448.2	726078.9	3397672.3	26708504.4	1727586.2	2777519.3	2468285.7	1378831.3	3310966.9	1924034.3	380829.8	287042.2	572563.2	308224.5	226192.2	488216.4	77732.6	208600.9	282349.5	0	0	342648.7	172538.6	334697.6	628063	278485.4	2568579.5	504728.1	0	146758.3	814332.1	170175	205614.4	76540.7	6113684.8	3139396.8	1692748	1308920.9	750820.6	174196.9	129243.4	463842.6	0	0	0	0	0	0	0	0	0	0	0	961815	2307310.3	1201770.9	20009.9	9482098.6	1254689.7	5441338.4	0	9794.3	20144604.3	1148051.4	908211.9	209943	361614.1	0	0	914347.5	3449324.3	2943501.3	1262748.3	1163121.6	2305830.8	992108.7	0	1254836.2	0	0	0	0	0	4403.2	0	0	244931.2	520952.3	692197.8	0	144770.6	0	0	0	0	0	1830880.7	0	0	0	3318326.7	803078.9	0	2294376	6043876.5	1809678.8	1549601.4	3052437.5	330453.7	5140726.1	976010	2435376.2	9615410.8	4251112.6	689642	0	0	9818.1	0	2616895.9	2109711.8	667307.9	8398.7	197366.5	895357.3	0	8300296.8	531363.4	121428.6	1678558.5	0	0	0	0	0	0	1478493.9	0	0	0	0	0	0	263479.1	256528.1	0	1381794.8	1280558.6	1846104.9	3062982.8	304064.4	222483.1	287995.2	1109989.9	545631.8	330621.6	7592869.7	324014.1	649314.2	398028.1	916262.2	114069.8	332355	0	0	203103	16987517	454929.5	973082.7	1241722.6	0	195878.6	0	0	0	0
Biliverdin	779880.2	0	1337116.3	498504.7	4317180.3	6983611.2	6031642.6	4430160.9	2793588.8	4356743.7	5821452.2	4247270	3619195.5	4687637.2	5567933.3	3303907.2	7579363.4	3823462	3852413.2	3852617.5	2799562.3	5356348.3	4188932.4	5771677.5	805571.4	179527.4	3552850.5	5441191.4	5892593.7	3452776.5	3770510.5	4293530.2	4840379.9	494901.8	2583644.7	3124225	5262453.3	3057337.9	5445297.8	2971291.2	3761959.9	6475516.6	5993668	4965965.7	5924005	4450151.8	662443.7	1480594	374905.4	699811.1	241442.5	627595.5	3927204.6	5991724.4	2832909.3	4250739.1	3816103.8	4870854.2	4657946.9	3825289.1	4515569.2	4817418.1	4679017.2	3017432.3	9719201.7	2358531.3	3989343.7	4629531.8	4541269.2	3471531.9	4364412.3	4261350.9	738195.7	654893.7	4302552.9	7731038.2	6577020.9	4054251.1	3255679.8	4061897.9	4466430.1	4577867.5	7187456.9	4185400.6	5120019.4	4242068	4387292	4553015.3	4423426.3	4075556.6	4941906.6	3416803.3	3469750.4	6482698.1	334899	263760.8	749362.1	633546.1	227372.1	307970.1	4589237.5	5186332	8143772.9	4691854.4	3754812.3	2880215	5980406	3561688.3	3605300.2	5034974.6	4706299.6	4161649.5	5794691.9	4460884.6	4140518	4630757.5	5120105.6	4612527.5	4216199.3	5398318.6	201459	557344.9	3466396.3	4179442.5	3885748.5	2878172.2	4617343.9	3708919.1	4792833.7	5944816	4773283.4	4108441.5	4733942.4	5829648.4	4825005.3	2738537.6	6327669.3	4879768	4924915.1	7645545.3	3620508.9	6677062.4	407553.4	427450.6	494283	1464832.2	948076.1	1158607.9	5673847	6221785.1	4827987.7	5072324.7	4781253.2	7645873.3	5418515.7	3687692.3	5471252.7	3394940.3	3049320	6147069.6	4399121.8	5857177.8	3611640.9	4836335	6930494	5313579.2	5745287.9	4778769.7	729706.1	1109043.5	4140134.6	2979447.4	4630637	3051930.2	5221394.6	2468211.5	3416747.9	1145088.3	1091285	1031615.7	1335803.9

metabolite_name	chemical_ID	InChiKey	mz	retention time	MSIcategory	Adduct
Hydroxypyruvic acid	HMDB01352	InChIKey=HHDDCCUIIUWNGJ-UHFFFAOYSA-N	103.0036	20	1	M-H
Serine	HMDB00187	InChIKey=MTCFGRXMJLQNBG-REOHCLBHSA-N	104.0353	37.3	1	M-H
Glyceric acid	HMDB00139	InChIKey=RBNPOMFGQQGHHO-UWTATZPHSA-N	105.0193	36.1	1	M-H
Uracil	HMDB00300	InChIKey=ISAKRJDGNUQOIC-UHFFFAOYSA-N	111.02	28.8	1	M-H
Acetylglycine	HMDB00532	InChIKey=OKJIRPAQVSHGFK-UHFFFAOYSA-N	116.0353	33.1	1	M-H
Pyrrolidonecarboxylic acid	HMDB00805	InChIKey=ODHCTXKNWHHXJC-UHFFFAOYSA-N	128.0353	35.9	1	M-H
Heptanoic acid	HMDB00666	InChIKey=MNWFXJYAOYHMED-UHFFFAOYSA-N	129.0921	47.3	1	M-H
cis-4-Hydroxy-D-proline	HMDB60460	InChIKey=PMMYEEVYMWASQN-SEFKMRKONA-N	130.051	36.8	1	M-H
Hypoxanthine	HMDB00157	InChIKey=FDGQSTZJBFJUBT-UHFFFAOYSA-N	135.0301	37.4	1	M-H
O-Phosphoethanolamine	HMDB00224	InChIKey=SUHOOTKUPISOBE-UHFFFAOYSA-N	140.012	42.1	1	M-H
4-Acetamidobutanoic acid	HMDB03681	InChIKey=UZTFMUBKZQVKLK-UHFFFAOYSA-N	144.0666	26.7	1	M-H
Oxoglutaric acid	HMDB00208	InChIKey=KPGXRSRHYNQIFN-UHFFFAOYSA-N	145.0143	35.3	1	M-H
Glutamine	HMDB00641	InChIKey=ZDXPYRJPNDTMRX-VKHMYHEASA-N	145.0619	35.8	1	M-H
Mevalonic acid	HMDB00227	InChIKey=KJTLQQUUPVSXIM-UHFFFAOYSA-N	147.0662	29	1	M-H
Ribose	HMDB00283	InChIKey=HMFHBZSHGGEWLO-SOOFDHNKSA-N	149.0455	36.6	1	M-H
24-Dihydroxyacetophenone	HMDB29659	InChIKey=SULYEHHGGXARJS-UHFFFAOYSA-N	151.0401	49.2	1	M-H
Histidine	HMDB00177	InChIKey=HNDVDQJCIGZPNO-YFKPBYRVSA-N	154.0623	36.8	1	M-H
Indoleacetaldehyde	HMDB01190	InChIKey=WHOOUMGHGSPMGR-UHFFFAOYSA-N	158.0612	74.1	1	M-H
Aminoadipic acid	HMDB00510	InChIKey=OYIFNHCXNCRBQI-UHFFFAOYSA-N	160.0615	35.9	1	M-H
Fucose	HMDB00174	InChIKey=SHZGCJCMOBCMKK-DHVFOXMCSA-N	163.0613	38.4	1	M-H
3-(2-Hydroxyphenyl)propanoic acid	HMDB33752	InChIKey=CJBDUOMQLFKVQC-UHFFFAOYSA-N	165.0557	39.6	1	M-H
Homogentisic acid	HMDB00130	InChIKey=IGMNYECMUMZDDF-UHFFFAOYSA-N	167.0348	31	1	M-H
N-Acetyl-L-aspartic acid	HMDB00812	InChIKey=OTCCIMWXFLJLIA-BYPYZUCNSA-N	174.0407	35.1	1	M-H
Citrulline	HMDB00904	InChIKey=RHGKLRLOHDJJDR-BYPYZUCNSA-N	174.0884	35.8	1	M-H
Gulonolactone	HMDB03466	InChIKey=SXZYCXMUPBBULW-SKNVOMKLSA-N	177.0405	31.4	1	M-H
Hippuric acid	HMDB00714	InChIKey=QIAFMBKCNZACKA-UHFFFAOYSA-N	178.051	37.1	1	M-H
3-Phosphoglyceric acid	HMDB00807	InChIKey=OSJPPGNTCRNQQC-UHFFFAOYSA-N	184.9857	29.5	1	M-H
Quinic acid	HMDB03072	InChIKey=AAWZDTNXLSGCEK-RKGSPJAZSA-N	191.0562	30.3	1	M-H
Gluconic acid	HMDB00625	InChIKey=RGHNJXZEOKUKBD-SQOUGZDYSA-N	195.051	35.7	1	M-H
Pantothenic acid	HMDB00210	InChIKey=GHOKWGTUZJEAQD-UHFFFAOYSA-N	218.1033	35.5	1	M-H
Hydroxykynurenine	HMDB00732	InChIKey=VCKPUUFAIGNJHC-UHFFFAOYSA-N	223.0709	37.7	1	M-H
Myristic acid	HMDB00806	InChIKey=TUNFSRHWOTWDNC-UHFFFAOYSA-N	227.2016	223.7	1	M-H
Ribose 5-phosphate	HMDB01548	InChIKey=KTVPXOYAKDPRHY-SOOFDHNKSA-N	229.0119	34.3	1	M-H
Cystine	HMDB00192	InChIKey=LEVWYRKDKASIDU-IMJSIDKUSA-N	239.0157	40.4	1	M-H
Palmitoleic acid	HMDB03229	InChIKey=SECPZKHBENQXJG-FPLPWBNLSA-N	253.2171	232.5	1	M-H
Palmitic acid	HMDB00220	InChIKey=IPCSVZSSVZVIGE-UHFFFAOYSA-N	255.2328	253.7	1	M-H
Glucose 6-phosphate	HMDB01401	InChIKey=NBSCHQHZLSJFNQ-GASJEMHNSA-N	259.0229	42.5	1	M-H
Heptadecanoic acid	HMDB02259	InChIKey=KEMQGTRYUADPNZ-UHFFFAOYSA-N	269.2484	270.1	1	M-H
Gamma-Linolenic acid	HMDB03073	InChIKey=VZCCETWTMQHEPK-QNEBEIHSSA-N	277.2171	223.2	1	M-H
Linoleic acid	HMDB00673	InChIKey=OYHQOLUKZRVURQ-HZJYTTRNSA-N	279.2327	239.2	1	M-H
Stearic acid	HMDB00827	InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-N	283.2641	281.7	1	M-H
Arachidic acid	HMDB02212	InChIKey=VKOBVWXKNCXXDE-UHFFFAOYSA-N	311.2953	297.7	1	M-H
Docosahexaenoic acid	HMDB02183	InChIKey=MBMBGCFOFBJSGT-KUBAVDMBSA-N	327.2328	227.9	1	M-H
Adenosine 35-diphosphate	HMDB00061	InChIKey=WHTCPDAXWFLDIH-KQYNXXCUSA-N	426.0209	29.2	1	M-H
IDP	HMDB03335	InChIKey=JPXZQMKKFWMMGK-VTHZCTBJSA-N	427.0071	35.3	1	M-H
Glycocholic acid	HMDB00138	InChIKey=RFDAIACWWDREDC-MZMBZMQMSA-N	464.3017	44.8	1	M-H
Adenosine triphosphate	HMDB00538	InChIKey=ZKHQWZAMYRWXGA-KQYNXXCUSA-N	505.9874	27.1	1	M-H
Biliverdin	HMDB01008	InChIKey=RCNSAJSGRJSBKK-YKSNQIBWSA-N	581.2399	54.9	1	M-H