Metabolomics Workbench : NIH Data Repository : Analyze Studies

Metabolite structure	F1	F2	F3	F4	F5	F6
1,1,3-Trimethylurea	1046306.09	816395.33	1207060.17	1399602.82	1591707.33	2282866.67
1,2-Di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphocho...	783464.45	486978.83	7524578.17	728774.00	295421.50	5831519.17
1,2-Diamino-2-methylpropane	5146498.27	6319131.83	6747253.00	5774158.36	10701874.83	7089370.67
1,2-Dilinoleoyl-sn-glycero-3-phosphocholine	1025990.09	433121.67	9438072.33	963942.27	231157.67	6503754.50
1,3,5-Benzenetriol	20115653.09	16121564.17	39317805.33	17299431.55	16962034.33	36521243.50
1,5-Pentanediamine	10902339.09	20603979.50	9780270.33	14834107.00	15932970.33	9189486.00
1-(9Z-Octadecenoyl)-sn-glycero-3-phosphocholine	312864.09	131741.67	722474.67	284683.09	96794.50	587524.67
1-Cyclohexylethanol	2052753.73	1922784.33	2413243.00	1224239.00	1324674.83	2077366.00
1-Heptadecanoyl-sn-glycero-3-phosphocholine	2327462.00	1546927.33	8956439.17	2509842.91	4417790.67	8192037.33
1-Hexadecanoyl-sn-glycero-3-phosphocholine	2199615.45	1394630.83	4649895.00	1747033.27	1324218.67	4891656.33
1-Isothiocyanato-7-(methylsulfinyl)-heptane	68427931.18	40973401.00	11922343.00	65394348.73	24085853.33	10767152.17
1-Isothiocyanato-8-(methylsulfinyl)-octane	234628709.82	143163950.33	48403960.17	206645411.73	83817564.17	48104328.33
1-Kestose	74449.18	10000.00	1061540.67	49509.82	17682.00	772304.67
1-methoxyindole-3-carbaldehyde	1682645.00	1891757.83	2946559.83	2037159.18	973163.50	2220213.67
1-Methyladenosine B	4131129.27	3266425.00	8122796.67	4848868.82	2542998.17	6723086.50
1-Methylhydantoin	1167914.18	1066035.33	6369681.50	1033320.55	734146.50	4130643.00
1-Methylnicotinamide cation	195670.55	364808.67	554218.00	155148.91	232349.83	585303.33
1-Monostearin	44572.73	29192.33	209983.67	42552.73	20133.83	124781.67
1-Oleoyl-2-acetyl-sn-glycerol	45671.09	43949.00	228855.33	40866.73	27154.33	103021.67
1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine	183796.64	139030.83	809932.17	154146.55	134247.67	558593.17
1-Propanamine, N,N-dipropyl-	1781376.27	1033169.67	3262262.17	2088910.82	2370002.33	4564627.50
1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine	348159.82	147848.33	1157050.83	291115.36	150500.33	819510.67
2-alpha-Mannobiose	1042370.27	1158579.00	300738.00	797717.73	911192.83	452671.33
2^-Deoxyguanosine 5^-monophosphate	484750.64	247266.50	804682.67	459805.64	479074.83	875353.00
2-Furancarboxylic acid	1958777.64	192341.33	200905.50	1044333.09	166575.00	98121.50
2-Hexenal	73026.55	51405.33	119869.67	237395.55	255810.00	488184.00
2-Hydroxyquinoline	5505974.64	7148805.33	8396182.83	4279099.55	6848779.00	8828952.00
2-Ketobutyric acid	738304.82	1028471.33	56981.00	671880.45	993044.00	54892.17
2-Linoleoyl-1-palmitoyl-sn-glycero-3-phosphoethanolamine	136405.73	56151.67	757276.33	175807.55	28727.17	479268.83
2-(N-Morpholino)ethanesulfonic acid	2573865879.18	2568447288.50	6947733.83	2696415976.73	2803722981.17	11245950.00
2^-O-Methylguanosine	1558470.18	991107.67	569804.67	2102375.45	620381.50	386184.17
2-Phenylacetamide	229022.55	253609.67	959647.17	274217.82	242162.33	1005405.00
2-Propenoic acid, 3-(4-methoxyphenyl)-	2641441.64	3944450.83	333210.33	2853308.36	1155200.17	709392.50
2-Pyridylacetic acid	651687.55	1565507.50	460178.17	676846.00	1304271.67	353761.17
(2S,3S)-(-)-3-Phenylglycidol	141354.18	631464.33	178402.00	391342.00	557687.83	173950.67
3-Aminopyridine	2927012.18	3279042.50	4115819.33	3460532.09	2353020.17	3585180.33
3-Furancarboxylic acid	21610153.82	8566464.67	330902.17	23407052.82	2313036.33	364491.33
3-Hexen-1-ol, (E)-	1661858.64	930186.17	1276121.67	1922664.36	2566115.33	965915.50
3-Hydroxy-4-methoxycinnamic acid	3473405.27	3779113.00	4515751.50	3942771.64	2817282.83	4182047.00
3-Hydroxynorvaline	30977583.00	36450378.50	16277027.33	29078455.45	29468662.67	15110989.00
3-Hydroxysebacic acid	442660.55	362310.00	649915.33	306920.09	279732.50	491909.17
3-Methylcytidine	33397.36	10000.00	384355.50	27315.91	15544.50	334311.50
3-Methylhistidine	5433404.73	5132730.67	34797876.83	4655926.55	2850672.50	33447298.83
3^-O-Methylcytidine	122069.45	126172.83	246092.83	193153.73	107426.17	141507.00
4-(2-Hydroxyethyl)piperazine-1-ethanesulfonic acid	4017378.36	19199479.83	624978.33	3992046.27	285913.17	315550.33
4-Acetamidobutyric acid	3001481.55	4848224.50	11990887.00	2444205.27	3778381.67	9632135.67
4-Amino-1-butanol	13704942.27	14799079.33	2366847.83	12734791.27	12250635.83	1431190.17
4-Aminobenzoic acid	25132625.18	40182874.50	33359775.50	28406606.55	48087768.67	29989079.33
4-Ethylbenzoic acid	1024414.55	1557209.83	276959.50	1094334.82	460257.33	291669.67
4-Guanidinobutyric acid	141601392.73	246522480.83	104302839.50	189483924.82	206385751.50	99880677.17
4-Hydroxy-3-methoxybenzyl alcohol	5789726.91	9895276.67	5184539.00	8366316.82	8093277.17	5442176.33
4-Hydroxy-6-methyl-2-pyrone	362216.00	284643.67	679245.17	391948.09	327889.50	664761.33
4-Hydroxybenzylcyanide	2367668.09	2286966.33	1966510.00	2042263.45	2109556.83	1961374.00
4-Hydroxymandelonitrile	362248.00	506187.67	334286.33	346742.00	320789.00	219435.00
4-Hydroxypyridine	1190724.18	996283.17	69596.17	1254748.09	1207924.50	165616.50
4-Hydroxyquinoline	5792194.45	2029729.17	5244080.17	6865713.45	3580485.17	9133788.83
4-Imidazoleacetic acid	22966361.55	41927029.33	11145677.00	26228423.27	35484672.17	10643055.17
4-Isopropylbenzoic acid	331875.55	279314.67	593899.17	327585.55	219073.83	482600.67
4-Methyl-5-thiazoleethanol?	2136478.36	1130678.67	1091564.50	3981050.73	1737239.83	1179324.00
4-Methylimidazole	650848.36	1048373.50	1969017.67	647260.00	1348531.17	1733243.00
4-Quinolinecarboxylic acid	443840.55	861046.33	186813.33	501102.00	570904.50	227704.33
5-Methylcytidine	29021.64	21675.33	135346.50	44235.00	28829.50	114081.67
5^-Methylthioadenosine	150388373.00	56561636.67	92111641.67	129172630.18	44644238.33	63048358.67
6,7-Dihydroxycoumarin	194561.73	97183.83	10000.00	130034.36	116708.83	33383.83
6-Hydroxy-7-methoxycoumarin	11882985.00	13004511.50	763185.00	20934655.45	2450309.00	599621.83
7,8-Dihydrobiopterin	72514.27	73272.83	134294.83	70516.91	129423.17	84037.50
7-Amino-4-methylcoumarin	1502809.09	3425574.83	535758.50	6747338.64	8156570.83	785227.50
7-Hydroxy-4-(methoxymethyl)coumarin	8661087.82	8002047.83	41490006.83	7540955.55	6030369.33	33607260.00
7-Methylcoumarin	1950858.73	2003616.00	4716039.17	2526322.27	1851795.67	4661011.67
7-Methylguanine	1291221.82	1013287.67	1633911.33	1457324.09	1464422.00	1532520.67
7-Methylguanosine	144273.64	90009.67	292965.67	151163.18	38027.67	226926.00
9,12-Octadecadiynoic Acid	77038.55	75321.00	200792.83	52977.18	39480.50	140573.50
9-Oxo-10E,12Z-octadecadienoic acid	110254.00	45354.67	202451.00	38214.27	62788.00	181851.00
Abietic acid	132008.73	77504.33	900654.67	120917.36	116821.83	446486.50
Acetyl coenzyme A	353629.64	143920.17	208573.00	305784.00	305489.67	230193.50
Actrarit	18177.00	29489.17	59290.33	40051.36	43108.83	58283.33
Adenosine	25326384.18	41268862.50	140637746.83	25703753.36	23100414.83	103193074.67
Adenosine, 2^-deoxy-	2561896.45	192873.33	127566.50	2358778.45	220080.33	134218.00
Adenosine 5^-diphosphate	505701.55	597364.17	111710.83	431947.64	1401932.50	35215.67
Adenosine 5^-monophosphate	5483830.00	5911201.50	4388775.17	4115976.09	5561405.83	4668741.33
Agmatine	1224370.55	591711.00	1373410.33	1753285.27	1538814.83	4002032.33
Ala-Ala	1952657.18	1538979.17	2372144.17	1854115.91	1759614.50	1836786.33
Ala-Leu	947050.18	682987.17	379101.83	922179.36	438128.83	313514.00
.alpha.-Pinene oxide	3101053.45	4913812.17	5284751.33	3745554.09	5628691.50	3998668.33
Androsterone	7220291.82	5125741.33	20846084.17	8938548.55	5934139.83	16795770.83
Arg-Ala	956474.45	391609.17	899213.83	464434.36	182168.50	605841.67
Argininosuccinic acid	1695827.09	1930372.17	676849.83	1776222.45	2703703.83	700992.17
Arg-Ser	579625.45	779213.17	1023222.00	619078.18	840843.83	1029511.00
Arg-Thr	593141.64	356325.00	1784334.83	509959.18	354920.00	1440323.33
Asparagine	813183948.36	1371049898.00	727607091.00	1057540914.36	1434127247.67	678895886.50
Asp-Arg	1214198.27	1457115.83	506941.33	1462273.18	1419588.33	463299.67
Aspartic acid	276934261.73	276052514.83	227042392.33	250659384.36	296524537.67	212008914.17
Asp-Glu	614520.36	750976.83	337864.17	349505.73	389727.67	586963.17
Benzamide	1398568.09	774889.50	506805.17	1100497.27	558521.67	767607.33
beta-Alanine	244662903.91	387410792.17	395971068.00	205279021.73	328273728.67	388098390.83
Betaine	172483903.55	156680112.67	175786509.50	207958971.27	109834626.67	162943343.50
Betaine aldehyde cation	1326278.18	1806663.50	5531607.50	1547408.36	1589586.33	4146531.33
.beta.-Methylphenethylamine	2604283.36	3730837.17	5815269.17	2303242.73	1506859.83	5166830.00
.beta.-Nicotinamide adenine dinucleotide	7707457.55	8064417.50	10000.00	7070697.82	8835221.17	10000.00
.beta.-Nicotinamide adenine dinucleotide phosphate	752382.27	665361.67	10000.00	684231.18	940919.17	10000.00
Biliverdin	188546.73	150515.33	876551.17	265973.45	135642.83	574930.33
Biuret	94278.73	387417.67	40424728.50	139886.27	322875.67	38865917.00
Caffeine	154393.45	121085.33	143977.50	57895.27	74639.67	157297.17
Carnosine	108838.45	18737.67	211489.33	64990.55	10000.00	128896.33
Choline	1859566722.64	2102800372.67	898834003.33	1648507489.82	752753615.33	1292021615.33
Cinnamaldehyde	1837313.36	1978923.83	2696694.00	2585620.91	3904265.33	3484068.17
Coniferol	462330.64	346452.67	1494941.67	606503.45	729562.50	1290785.83
Creatine	53265095.18	87841896.17	73473639.50	58014675.45	80395835.33	75756283.17
Cyclohexanamine	9025605.09	582792.83	1372538.67	3817637.55	1218758.17	2253712.83
Cyclopropanecarboxylic acid, 1-amino-	130655987.73	197313675.33	147537886.00	161517739.27	272517096.33	140879784.33
Cys-Gly	562298.73	191531.17	1161290.00	680201.64	555290.33	1549165.83
Cys-Gly (oxidized)	49153.00	31347.00	10000.00	19607.64	10000.00	10000.00
Cystathionine	555349.09	563452.83	17953.33	568103.00	1052499.33	178888.33
Cytidine 5^-diphosphocholine	717977.91	552274.33	10000.00	648272.36	857120.33	46196.83
Cytidine, 5-methyl-	50745197.73	15832242.33	22737979.67	47301752.73	72850849.50	37132812.83
Cytidine-5^-monophosphate	316320.00	305615.00	88219.83	260968.73	162626.00	109602.50
Cytosine	262487345.82	230214248.83	20982563.17	269795643.82	121030646.00	19741113.67
Dexpanthenol	488271.91	265608.17	499658.33	286696.82	436363.33	478114.33
D-Fructose 6-phosphate	188193.64	42788.50	1219494.67	196114.82	52769.50	1344618.67
D-Glucose 6-phosphate	2846815.55	1899058.33	945048.33	3057175.73	2493117.83	1090071.33
dGSH	10831.91	10000.00	10000.00	85987.55	205650.00	10000.00
Dihydrocapsaicin	146292.73	236472.83	1019332.83	108808.00	98977.00	645005.50
DL-Mevalonic acid lactone	1000385.09	3145946.83	670391.17	1160954.09	2498590.33	634944.67
D-myo-Inositol-1-phosphate	2130726.64	1013936.83	10000.00	2206788.00	2140134.67	22732.17
dOA 1	86147.00	67960.67	63846.00	63893.82	85282.00	54165.00
dOA 2	235390.00	230809.50	-	149637.00	463374.60	-
Epigallocatechin	19297162.55	25265750.83	753016.00	16752250.27	18432444.50	873093.17
Ergothioneine	276377.91	690155.50	234508.50	362676.36	604316.50	299587.67
Erucamide	5373870.64	8448675.17	35920376.17	2966766.73	7820390.00	24066071.67
Ethanolamine	25152084.00	50442600.00	39194957.33	26564404.00	15100529.83	35532320.67
Ethylacetate	1606997.64	1031686.00	2028270.17	2277636.91	2186809.83	3091603.67
Ethylhexanoate	928842.64	869536.33	3300003.50	788723.18	780127.50	2112382.67
exo-Norbornyl alcohol	3444260.18	5732629.83	5584423.00	4148206.82	6436638.83	4913744.17
Flavin adenine dinucleotide	813860.36	659554.00	10000.00	785720.36	857142.67	10000.00
FMN	1552314.55	1065470.33	599824.17	1504657.64	1094113.00	614253.33
Folinic acid	150435.73	238033.83	22577.83	153302.73	234748.17	38146.00
Fructose-1,6-bisphosphate	219750.73	26901.50	10000.00	315789.00	149408.33	10000.00
Galactosamine	11225912.55	8551917.33	16979903.00	10103344.45	9997394.17	17154244.33
gamma-Aminobutyric acid	32055937.55	47725018.33	15753075.17	39272256.45	13630153.17	13339476.50
gamma-Butyrolactone	5993332.64	8971737.17	4752272.83	7338597.27	2739755.00	4051289.17
gamma-Glutamylglutamine	2991491.27	2496455.50	2879814.00	1788429.91	2209721.00	3322328.17
gamma-Glutamylleucine	2320393.82	2944080.83	563252.33	1923333.55	1471100.17	473506.67
gamma-Glutamylmethionine	787201.18	704647.50	592308.33	666123.36	750940.83	460695.67
.gamma.-L-Glu-.epsilon.-L-Lys	757505.91	807968.17	1230657.67	656436.18	1068907.00	1106475.17
Geranic acid	321546.55	217426.83	8020622.83	350393.91	191974.83	7193399.00
Gluconate	139444.27	93363.83	513800.00	172366.27	136940.83	379965.83
Glucose-1-phosphate	3567287.18	1607397.50	94939.67	3549236.64	2482362.00	341912.83
Glu-Thr	301428.36	191046.67	272219.67	331371.64	552776.33	244725.50
Glu-Val-Phe	1188270.64	1469299.67	564023.83	896372.36	1417642.50	509372.67
Glyceraldehyde-3-phosphate	185386.36	401398.67	1601558.50	254458.91	386467.33	1463165.50
Glycine	92047999.91	99773554.67	22021564.83	99228436.09	84630065.50	21052066.50
Gly-Gly-Arg	80815.91	113265.67	998389.00	43362.00	81801.00	835853.67
Gly-Gly-Gly	131724.18	48022.83	143275.67	101137.00	112172.00	138477.33
Gly-Ile	698401.73	827711.33	737043.33	706062.91	916703.17	682560.17
Gly-Tyr	730686.55	2398372.33	404754.33	805317.45	614348.83	324297.67
His-Ile	740135.45	608114.33	463131.67	402229.82	297872.33	352273.83
His-Pro	1474541.09	1000594.33	1132462.17	1309415.73	1222449.83	828719.67
Histamine	6590645.82	8679193.17	2896131.50	5828460.82	6695040.67	2981352.17
Hydroxyproline	12677737.55	20607260.00	5284118.50	14077852.82	22877890.50	4248687.00
Ile-Arg	1473126.18	1819730.83	1813461.50	1188346.55	1159774.67	1409388.17
Ile-Ile	1321217.18	906193.67	1038451.83	972728.55	662945.17	898793.33
Ile-Pro	9379811.45	14892291.50	4998363.17	11285974.36	14580681.83	4630981.50
Indole-3-acetamide	2893729.64	1880996.67	113556673.83	5918717.18	3994307.00	68006328.00
Indole-3-carbinol	544094.18	456462.83	23080509.00	970418.82	704316.00	19008578.67
Indole-3-carboxaldehyde A	1709282.55	1145343.67	12904981.17	1555709.36	1372930.83	7113696.83
Isorhamnetin-3-O-rutinoside	11703406.18	7632876.50	1061728.67	11401283.82	2486441.33	651618.83
Kaempferitrin	7838362.18	3774884.50	45597037.83	7558937.18	3510423.67	33038097.33
Kaempferol-3-O-rutinoside	35515225.00	31279841.17	59276848.33	51887427.09	17165612.00	41168487.17
Kaempferol-7-O-neohesperidoside	1292631.73	741516.83	1563148.50	840042.64	308361.17	892154.17
Lactulose	1712796.64	2521797.67	2374200.83	1619409.73	1836461.00	1866302.67
L-.alpha.-Amino-.gamma.-butyrolactone	16000219.09	16050031.33	21104056.33	18530024.64	18237892.67	6949212.00
Levulinic acid	425620.09	413954.00	323665.67	594261.73	226853.00	316975.00
L-Histidine, 1-methyl-	25065889.18	39798611.67	12923843.83	27697645.09	39702441.83	11736828.50
L-Histidinol	41414235.27	45617918.83	30517238.00	36665809.18	68805825.50	24662609.50
Linalool oxide	5878840.45	7494988.33	5080495.50	6279097.18	9198115.17	5191412.83
Lipoamide	25297303.73	10298947.50	3140274.50	20750081.18	8830885.50	2713160.50
L-Saccharopine	3564988.00	8117099.83	1202557.00	3754788.00	4181044.33	2219223.50
Lys-Lys	1250881.09	1295450.83	70905.00	1197583.73	1549945.67	86357.83
Lyso-PC(16:0)	3157663.36	2084514.50	6637376.67	2880610.73	1489034.00	4588728.50
Lys-Ser	83901.73	115457.00	671440.17	67078.36	116225.33	480953.83
Lys-Val	1050466.18	960413.33	557373.17	1090579.36	856109.83	528076.83
Maltol	268897.18	290471.17	628654.33	274002.27	193435.67	675815.17
Melibiose	1339080.82	1634985.83	339090.33	1021690.91	1234225.33	573035.67
meso-Erythritol	2097083.73	3522189.67	2275582.67	1992937.27	2637563.67	1990449.83
Methionine	12068175.55	14600471.17	20307643.83	11823405.55	16192047.17	17580647.50
Muramic acid	6701527.45	9094534.17	346758.33	4993924.91	1953301.33	314967.17
myo-Inositol	958734.27	445160.67	2186003.33	837718.73	47378.67	1864195.00
N2-Acetyl-L-ornithine	329941817.82	151653974.50	51961054.83	318312147.73	319634300.67	26015105.83
N2,N2-Dimethylguanosine	562719.45	517549.17	379251.17	830350.91	224889.33	269001.50
N8-Acetylspermidine	135608444.45	179414076.33	185895452.67	162090073.27	190349242.17	176367476.50
N-Acetyl-D-glucosamine	61305518.00	52479166.33	10000.00	62490365.09	64301434.33	65002.67
N-Acetyl-D-mannosamine	361045.27	390740.50	446129.00	310901.09	381649.17	337674.33
N-Acetylhistidine	4511528.55	7687710.67	2872263.33	4766932.45	13089067.17	2227324.17
N-Acetyl-L-tyrosine	1418525.55	2113447.83	1476367.00	1712393.18	1682885.50	1188391.67
N-Acetylmethionine	696012.82	507419.67	1367452.33	920222.73	474112.00	1731157.17
N-Acetylputrescine	36091864.82	82697564.00	20671174.50	38684832.55	49969668.50	22572583.83
N-Acetyltryptophan	7034829.64	7280010.67	7531099.50	5588812.91	5064505.17	5637405.33
N-.alpha.-Acetyl-L-arginine	50117023.09	42944096.00	44356341.50	53294242.00	49029005.17	34018146.83
N.alpha.-Acetyl-L-lysine	4388369.55	3356585.17	6331942.17	5198376.55	5121797.33	5435868.50
N.epsilon.-Methyl-L-lysine	13449219.73	28175463.00	31398964.83	16284682.18	44988396.00	22045168.83
Neroloxide	145333.45	104700.33	4828031.50	128559.09	158049.83	4842524.17
Niacinamide	1787001.36	2039267.50	3640529.00	1956391.55	1331229.50	3012985.67
Nialamide	101080.91	156348.50	128506.67	88154.91	341655.17	86136.33
Nicotinic acid	5238727.55	4071289.83	13199799.00	5880302.64	1329033.17	13302645.17
N-Methylglutamic acid	31446383.64	51228111.17	24921684.33	34821683.82	31286126.33	28525585.83
N-Methylhistidine	4068494.91	2166914.50	5081863.17	4036091.91	3430419.00	3591011.67
N-Methylleucine	67903.82	44846.00	38997.17	34057.64	135288.17	23858.33
N-Methylproline	2477758.55	2401851.67	6669002.00	2407284.00	3228102.17	6587028.00
N-Methylvaline	10418781.73	18633189.17	8072618.33	12513345.27	17857975.67	8325721.33
N-omega-Acetylhistamine	177669.64	161773.00	151377.67	198042.18	197760.33	105362.50
N-Trimethyllysine	605660762.55	948978924.67	1067915338.50	641829872.00	971647648.33	927233854.17
O-Acetyl-L-serine	6084327.73	6377467.17	1262031.33	4997686.18	6107964.33	1341337.83
Octadecanedioic acid	45624.55	38244.50	71827.83	76098.91	20512.00	218247.67
O-Phosphothreonine	1537802.36	972242.50	10000.00	1151804.64	2231331.83	10000.00
Opthalmic acid	287390.45	416471.33	1192151.50	240574.09	404915.33	960424.17
O-Succinylhomoserine	346719.91	593254.50	208770.50	223398.91	357385.00	130795.83
p-Coumaric acid	107852.36	111074.83	182455.17	123711.64	148730.83	181465.17
Perillaldehyde	7298382.91	10957161.33	7635316.00	7819592.36	9004308.17	4895695.33
Phe-Arg	163225.55	189520.83	404586.33	121000.82	36329.83	325510.67
Phe Lys	118524.00	74930.83	415446.17	80459.45	37734.00	270184.17
Phenylacetaldehyde B	27396970.00	10621925.67	122683826.83	22574425.36	16838281.67	110503778.67
Phenylethanolamine B	11099027.18	5205085.67	49233885.67	10364431.55	6574029.17	44460896.00
Phosphocholine	162701990.91	235122265.50	336647087.50	161765238.82	193823781.00	343459412.33
Phthalic acid	47856.09	36255.83	168145.50	52712.73	42037.67	124470.00
Phytosphingosine	97471.09	10000.00	1326709.33	104101.45	10000.00	885763.50
Pipecolic acid	5852952.00	3544188.17	17158599.83	5866183.91	1970760.17	12962454.50
Pro Gly	5395330.64	4966439.33	8581388.00	5886068.64	4682171.50	5924343.83
Proline	389085543.82	238884045.00	458691217.67	319714096.73	349034865.83	428847125.00
Proline-hydroxyproline	118156.91	118507.83	107651.67	119160.18	111584.33	83560.50
P-Toluenesulfonic acid	2215320.09	1447242.83	854008.00	2277719.00	1778237.00	855993.17
Putrescine	8873186.18	44335262.67	57742437.83	10703495.55	19300413.00	50795782.67
Pyridoxal	3807024.91	2980205.17	8722983.83	4181346.18	4205262.50	7888184.67
Pyridoxamine	2394652.73	3077519.00	4639791.00	2711770.18	3071067.17	2643005.50
PyroGlu-Val-Lys	1108457.82	927728.17	1137739.17	1130989.82	982980.33	804950.83
Retinoic acid	81728.91	45264.33	203596.83	79741.09	41182.83	166765.33
(-)-Riboflavin	1819328.09	1918253.00	7908404.17	1754922.18	1151312.00	5426511.33
Rutin	3486332.18	1353408.17	439516.17	3344277.27	465576.33	250950.17
S-Adenosyl-homocysteine	5825798.45	3084272.50	25178264.67	4769418.64	3186124.67	19607556.50
S-Adenosyl-methionine	3228970.73	6368524.67	7040534.50	1786031.36	13207794.17	6551173.83
(S)-(-)-.alpha.-Methylbenzylamine	634200.09	838402.33	1531412.67	603960.36	515319.83	1184229.00
Sinapine	132465102.18	17377944.83	1263051.33	1396765.73	2645698.83	73964.00
Sinapyl alcohol	14471410.27	22071362.33	1735239.00	15176380.82	6360696.00	1841189.50
sn-Glycero-3-phosphocholine	1876629656.91	1132579016.17	1963759139.33	1840434908.73	2025842674.17	2306311577.67
Spermidine	207215425.64	227982418.83	1167914517.83	225474113.82	301539146.67	1119545414.17
Sucrose	9415536.09	7692315.00	17664703.00	7946128.27	7483578.00	16428638.17
Sulforaphane	658503322.91	308575656.83	348908774.33	514666600.27	366891084.17	351438166.83
Syringaldehyde	600524.45	462271.83	3323239.83	653972.00	609297.50	3331412.50
Thiamine	2948297.55	8002788.50	3496781.17	2686635.91	2452501.17	3512705.17
Threonine	255746210.36	312941194.67	539923291.33	286626248.73	248725784.33	506463137.00
Thymidine	1975426.91	1309358.50	402217.00	2674921.82	625698.33	300407.33
Thymine	12667833.09	10325562.67	2305845.00	17640565.09	4637817.17	1518455.67
Thymol	60001.64	88064.50	227696.00	111537.09	1975203.33	234759.33
trans,cis-3,6-Nonadien-1-ol	324115.73	1101447.83	394422.33	229664.09	1824242.83	384302.50
Triethanolamine	3305059.09	2103748.17	4266272.67	2346459.73	1538467.00	6275866.00
Trimethylamine N-oxide	821234.18	1136594.83	146097.83	696605.82	1973372.33	79804.50
Tyrosine	3348331.45	5742733.67	2204428.33	3706555.64	4738818.67	2327789.33
UDP-Glucose	379233.73	158751.00	10000.00	287021.09	294868.67	10000.00
Uracil	2179860.45	1690179.33	184834.50	3623410.55	776407.00	142138.17
Urea	11473641.18	24309060.83	14880007.83	17220578.82	55411799.00	12947843.50
Uridine-5-diphosphoacetylglucosamine	1461144.00	1327749.00	10000.00	1327459.09	1486213.67	10000.00
Uridine 5^-monophosphate	2056996.91	1700415.17	2999182.83	1964093.00	1567371.17	1907456.67
Val-Arg	428565.73	457928.67	1680083.83	333159.82	393026.67	1704259.00
Valine	28666705.36	36258801.83	38567691.33	29882011.45	63332925.00	38250410.50
Vitexin	2065549.55	960401.17	11595516.50	1957006.45	932888.83	8282607.00

1,1,3-Trimethylurea

1046306.09

816395.33

1207060.17

1399602.82

1591707.33

2282866.67

1,2-Di-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphocho...

783464.45

486978.83

7524578.17

728774.00

295421.50

5831519.17

1,2-Diamino-2-methylpropane

5146498.27

6319131.83

6747253.00

5774158.36

10701874.83

7089370.67

1,2-Dilinoleoyl-sn-glycero-3-phosphocholine

1025990.09

433121.67

9438072.33

963942.27

231157.67

6503754.50

1,3,5-Benzenetriol

20115653.09

16121564.17

39317805.33

17299431.55

16962034.33

36521243.50

1,5-Pentanediamine

10902339.09

20603979.50

9780270.33

14834107.00

15932970.33

9189486.00

1-(9Z-Octadecenoyl)-sn-glycero-3-phosphocholine

312864.09

131741.67

722474.67

284683.09

96794.50

587524.67

1-Cyclohexylethanol

2052753.73

1922784.33

2413243.00

1224239.00

1324674.83

2077366.00

1-Heptadecanoyl-sn-glycero-3-phosphocholine

2327462.00

1546927.33

8956439.17

2509842.91

4417790.67

8192037.33

1-Hexadecanoyl-sn-glycero-3-phosphocholine

2199615.45

1394630.83

4649895.00

1747033.27

1324218.67

4891656.33

1-Isothiocyanato-7-(methylsulfinyl)-heptane

68427931.18

40973401.00

11922343.00

65394348.73

24085853.33

10767152.17

1-Isothiocyanato-8-(methylsulfinyl)-octane

234628709.82

143163950.33

48403960.17

206645411.73

83817564.17

48104328.33

1-Kestose

74449.18

10000.00

1061540.67

49509.82

17682.00

772304.67

1-methoxyindole-3-carbaldehyde

1682645.00

1891757.83

2946559.83

2037159.18

973163.50

2220213.67

1-Methyladenosine B

4131129.27

3266425.00

8122796.67

4848868.82

2542998.17

6723086.50

1-Methylhydantoin

1167914.18

1066035.33

6369681.50

1033320.55

734146.50

4130643.00

1-Methylnicotinamide cation

195670.55

364808.67

554218.00

155148.91

232349.83

585303.33

1-Monostearin

44572.73

29192.33

209983.67

42552.73

20133.83

124781.67

1-Oleoyl-2-acetyl-sn-glycerol

45671.09

43949.00

228855.33

40866.73

27154.33

103021.67

1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine

183796.64

139030.83

809932.17

154146.55

134247.67

558593.17

1-Propanamine, N,N-dipropyl-

1781376.27

1033169.67

3262262.17

2088910.82

2370002.33

4564627.50

1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine

348159.82

147848.33

1157050.83

291115.36

150500.33

819510.67

2-alpha-Mannobiose

1042370.27

1158579.00

300738.00

797717.73

911192.83

452671.33

2^-Deoxyguanosine 5^-monophosphate

484750.64

247266.50

804682.67

459805.64

479074.83

875353.00

2-Furancarboxylic acid

1958777.64

192341.33

200905.50

1044333.09

166575.00

98121.50

2-Hexenal

73026.55

51405.33

119869.67

237395.55

255810.00

488184.00

2-Hydroxyquinoline

5505974.64

7148805.33

8396182.83

4279099.55

6848779.00

8828952.00

2-Ketobutyric acid

738304.82

1028471.33

56981.00

671880.45

993044.00

54892.17

2-Linoleoyl-1-palmitoyl-sn-glycero-3-phosphoethanolamine

136405.73

56151.67

757276.33

175807.55

28727.17

479268.83

2-(N-Morpholino)ethanesulfonic acid

2573865879.18

2568447288.50

6947733.83

2696415976.73

2803722981.17

11245950.00

2^-O-Methylguanosine

1558470.18

991107.67

569804.67

2102375.45

620381.50

386184.17

2-Phenylacetamide

229022.55

253609.67

959647.17

274217.82

242162.33

1005405.00

2-Propenoic acid, 3-(4-methoxyphenyl)-

2641441.64

3944450.83

333210.33

2853308.36

1155200.17

709392.50

2-Pyridylacetic acid

651687.55

1565507.50

460178.17

676846.00

1304271.67

353761.17

(2S,3S)-(-)-3-Phenylglycidol

141354.18

631464.33

178402.00

391342.00

557687.83

173950.67

3-Aminopyridine

2927012.18

3279042.50

4115819.33

3460532.09

2353020.17

3585180.33

3-Furancarboxylic acid

21610153.82

8566464.67

330902.17

23407052.82

2313036.33

364491.33

3-Hexen-1-ol, (E)-

1661858.64

930186.17

1276121.67

1922664.36

2566115.33

965915.50

3-Hydroxy-4-methoxycinnamic acid

3473405.27

3779113.00

4515751.50

3942771.64

2817282.83

4182047.00

3-Hydroxynorvaline

30977583.00

36450378.50

16277027.33

29078455.45

29468662.67

15110989.00

3-Hydroxysebacic acid

442660.55

362310.00

649915.33

306920.09

279732.50

491909.17

3-Methylcytidine

33397.36

10000.00

384355.50

27315.91

15544.50

334311.50

3-Methylhistidine

5433404.73

5132730.67

34797876.83

4655926.55

2850672.50

33447298.83

3^-O-Methylcytidine

122069.45

126172.83

246092.83

193153.73

107426.17

141507.00

4-(2-Hydroxyethyl)piperazine-1-ethanesulfonic acid

4017378.36

19199479.83

624978.33

3992046.27

285913.17

315550.33

4-Acetamidobutyric acid

3001481.55

4848224.50

11990887.00

2444205.27

3778381.67

9632135.67

4-Amino-1-butanol

13704942.27

14799079.33

2366847.83

12734791.27

12250635.83

1431190.17

4-Aminobenzoic acid

25132625.18

40182874.50

33359775.50

28406606.55

48087768.67

29989079.33

4-Ethylbenzoic acid

1024414.55

1557209.83

276959.50

1094334.82

460257.33

291669.67

4-Guanidinobutyric acid

141601392.73

246522480.83

104302839.50

189483924.82

206385751.50

99880677.17

4-Hydroxy-3-methoxybenzyl alcohol

5789726.91

9895276.67

5184539.00

8366316.82

8093277.17

5442176.33

4-Hydroxy-6-methyl-2-pyrone

362216.00

284643.67

679245.17

391948.09

327889.50

664761.33

4-Hydroxybenzylcyanide

2367668.09

2286966.33

1966510.00

2042263.45

2109556.83

1961374.00

4-Hydroxymandelonitrile

362248.00

506187.67

334286.33

346742.00

320789.00

219435.00

4-Hydroxypyridine

1190724.18

996283.17

69596.17

1254748.09

1207924.50

165616.50

4-Hydroxyquinoline

5792194.45

2029729.17

5244080.17

6865713.45

3580485.17

9133788.83

4-Imidazoleacetic acid

22966361.55

41927029.33

11145677.00

26228423.27

35484672.17

10643055.17

4-Isopropylbenzoic acid

331875.55

279314.67

593899.17

327585.55

219073.83

482600.67

4-Methyl-5-thiazoleethanol?

2136478.36

1130678.67

1091564.50

3981050.73

1737239.83

1179324.00

4-Methylimidazole

650848.36

1048373.50

1969017.67

647260.00

1348531.17

1733243.00

4-Quinolinecarboxylic acid

443840.55

861046.33

186813.33

501102.00

570904.50

227704.33

5-Methylcytidine

29021.64

21675.33

135346.50

44235.00

28829.50

114081.67

5^-Methylthioadenosine

150388373.00

56561636.67

92111641.67

129172630.18

44644238.33

63048358.67

6,7-Dihydroxycoumarin

194561.73

97183.83

10000.00

130034.36

116708.83

33383.83

6-Hydroxy-7-methoxycoumarin

11882985.00

13004511.50

763185.00

20934655.45

2450309.00

599621.83

7,8-Dihydrobiopterin

72514.27

73272.83

134294.83

70516.91

129423.17

84037.50

7-Amino-4-methylcoumarin

1502809.09

3425574.83

535758.50

6747338.64

8156570.83

785227.50

7-Hydroxy-4-(methoxymethyl)coumarin

8661087.82

8002047.83

41490006.83

7540955.55

6030369.33

33607260.00

7-Methylcoumarin

1950858.73

2003616.00

4716039.17

2526322.27

1851795.67

4661011.67

7-Methylguanine

1291221.82

1013287.67

1633911.33

1457324.09

1464422.00

1532520.67

7-Methylguanosine

144273.64

90009.67

292965.67

151163.18

38027.67

226926.00

9,12-Octadecadiynoic Acid

77038.55

75321.00

200792.83

52977.18

39480.50

140573.50

9-Oxo-10E,12Z-octadecadienoic acid

110254.00

45354.67

202451.00

38214.27

62788.00

181851.00

Abietic acid

132008.73

77504.33

900654.67

120917.36

116821.83

446486.50

Acetyl coenzyme A

353629.64

143920.17

208573.00

305784.00

305489.67

230193.50

Actrarit

18177.00

29489.17

59290.33

40051.36

43108.83

58283.33

Adenosine

25326384.18

41268862.50

140637746.83

25703753.36

23100414.83

103193074.67

Adenosine, 2^-deoxy-

2561896.45

192873.33

127566.50

2358778.45

220080.33

134218.00

Adenosine 5^-diphosphate

505701.55

597364.17

111710.83

431947.64

1401932.50

35215.67

Adenosine 5^-monophosphate

5483830.00

5911201.50

4388775.17

4115976.09

5561405.83

4668741.33

Agmatine

1224370.55

591711.00

1373410.33

1753285.27

1538814.83

4002032.33

Ala-Ala

1952657.18

1538979.17

2372144.17

1854115.91

1759614.50

1836786.33

Ala-Leu

947050.18

682987.17

379101.83

922179.36

438128.83

313514.00

.alpha.-Pinene oxide

3101053.45

4913812.17

5284751.33

3745554.09

5628691.50

3998668.33

Androsterone

7220291.82

5125741.33

20846084.17

8938548.55

5934139.83

16795770.83

Arg-Ala

956474.45

391609.17

899213.83

464434.36

182168.50

605841.67

Argininosuccinic acid

1695827.09

1930372.17

676849.83

1776222.45

2703703.83

700992.17

Arg-Ser

579625.45

779213.17

1023222.00

619078.18

840843.83

1029511.00

Arg-Thr

593141.64

356325.00

1784334.83

509959.18

354920.00

1440323.33

Asparagine

813183948.36

1371049898.00

727607091.00

1057540914.36

1434127247.67

678895886.50

Asp-Arg

1214198.27

1457115.83

506941.33

1462273.18

1419588.33

463299.67

Aspartic acid

276934261.73

276052514.83

227042392.33

250659384.36

296524537.67

212008914.17

Asp-Glu

614520.36

750976.83

337864.17

349505.73

389727.67

586963.17

Benzamide

1398568.09

774889.50

506805.17

1100497.27

558521.67

767607.33

beta-Alanine

244662903.91

387410792.17

395971068.00

205279021.73

328273728.67

388098390.83

Betaine

172483903.55

156680112.67

175786509.50

207958971.27

109834626.67

162943343.50

Betaine aldehyde cation

1326278.18

1806663.50

5531607.50

1547408.36

1589586.33

4146531.33

.beta.-Methylphenethylamine

2604283.36

3730837.17

5815269.17

2303242.73

1506859.83

5166830.00

.beta.-Nicotinamide adenine dinucleotide

7707457.55

8064417.50

10000.00

7070697.82

8835221.17

10000.00

.beta.-Nicotinamide adenine dinucleotide phosphate

752382.27

665361.67

10000.00

684231.18

940919.17

10000.00

Biliverdin

188546.73

150515.33

876551.17

265973.45

135642.83

574930.33

Biuret

94278.73

387417.67

40424728.50

139886.27

322875.67

38865917.00

Caffeine

154393.45

121085.33

143977.50

57895.27

74639.67

157297.17

Carnosine

108838.45

18737.67

211489.33

64990.55

10000.00

128896.33

Choline

1859566722.64

2102800372.67

898834003.33

1648507489.82

752753615.33

1292021615.33

Cinnamaldehyde

1837313.36

1978923.83

2696694.00

2585620.91

3904265.33

3484068.17

Coniferol

462330.64

346452.67

1494941.67

606503.45

729562.50

1290785.83

Creatine

53265095.18

87841896.17

73473639.50

58014675.45

80395835.33

75756283.17

Cyclohexanamine

9025605.09

582792.83

1372538.67

3817637.55

1218758.17

2253712.83

Cyclopropanecarboxylic acid, 1-amino-

130655987.73

197313675.33

147537886.00

161517739.27

272517096.33

140879784.33

Cys-Gly

562298.73

191531.17

1161290.00

680201.64

555290.33

1549165.83

Cys-Gly (oxidized)

49153.00

31347.00

10000.00

19607.64

10000.00

Cystathionine

555349.09

563452.83

17953.33

568103.00

1052499.33

178888.33

Cytidine 5^-diphosphocholine

717977.91

552274.33

10000.00

648272.36

857120.33

46196.83

Cytidine, 5-methyl-

50745197.73

15832242.33

22737979.67

47301752.73

72850849.50

37132812.83

Cytidine-5^-monophosphate

316320.00

305615.00

88219.83

260968.73

162626.00

109602.50

Cytosine

262487345.82

230214248.83

20982563.17

269795643.82

121030646.00

19741113.67

Dexpanthenol

488271.91

265608.17

499658.33

286696.82

436363.33

478114.33

D-Fructose 6-phosphate

188193.64

42788.50

1219494.67

196114.82

52769.50

1344618.67

D-Glucose 6-phosphate

2846815.55

1899058.33

945048.33

3057175.73

2493117.83

1090071.33

dGSH

10831.91

10000.00

85987.55

205650.00

10000.00

Dihydrocapsaicin

146292.73

236472.83

1019332.83

108808.00

98977.00

645005.50

DL-Mevalonic acid lactone

1000385.09

3145946.83

670391.17

1160954.09

2498590.33

634944.67

D-myo-Inositol-1-phosphate

2130726.64

1013936.83

10000.00

2206788.00

2140134.67

22732.17

dOA 1

86147.00

67960.67

63846.00

63893.82

85282.00

54165.00

dOA 2

235390.00

230809.50

-

149637.00

463374.60

-

Epigallocatechin

19297162.55

25265750.83

753016.00

16752250.27

18432444.50

873093.17

Ergothioneine

276377.91

690155.50

234508.50

362676.36

604316.50

299587.67

Erucamide

5373870.64

8448675.17

35920376.17

2966766.73

7820390.00

24066071.67

Ethanolamine

25152084.00

50442600.00

39194957.33

26564404.00

15100529.83

35532320.67

Ethylacetate

1606997.64

1031686.00

2028270.17

2277636.91

2186809.83

3091603.67

Ethylhexanoate

928842.64

869536.33

3300003.50

788723.18

780127.50

2112382.67

exo-Norbornyl alcohol

3444260.18

5732629.83

5584423.00

4148206.82

6436638.83

4913744.17

Flavin adenine dinucleotide

813860.36

659554.00

10000.00

785720.36

857142.67

10000.00

FMN

1552314.55

1065470.33

599824.17

1504657.64

1094113.00

614253.33

Folinic acid

150435.73

238033.83

22577.83

153302.73

234748.17

38146.00

Fructose-1,6-bisphosphate

219750.73

26901.50

10000.00

315789.00

149408.33

10000.00

Galactosamine

11225912.55

8551917.33

16979903.00

10103344.45

9997394.17

17154244.33

gamma-Aminobutyric acid

32055937.55

47725018.33

15753075.17

39272256.45

13630153.17

13339476.50

gamma-Butyrolactone

5993332.64

8971737.17

4752272.83

7338597.27

2739755.00

4051289.17

gamma-Glutamylglutamine

2991491.27

2496455.50

2879814.00

1788429.91

2209721.00

3322328.17

gamma-Glutamylleucine

2320393.82

2944080.83

563252.33

1923333.55

1471100.17

473506.67

gamma-Glutamylmethionine

787201.18

704647.50

592308.33

666123.36

750940.83

460695.67

.gamma.-L-Glu-.epsilon.-L-Lys

757505.91

807968.17

1230657.67

656436.18

1068907.00

1106475.17

Geranic acid

321546.55

217426.83

8020622.83

350393.91

191974.83

7193399.00

Gluconate

139444.27

93363.83

513800.00

172366.27

136940.83

379965.83

Glucose-1-phosphate

3567287.18

1607397.50

94939.67

3549236.64

2482362.00

341912.83

Glu-Thr

301428.36

191046.67

272219.67

331371.64

552776.33

244725.50

Glu-Val-Phe

1188270.64

1469299.67

564023.83

896372.36

1417642.50

509372.67

Glyceraldehyde-3-phosphate

185386.36

401398.67

1601558.50

254458.91

386467.33

1463165.50

Glycine

92047999.91

99773554.67

22021564.83

99228436.09

84630065.50

21052066.50

Gly-Gly-Arg

80815.91

113265.67

998389.00

43362.00

81801.00

835853.67

Gly-Gly-Gly

131724.18

48022.83

143275.67

101137.00

112172.00

138477.33

Gly-Ile

698401.73

827711.33

737043.33

706062.91

916703.17

682560.17

Gly-Tyr

730686.55

2398372.33

404754.33

805317.45

614348.83

324297.67

His-Ile

740135.45

608114.33

463131.67

402229.82

297872.33

352273.83

His-Pro

1474541.09

1000594.33

1132462.17

1309415.73

1222449.83

828719.67

Histamine

6590645.82

8679193.17

2896131.50

5828460.82

6695040.67

2981352.17

Hydroxyproline

12677737.55

20607260.00

5284118.50

14077852.82

22877890.50

4248687.00

Ile-Arg

1473126.18

1819730.83

1813461.50

1188346.55

1159774.67

1409388.17

Ile-Ile

1321217.18

906193.67

1038451.83

972728.55

662945.17

898793.33

Ile-Pro

9379811.45

14892291.50

4998363.17

11285974.36

14580681.83

4630981.50

Indole-3-acetamide

2893729.64

1880996.67

113556673.83

5918717.18

3994307.00

68006328.00

Indole-3-carbinol

544094.18

456462.83

23080509.00

970418.82

704316.00

19008578.67

Indole-3-carboxaldehyde A

1709282.55

1145343.67

12904981.17

1555709.36

1372930.83

7113696.83

Isorhamnetin-3-O-rutinoside

11703406.18

7632876.50

1061728.67

11401283.82

2486441.33

651618.83

Kaempferitrin

7838362.18

3774884.50

45597037.83

7558937.18

3510423.67

33038097.33

Kaempferol-3-O-rutinoside

35515225.00

31279841.17

59276848.33

51887427.09

17165612.00

41168487.17

Kaempferol-7-O-neohesperidoside

1292631.73

741516.83

1563148.50

840042.64

308361.17

892154.17

Lactulose

1712796.64

2521797.67

2374200.83

1619409.73

1836461.00

1866302.67

L-.alpha.-Amino-.gamma.-butyrolactone

16000219.09

16050031.33

21104056.33

18530024.64

18237892.67

6949212.00

Levulinic acid

425620.09

413954.00

323665.67

594261.73

226853.00

316975.00

L-Histidine, 1-methyl-

25065889.18

39798611.67

12923843.83

27697645.09

39702441.83

11736828.50

L-Histidinol

41414235.27

45617918.83

30517238.00

36665809.18

68805825.50

24662609.50

Linalool oxide

5878840.45

7494988.33

5080495.50

6279097.18

9198115.17

5191412.83

Lipoamide

25297303.73

10298947.50

3140274.50

20750081.18

8830885.50

2713160.50

L-Saccharopine

3564988.00

8117099.83

1202557.00

3754788.00

4181044.33

2219223.50

Lys-Lys

1250881.09

1295450.83

70905.00

1197583.73

1549945.67

86357.83

Lyso-PC(16:0)

3157663.36

2084514.50

6637376.67

2880610.73

1489034.00

4588728.50

Lys-Ser

83901.73

115457.00

671440.17

67078.36

116225.33

480953.83

Lys-Val

1050466.18

960413.33

557373.17

1090579.36

856109.83

528076.83

Maltol

268897.18

290471.17

628654.33

274002.27

193435.67

675815.17

Melibiose

1339080.82

1634985.83

339090.33

1021690.91

1234225.33

573035.67

meso-Erythritol

2097083.73

3522189.67

2275582.67

1992937.27

2637563.67

1990449.83

Methionine

12068175.55

14600471.17

20307643.83

11823405.55

16192047.17

17580647.50

Muramic acid

6701527.45

9094534.17

346758.33

4993924.91

1953301.33

314967.17

myo-Inositol

958734.27

445160.67

2186003.33

837718.73

47378.67

1864195.00

N2-Acetyl-L-ornithine

329941817.82

151653974.50

51961054.83

318312147.73

319634300.67

26015105.83

N2,N2-Dimethylguanosine

562719.45

517549.17

379251.17

830350.91

224889.33

269001.50

N8-Acetylspermidine

135608444.45

179414076.33

185895452.67

162090073.27

190349242.17

176367476.50

N-Acetyl-D-glucosamine

61305518.00

52479166.33

10000.00

62490365.09

64301434.33

65002.67

N-Acetyl-D-mannosamine

361045.27

390740.50

446129.00

310901.09

381649.17

337674.33

N-Acetylhistidine

4511528.55

7687710.67

2872263.33

4766932.45

13089067.17

2227324.17

N-Acetyl-L-tyrosine

1418525.55

2113447.83

1476367.00

1712393.18

1682885.50

1188391.67

N-Acetylmethionine

696012.82

507419.67

1367452.33

920222.73

474112.00

1731157.17

N-Acetylputrescine

36091864.82

82697564.00

20671174.50

38684832.55

49969668.50

22572583.83

N-Acetyltryptophan

7034829.64

7280010.67

7531099.50

5588812.91

5064505.17

5637405.33

N-.alpha.-Acetyl-L-arginine

50117023.09

42944096.00

44356341.50

53294242.00

49029005.17

34018146.83

N.alpha.-Acetyl-L-lysine

4388369.55

3356585.17

6331942.17

5198376.55

5121797.33

5435868.50

N.epsilon.-Methyl-L-lysine

13449219.73

28175463.00

31398964.83

16284682.18

44988396.00

22045168.83

Neroloxide

145333.45

104700.33

4828031.50

128559.09

158049.83

4842524.17

Niacinamide

1787001.36

2039267.50

3640529.00

1956391.55

1331229.50

3012985.67

Nialamide

101080.91

156348.50

128506.67

88154.91

341655.17

86136.33

Nicotinic acid

5238727.55

4071289.83

13199799.00

5880302.64

1329033.17

13302645.17

N-Methylglutamic acid

31446383.64

51228111.17

24921684.33

34821683.82

31286126.33

28525585.83

N-Methylhistidine

4068494.91

2166914.50

5081863.17

4036091.91

3430419.00

3591011.67

N-Methylleucine

67903.82

44846.00

38997.17

34057.64

135288.17

23858.33

N-Methylproline

2477758.55

2401851.67

6669002.00

2407284.00

3228102.17

6587028.00

N-Methylvaline

10418781.73

18633189.17

8072618.33

12513345.27

17857975.67

8325721.33

N-omega-Acetylhistamine

177669.64

161773.00

151377.67

198042.18

197760.33

105362.50

N-Trimethyllysine

605660762.55

948978924.67

1067915338.50

641829872.00

971647648.33

927233854.17

O-Acetyl-L-serine

6084327.73

6377467.17

1262031.33

4997686.18

6107964.33

1341337.83

Octadecanedioic acid

45624.55

38244.50

71827.83

76098.91

20512.00

218247.67

O-Phosphothreonine

1537802.36

972242.50

10000.00

1151804.64

2231331.83

10000.00

Opthalmic acid

287390.45

416471.33

1192151.50

240574.09

404915.33

960424.17

O-Succinylhomoserine

346719.91

593254.50

208770.50

223398.91

357385.00

130795.83

p-Coumaric acid

107852.36

111074.83

182455.17

123711.64

148730.83

181465.17

Perillaldehyde

7298382.91

10957161.33

7635316.00

7819592.36

9004308.17

4895695.33

Phe-Arg

163225.55

189520.83

404586.33

121000.82

36329.83

325510.67

Phe Lys

118524.00

74930.83

415446.17

80459.45

37734.00

270184.17

Phenylacetaldehyde B

27396970.00

10621925.67

122683826.83

22574425.36

16838281.67

110503778.67

Phenylethanolamine B

11099027.18

5205085.67

49233885.67

10364431.55

6574029.17

44460896.00

Phosphocholine

162701990.91

235122265.50

336647087.50

161765238.82

193823781.00

343459412.33

Phthalic acid

47856.09

36255.83

168145.50

52712.73

42037.67

124470.00

Phytosphingosine

97471.09

10000.00

1326709.33

104101.45

10000.00

885763.50

Pipecolic acid

5852952.00

3544188.17

17158599.83

5866183.91

1970760.17

12962454.50

Pro Gly

5395330.64

4966439.33

8581388.00

5886068.64

4682171.50

5924343.83

Proline

389085543.82

238884045.00

458691217.67

319714096.73

349034865.83

428847125.00

Proline-hydroxyproline

118156.91

118507.83

107651.67

119160.18

111584.33

83560.50

P-Toluenesulfonic acid

2215320.09

1447242.83

854008.00

2277719.00

1778237.00

855993.17

Putrescine

8873186.18

44335262.67

57742437.83

10703495.55

19300413.00

50795782.67

Pyridoxal

3807024.91

2980205.17

8722983.83

4181346.18

4205262.50

7888184.67

Pyridoxamine

2394652.73

3077519.00

4639791.00

2711770.18

3071067.17

2643005.50

PyroGlu-Val-Lys

1108457.82

927728.17

1137739.17

1130989.82

982980.33

804950.83

Retinoic acid

81728.91

45264.33

203596.83

79741.09

41182.83

166765.33

(-)-Riboflavin

1819328.09

1918253.00

7908404.17

1754922.18

1151312.00

5426511.33

Rutin

3486332.18

1353408.17

439516.17

3344277.27

465576.33

250950.17

S-Adenosyl-homocysteine

5825798.45

3084272.50

25178264.67

4769418.64

3186124.67

19607556.50

S-Adenosyl-methionine

3228970.73

6368524.67

7040534.50

1786031.36

13207794.17

6551173.83

(S)-(-)-.alpha.-Methylbenzylamine

634200.09

838402.33

1531412.67

603960.36

515319.83

1184229.00

Sinapine

132465102.18

17377944.83

1263051.33

1396765.73

2645698.83

73964.00

Sinapyl alcohol

14471410.27

22071362.33

1735239.00

15176380.82

6360696.00

1841189.50

sn-Glycero-3-phosphocholine

1876629656.91

1132579016.17

1963759139.33

1840434908.73

2025842674.17

2306311577.67

Spermidine

207215425.64

227982418.83

1167914517.83

225474113.82

301539146.67

1119545414.17

Sucrose

9415536.09

7692315.00

17664703.00

7946128.27

7483578.00

16428638.17

Sulforaphane

658503322.91

308575656.83

348908774.33

514666600.27

366891084.17

351438166.83

Syringaldehyde

600524.45

462271.83

3323239.83

653972.00

609297.50

3331412.50

Thiamine

2948297.55

8002788.50

3496781.17

2686635.91

2452501.17

3512705.17

Threonine

255746210.36

312941194.67

539923291.33

286626248.73

248725784.33

506463137.00

Thymidine

1975426.91

1309358.50

402217.00

2674921.82

625698.33

300407.33

Thymine

12667833.09

10325562.67

2305845.00

17640565.09

4637817.17

1518455.67

Thymol

60001.64

88064.50

227696.00

111537.09

1975203.33

234759.33

trans,cis-3,6-Nonadien-1-ol

324115.73

1101447.83

394422.33

229664.09

1824242.83

384302.50

Triethanolamine

3305059.09

2103748.17

4266272.67

2346459.73

1538467.00

6275866.00

Trimethylamine N-oxide

821234.18

1136594.83

146097.83

696605.82

1973372.33

79804.50

Tyrosine

3348331.45

5742733.67

2204428.33

3706555.64

4738818.67

2327789.33

UDP-Glucose

379233.73

158751.00

10000.00

287021.09

294868.67

10000.00

Uracil

2179860.45

1690179.33

184834.50

3623410.55

776407.00

142138.17

Urea

11473641.18

24309060.83

14880007.83

17220578.82

55411799.00

12947843.50

Uridine-5-diphosphoacetylglucosamine

1461144.00

1327749.00

10000.00

1327459.09

1486213.67

10000.00

Uridine 5^-monophosphate

2056996.91

1700415.17

2999182.83

1964093.00

1567371.17

1907456.67

Val-Arg

428565.73

457928.67

1680083.83

333159.82

393026.67

1704259.00

Valine

28666705.36

36258801.83

38567691.33

29882011.45

63332925.00

38250410.50

Vitexin

2065549.55

960401.17

11595516.50

1957006.45

932888.83

8282607.00

Data for ST001062

Factors:

F1	Genotype:Columbai-O_WT \| Treatment:1/2MS-media_3weeks \| Tissue Type:Whole Plant
F2	Genotype:Columbai-O_WT \| Treatment:1/2MS-media_4weeks \| Tissue Type:Whole Plant
F3	Genotype:Columbai-O_WT \| Treatment:SoilGrown_4weeks \| Tissue Type:Leaves
F4	Genotype:SALK_108849C_KO \| Treatment:1/2MS-media_3weeks \| Tissue Type:Whole Plant
F5	Genotype:SALK_108849C_KO \| Treatment:1/2MS-media_4weeks \| Tissue Type:Whole Plant
F6	Genotype:SALK_108849C_KO \| Treatment:SoilGrown_4weeks \| Tissue Type:Leaves