Metabolomics Workbench : NIH Data Repository : Analyze Studies

Data for ST000756

(Analysis AN001187): Average values per metabolite and experimental factor (Units:Peak area)

Metabolite structure	F1	F2	F3
10-HYDROXYDECANOATE (CAS# 1679-53-4); (M+NA)+	32301.50	57310.00	36911.00
11-DEOXYCORTISOL (CAS# 152-58-9); (M+H)+	26964.33	38692.00	41281.33
16:0-18:0 PC (CAS# 59403-51-9); (M+H)+	19936.00	10772.00	8519.33
16:0-18:0 PC (CAS# 59403-51-9); (M+NA)+	129062.33	182605.00	118184.33
16:0 LYSO PC (CAS# 17364-16-8); (M+H)+	183148.67	264660.00	156255.00
16:0 LYSO PC (CAS# 17364-16-8); (M+NA)+	6789796.67	1175122.00	6906228.33
18:0 LYSO-PE (CAS# 69747-55-3); (2M+NA)+	3497.00	-	11234.00
18:0 LYSO-PE (CAS# 69747-55-3); (M+H)+	-	-	30533.00
1-AMINOCYCLOPROPANE-1-CARBOXYLATE (CAS# 22059-21-8); (M+H)+	17535.00	14785.00	19040.33
1-METHYLADENOSINE (CAS# 15763-06-1); (M+H)+	-	4235.00	7121.00
1-OLEOYL-RAC-GLYCEROL (CAS# 111-03-5); (M+NA)+	389836.00	107829.00	67532.67
20:0 LYSO PC (CAS# 108341-80-6); (M+NA)+	57234.50	85694.00	80953.33
24:0 SM (D18:1/24:0) (CAS# 60037-60-7); (M+NA)+	271489.67	-	-
2-DEOXY-D-GLUCOSE (CAS# 154-17-6); (M+NA)+	3070.50	-	-
2^-DEOXYGUANOSINE (CAS# 961-07-9); (M+H)+	30808.00	64379.00	48959.00
2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID (CAS# 583-91-5); (M+NA)...	-	-	1277.00
2-HYDROXYBUTYRATE (CAS# ); (M+NA)+	1827.00	-	-
2-METHYLGLUTARIC ACID (CAS# 18069-17-5); (M+H)+[-H2O]	2988.00	4056.00	6302.00
2-METHYLMALEATE (CAS# 498-23-7); (M+H)+	98005.50	-	101611.00
2-METHYLPROPANAL OXIME (CAS# 151-00-8); (M+H)+[-H2O]	52086.50	23363.00	29401.00
3-(4-HYDROXYPHENYL)LACTATE (CAS# 6482-98-0); (M+H)+	21598.00	-	30261.50
3-(4-HYDROXYPHENYL)LACTATE (CAS# 6482-98-0); (M+NA)+	-	-	1217.00
3-AMINO-4-HYDROXYBENZOIC ACID (CAS# 1571-72-8); (M+H)+	23979.00	-	-
3-AMINOISOBUTANOATE (CAS# 144-90-1); (M+H)+[-H2O]	5189.00	4241.00	3701.00
3-DEHYDROSHIKIMATE (CAS# 2922-42-1); (M+H)+[-H2O]	-	1208.00	-
3-DEHYDROXYCARNITINE (CAS# 407-64-7); (M+H)+	137618.00	70617.00	29480.33
3-HYDROXY-3-METHYLGLUTARATE (CAS# 503-49-1); (M+NA)+	-	-	36332.00
3-HYDROXYBENZALDEHYDE (CAS# 100-83-4); (M+H)+[-H2O]	18057.33	58687.00	27951.67
3-HYDROXYBENZYL ALCOHOL (CAS# 620-24-6); (M+H)+	-	3659.00	-
3-METHOXYTYROSINE (CAS# 4214-13-5); (M+H)+	12249.00	-	-
3-METHYGLUTARIC ACID (CAS# 626-51-7); (M+H)+[-H2O]	1977.00	4106.00	6302.00
3-METHYL-2-BUTENAL (CAS# 107-86-8); (M+NA)+	2408.50	-	2943.67
3-METHYLADIPIC ACID (CAS# 3058-01-3); (M+NA)+	8888.00	-	16406.00
3-METHYLXANTHINE (CAS# 1076-22-8); (M+H)+	-	-	16308.50
4-ACETAMIDOBUTANOATE (CAS# 3025-96-5); (M+NA)+	66391.00	48340.00	-
4-GUANIDINOBUTANOATE (CAS# 463-00-3 ); (M+H)+	104438.00	-	-
4-HYDROXY-2-QUINOLINECARBOXYLIC ACID-KRYNURENIC ACID (CAS# 4...	5534.00	-	-
4-HYDROXY-3-METHOXYPHENYLGLYCOL (CAS# 67423-45-4); (M+H)+[-H...	434991.00	478515.00	-
4-HYDROXYPHENYLACETATE (CAS# 156-38-7); (M+H)+	8589.50	-	27240.33
4-METHYL-2-OXOVALERIC ACID (CAS# 816-66-0); (M+NA)+	8517.50	16206.00	24947.33
4-METHYLCATECHOL (CAS# 452-86-8); (M+H)+	47953.00	-	58787.00
4-PYRIDOXATE (CAS# 82-82-6); (M+H)+	216588.00	148101.00	80988.00
4-PYRIDOXATE (CAS# 82-82-6); (M+H)+[-H2O]	6794.00	-	-
4-PYRIDOXATE (CAS# 82-82-6); (M+NA)+	15037.00	22969.00	8881.00
4-QUINOLINECARBOXYLIC ACID (CAS# 486-74-8); (M+H)+	52231.00	176529.00	44195.00
5ALPHA-CHOLEST-7-EN-3BETA-OL (CAS# 80-99-9); (M+H)+[-H2O]	235428.33	292241.00	225345.00
5-AMINOPENTANOATE (CAS# 660-88-8); (M+H)+	2650117.67	2383100.00	2388994.67
5-METHYLCYTOSINE (CAS# 554-01-8); (M+H)+	8393.00	-	6826.00
5-METHYLTETRAHYDROFOLATE (CAS# 134-35-0); (M+H)+	5819.00	-	-
5^-METHYLTHIOADENOSINE (CAS# 2457-80-9); (M+H)+	6300.00	17285.00	-
5^-METHYLTHIOADENOSINE (CAS# 2457-80-9); (M+NA)+	3175.00	-	5407.50
5-OXOPROLINE (CAS# 4042-36-8); (M+H)+	288223.00	35817.00	85964.67
5-VALEROLACTONE (CAS# 542-28-9); (M+H)+	8069.67	19398.00	33162.67
6-CARBOXYHEXANOATE (CAS# 111-16-0); (M+NA)+	8888.00	-	15598.00
ABRINE (CAS# 526-31-8); (M+H)+	5054.00	-	-
ACETAMINOPHEN (TN TYLENOL) (CAS# 103-90-2); (M+NA)+	-	2817.00	2317.00
ACETOACETATE (CAS# 541-50-4); (M+H)+	37799.00	14718.00	43420.00
ADENINE (CAS# 73-24-5); (M+H)+	14837.67	6066.00	8932.50
ADENOSINE 5^-MONOPHOSPHATE (CAS# 61-19-8); (2M+H)+	-	-	3441.00
ADENOSINE 5^-MONOPHOSPHATE (CAS# 61-19-8); (M+H)+	6402.00	17421.00	14584.00
ADENOSINE (CAS# 58-61-7); (M+H)+	30808.00	64379.00	48959.00
AHBA (CAS# 76045-71-1); (M+H)+	23979.00	-	-
ALANINE (CAS# 56-41-7); (M+H)+	20025.50	18630.00	10359.50
ALLOSE (CAS# 2595-97-3); (M+NA)+[-H2O]	-	-	36332.00
ALPHA-TOCOPHEROL (CAS# 59-02-9); (M+H)+	11297.33	19433.00	16349.00
ANTHRANILATE (CAS# 118-92-3); (M+H)+	-	4940.00	-
AZELAIC ACID (CAS# 123-99-9); (M+NA)+	34315.33	59962.00	71104.00
BENZYLAMINE (CAS# 100-46-9); (M+H)+	-	1982.00	1021.00
BETA-ALANINE (CAS# 107-95-9); (M+H)+	20025.50	18630.00	10797.00
BETAINE (CAS# 107-43-7); (M+H)+	2657614.33	2225894.00	1156230.67
BETAINE (CAS# 107-43-7); (M+NA)+	231258.67	14439.00	20820.33
BILIRUBIN (CAS# 635-65-4); (M+H)+[-H2O]	2978.00	-	-
BIS(2-ETHYLHEXYL)PHTHALATE (CAS# 117-81-7); (M+H)+	19098.00	-	13500.00
BIS(2-ETHYLHEXYL)PHTHALATE (CAS# 117-81-7); (M+NA)+	1412979.33	1135003.00	1256739.33
C12 GALACTOSYL(BETA) CERAMIDE (D18:1/12:0) (CAS# 41613-14-3)...	7164.00	7187.00	-
C12 GALACTOSYL(BETA) CERAMIDE (D18:1/12:0) (CAS# 41613-14-3)...	-	-	4143.00
CAFFEINE (CAS# 58-08-2); (M+NA)+	6065.00	25647.00	16632.50
CATECHOL (CAS# 120-80-9); (M+H)+	-	-	2651.00
CHOLATE (CAS# 81-25-4); (2M+H)+	3087.00	40196.00	223140.67
CHOLATE (CAS# 81-25-4); (2M+H)+[-H2O]	-	13499.00	77671.33
CHOLATE (CAS# 81-25-4); (2M+NA)+	23198.00	458007.00	3075505.00
CHOLATE (CAS# 81-25-4); (M+NA)+	242265.67	1199451.00	2242333.33
CHOLESTEROL (CAS# 57-88-5); (M+H)+[-H2O]	235428.33	292261.00	225384.67
CHOLINE (CAS# 62-49-7); M+	78720.67	24182.00	20917.33
CHOLINE PHOSPHATE (CAS# 107-73-3); (M+H)+	4884.00	-	-
CIS-VACCENIC ACID (CAS# 506-17-2); (M+H)+	2929.67	3867.00	8225.00
CIS-VACCENIC ACID (CAS# 506-17-2); (M+K)+	-	-	3820.50
CIS-ZEATIN (CAS# 1637-39-4); (M+H)+	8063925.33	12100000.00	9345796.67
CITRAMALATE (CAS# 2306-22-1); (M+H)+	-	-	5953.00
CITRATE (CAS# 77-92-9); (M+NA)+	50623.67	91471.00	92008.33
CITRULLINE (CAS# 372-75-8); (M+NA)+	2708.00	-	2437.00
CORTICOSTERONE (CAS# 50-22-6); (M+H)+	26670.00	39298.00	40514.00
(-)-COTININE (CAS# 486-56-6); (M+H)+	60215.00	248604.00	284821.00
CREATINE (CAS# 57-00-1); (M+H)+	380747.00	-	308019.00
CYTIDINE (CAS# 65-46-3); (2M+H)+	6020.00	4572.00	2965.50
CYTIDINE (CAS# 65-46-3); (M+H)+	29115.33	11353.00	11752.67
CYTOSINE (CAS# 71-30-7); (M+H)+	33104.33	-	18101.00
D-(-)-ARABINOSE (CAS# 10323-20-3); (M+NA)+	53527.67	16551.00	6562.00
DEBRISOQUIN (CAS# 581-88-4); (M+H)+	2476.50	-	2096.00
DECANOATE (CAS# 334-48-5); (2M+NA)+	6467.50	-	-
DEOXYCHOLIC ACID (CAS# 83-44-3); (2M+NA)+	-	-	94467.00
DEOXYCHOLIC ACID (CAS# 83-44-3); (M+H)+	10996.00	-	7359.00
DEOXYCHOLIC ACID (CAS# 83-44-3); (M+NA)+	25715.50	31684.00	277147.67
DEOXYCYTIDINE (CAS# 951-77-9); (2M+H)+	2572273.33	4811451.00	1064019.67
DEOXYCYTIDINE (CAS# 951-77-9); (2M+NA)+	48829.50	2275.00	-
DEOXYCYTIDINE (CAS# 951-77-9); (M+NA)+	25327.50	9456.00	-
DESMOSTEROL (CAS# 313-04-2); (M+H)+[-H2O]	-	-	2689.00
DGMP (CAS# 902-04-5); (M+H)+	1125.00	17421.00	14584.00
DIMETHYL MALEATE (CAS# 624-48-6); (M+NA)+	9002.50	24482.00	17543.00
DI-TERT-BUTYL DICARBONATE (CAS# 24424-99-5); (M+NA)+	21513.00	8580.00	18713.50
D-ORNITHINE (CAS# 348-66-3); (M+H)+	2027.00	1393.00	1956.00
EDTA (CAS# 60-00-4); (M+H)+	2878650.00	8789723.00	11534516.67
EDTA (CAS# 60-00-4); (M+NA)+	6229772.00	7395671.00	2491417.00
ELAIDIC ACID (CAS# 112-79-8); (M+H)+	2929.67	3867.00	8225.00
ELAIDIC ACID (CAS# 112-79-8); (M+NA)+	16980.00	23474.00	18452.67
EPINEPHRINE (CAS# 51-43-4); (M+H)+	-	-	1560.50
EPINEPHRINE (CAS# 51-43-4); (M+H)+[-H2O]	28710.50	-	-
ESTRADIOL-17BETA (CAS# 50-28-2); (M+NA)+	3965.00	-	3777.00
FRUCTOSE (CAS# 57-48-7); (M+NA)+	225000.33	89345.00	64398.33
GLUCOSE (CAS# 50-99-7); (M+NA)+	225000.33	30108.00	59954.67
GLUTAMATE (CAS# 56-86-0); (M+H)+[-H2O]	18275.00	-	-
GLUTAMINE (CAS# 56-85-9); (M+NA)+	3327.00	-	-
GLUTARATE (CAS# 110-94-1); (M+NA)+[-H2O]	-	-	2192.00
GLUTATHIONE (CAS# 27025-41-8); (M+H)+	3679.67	13866.00	5109.67
GLUTATHIONE (CAS# 27025-41-8); (M+H2)+2	4969.50	-	-
GLYCERALDEHYDE (CAS# 367-47-5); (2M+NA)+[-H2O]	-	-	36332.00
GLYCOCHENODEOXYCHOLATE (CAS# 640-79-9); (M+H)+	-	-	3322.00
GLYCOCHENODEOXYCHOLATE (CAS# 640-79-9); (M+H)+[-H2O]	3089.00	-	-
GLYCOCHENODEOXYCHOLATE (CAS# 640-79-9); (M+NA)+	2111.00	-	19919.00
GLYCOCHOLATE (CAS# 475-31-0); (2M+NA)+	-	-	5222.00
GLYCOCHOLATE (CAS# 475-31-0); (M+H)+	-	-	8233.00
GLYCOCHOLATE (CAS# 475-31-0); (M+H)+[-H2O]	-	-	27759.33
GLYCOCHOLATE (CAS# 475-31-0); (M+NA)+	1229145.33	2004304.00	985440.33
GUAIFENESIN (CAS# 93-14-1); (M+NA)+	-	219016.00	149290.00
GUANINE (CAS# 73-40-5); (M+H)+	85009.67	47826.00	45246.00
GUANINE (CAS# 73-40-5); (M+NA)+	4796.00	-	-
GUANOSINE (CAS# 118-00-3); (M+H)+	8092.00	-	-
HIPPURATE (CAS# 495-69-2); (M+H)+	122918.00	201954.00	148597.00
HIPPURATE (CAS# 495-69-2); (M+NA)+	305890.00	1046781.00	622768.00
HISTAMINE (CAS# 51-45-6); (M+H)+	2248.00	3346.00	2337.00
HOMOGENTISATE (CAS# 451-13-8); (M+H)+	155074.50	-	-
HOMOGENTISATE (CAS# 451-13-8); (M+NA)+	5822.00	-	-
HOMOVANILLATE (CAS# 306-08-1); (M+H)+	13609.00	-	-
HYODEOXYCHOLATE (CAS# 83-49-8); (M+NA)+	-	-	40780.50
INDOLE-3-ACETALDEHYDE (CAS# 2591-98-2); (M+H)+	52050.00	547710.00	350324.00
INDOLE-3-ACETATE (CAS# 87-51-4); (M+H)+	12327.33	28970.00	11833.00
INDOLE-3-ACETATE (CAS# 87-51-4); (M+NA)+	13168.50	28815.00	13331.50
INDOLE-3-ETHANOL (CAS# 526-55-6); (M+H)+	7359.50	12606.00	-
INOSINE (CAS# 58-63-9); (M+H)+	28625.00	-	-
INOSINE (CAS# 58-63-9); (M+NA)+	41158.00	9263.00	28476.00
ISOLEUCINE (CAS# 73-32-5); (M+H)+	8065297.67	18300000.00	22366666.67
ISOLEUCINE (CAS# 73-32-5); (M+NA)+	66772.00	68741.00	110680.67
JASMONIC ACID [ISTD] (CAS# 77026-92-7); (M+NA)+	16560.33	32201.00	22431.00
KYNURENINE (CAS# 343-65-7); (M+H)+	181759.33	582192.00	224648.00
KYNURENINE (CAS# 343-65-7); (M+NA)+	29329.00	90959.00	36994.00
L-ALLOTHREONINE (CAS# 28954-12-3); (M+H)+[-H2O]	-	-	26339.50
LANOSTEROL (CAS# 79-63-0); (M+NA)+	49359.00	77070.00	-
L-ARGININE (CAS# 74-79-3); (M+H)+	67919.00	-	-
L-CARNITINE (CAS# 541-15-1); (M+H)+	1596934.00	90243.00	966288.67
LEUCINE (CAS# 328-39-2); (M+H)+	8065297.67	18300000.00	22366666.67
LEUCINE (CAS# 328-39-2); (M+NA)+	66772.00	59492.00	112894.00
LEUKOTRIENE B4 (CAS# 71160-24-2); (M+H)+[-H2O]	-	5540.00	1330.00
LEVORPHANOL (CAS# 77-07-6); (M+H)+	-	-	4697.00
LITHOCHOLIC ACID (CAS# 434-13-9); (M+NA)+	4150.00	2409.00	6754.00
L-ORNITHINE (CAS# 70-26-8); (M+H)+	2027.00	1393.00	1956.00
L-TRYPTOPHAN-15N2 [ISTD] (CAS# ); (M+H)+	436393.33	812624.00	599868.00
LYSINE (CAS# 56-87-1); (M+H)+	17498.00	8776.00	4601.33
LYSINE (CAS# 56-87-1); (M+NA)+	2741.00	1658.00	-
MELATONIN (CAS# 73-31-4); (M+NA)+	-	-	8575.50
METHIONINE (CAS# 63-68-3); (M+H)+	1765529.33	982188.00	963866.00
METHYL JASMONATE (CAS# 1211-29-6); (M+NA)+	39909.67	44981.00	39245.67
METHYLMALONATE (CAS# 516-05-2); (M+NA)+	-	-	1288.00
MEVALONIC ACID (CAS# 674-26-0); (M+NA)+	-	-	2412.00
MONO-METHYL GLUTARATE (CAS# 1501-27-5); (M+H)+[-H2O]	1977.00	4056.00	-
MYO-INOSITOL (CAS# 87-89-8); (M+NA)+	40602.67	32496.00	49818.33
N-ACETYL-DL-GLUTAMIC ACID (CAS# 5817-08-3); (M+NA)+	3846.50	-	11042.00
N-ACETYL-DL-METHIONINE (CAS# 1115-47-5); (M+NA)+	5885.00	-	10604.00
N-ACETYL-DL-SERINE (CAS# 97-14-3); (M+H)+[-H2O]	20667.33	13144.00	16493.00
N-ACETYL-L-ALANINE (CAS# 97-69-8); (M+NA)+	13194.00	6486.00	8929.67
N-ACETYL-L-ASPARTIC ACID (CAS# 997-55-7); (M+H)+	-	2057.00	-
N-ACETYL-L-ASPARTIC ACID (CAS# 997-55-7); (M+NA)+	3717.00	8322.00	2833.33
N-ACETYL-L-LEUCINE (CAS# 1188-21-2); (M+H)+	1798.50	2796.00	23420.00
N-ACETYL-L-LEUCINE (CAS# 1188-21-2); (M+NA)+	35712.00	61612.00	344553.50
N-ALPHA-ACETYL-L-LYSINE (CAS# 1946-82-3); (M+H)+	12854.00	7814.00	6861.00
N-CYCLOHEXYLFORMAMIDE (CAS# 766-93-8); (2M+H)+	-	-	1202.00
N-CYCLOHEXYLFORMAMIDE (CAS# 766-93-8); (M+H)+	9774.00	12407.00	10776.00
N-CYCLOHEXYLFORMAMIDE (CAS# 766-93-8); (M+NA)+	20509.33	18944.00	21870.00
NICOTINAMIDE (CAS# 98-92-0); (M+H)+	244253.67	321445.00	132599.00
NICOTINATE (CAS# 59-67-6); (M+H)+	1608.00	-	3060.00
N-METHYLANILINE (CAS# 100-61-8); (M+H)+	-	1934.00	1021.00
N-METHYL-L-GLUTAMATE (CAS# 6753-62-4); (M+NA)+	135176.00	170474.00	69413.33
N-METHYL-L-GLUTAMATE (CAS# 6753-62-4); (M+NA)+[-H2O]	-	-	3246.00
N-METHYLNICOTINATE (CAS# 535-83-1); (M+H)+	-	40984.00	62858.67
NORADRENALINE (CAS# 51-41-2); (M+H)+[-H2O]	7579.33	-	3554.50
NORLEUCINE (CAS# 327-57-1); (M+H)+	13033333.33	18300000.00	22366666.67
NORMETANEPHRINE (CAS# 0); (M+H)+[-H2O]	2242082.67	2338898.00	2384081.00
NORVALINE (CAS# 6600-40-4); M+[-CO2H]	778570.33	505536.00	1272191.00
NORVALINE (CAS# 6600-40-4); (M+H)+	2994817.33	2253976.00	3423212.00
N(PAI)-METHYL-L-HISTIDINE (CAS# 332-80-9); (M+H)+	1558.00	4980.00	-
O-ACETYLCARNITINE (CAS# 461-77-8); (M+H)+	3607371.33	9448090.00	8907562.33
OLEIC ACID (CAS# 112-80-1); (M+NA)+	67818.00	70181.00	69554.33
OPHTHALMIC ACID (CAS# 495-27-2); (M+H)+	-	1418.00	7161.00
OXIDIZED GLUTATHIONE (CAS# 27025-41-8); (M+2H)+2	4969.50	-	-
OXIDIZED GLUTATHIONE (CAS# 27025-41-8); (M+H)+	3679.67	13866.00	5109.67
PALMITOYLCARNITINE (CAS# 2364-67-2); (M+H)+	25879.00	42271.00	51306.33
PANTOTHENATE (CAS# 79-83-4); (M+H)+	210691.00	698758.00	318606.67
PANTOTHENATE (CAS# 79-83-4); (M+NA)+	509981.33	1886705.00	913789.33
PARAXANTHINE (CAS# 611-59-6); (M+NA)+	29080.00	143607.00	123791.00
PHENYLALANINE (CAS# 63-91-2); (M+H)+	1611841.33	884815.00	1978790.00
PHENYLALANINE (CAS# 63-91-2); (M+NA)+	56777.50	21534.00	51218.00
PHENYLEPHRINE (CAS# 59-42-7); (M+H)+	24981.00	33177.00	5641.00
PHENYLETHANOLAMINE (CAS# 7568-93-6); (M+H)+	31832.50	47300.00	29592.33
PHTHALATE (CAS# 88-99-3); (M+H)+	10959.00	23035.00	15730.00
PHTHALATE (CAS# 88-99-3); (M+NA)+	-	-	2188.50
PICOLINIC ACID (CAS# 98-98-6); (M+H)+	1608.00	-	2928.00
PIPECOLATE (CAS# 535-75-1); (M+H)+	62924.67	3527.00	-
PIPECOLATE (CAS# 535-75-1); (M+NA)+	7917.67	-	2255.33
PROLINE (CAS# 147-85-3); (M+H)+	270975.00	135366.00	108237.00
PROLINE (CAS# 147-85-3); (M+NA)+	-	-	3790.00
PURINE (CAS# 120-73-0); (M+H)+	1054162.67	644010.00	634351.00
PURINE (CAS# 120-73-0); (M+NA)+	70293.50	61666.00	27055.00
PYRIDOXAL (CAS# 66-72-8); (M+H)+	54441.33	1001.00	11409.00
PYRIDOXAL PHOSPHATE (CAS# 853645-22-4); (2M+H)+	6834.00	2681.00	4688.67
QUINOLIN-2-OL (CAS# 59-31-4); (M+H)+	41589.33	41455.00	60391.00
QUINOLIN-2-OL (CAS# 59-31-4); (M+NA)+	92331.67	79346.00	135868.67
RAFFINOSE (CAS# 512-69-6); (M+NA)+	1094.00	-	-
RIBOFLAVIN (CAS# 83-88-5); (M+NA)+	1554.00	-	2817.50
RIBOSE (CAS# 50-69-1); (M+NA)+	53527.67	16551.00	6562.00
S-ADENOSYL-L-HOMOCYSTEINE (CAS# 979-92-0); (M+H)+	6121.33	20633.00	24646.50
(-)-SALSOLINOL (CAS# 27740-96-1); (M+H)+	40828.00	63386.00	49798.67
SARCOSINE (CAS# 107-97-1); (M+H)+	20025.50	18630.00	10797.00
SERINE (CAS# 56-45-1); (M+H)+	8120.00	-	2142.00
SEROTONIN (CAS# 50-67-9); (M+H)+	60215.00	248604.00	284821.00
SHIKIMATE (CAS# 138-59-0); (M+H)+[-H2O]	-	-	2289.00
SN-GLYCERO-3-PHOSPHOCHOLINE (CAS# 28319-77-9); (M+H)+	80345.00	58236.00	127970.00
SPERMIDINE (CAS# 124-20-9); (M+H)+	233084.67	31318.00	18712.33
SQUALENE (CAS# 111-02-4); (M+K)+	-	-	2266.00
SUBERIC ACID (CAS# 505-48-6); (M+NA)+	18273.00	35740.00	26150.50
TAUROCHENODEOXYCHOLATE (CAS# 516-35-8); (M+NA)+	-	1193.00	7830.00
TAUROCHOLATE (CAS# 81-24-3); (M+NA)+	16072.00	3764.00	-
TAUROLITHOCHOLATE (CAS# 516-90-5); (M+NA)+	-	-	17179.00
THEOBROMINE (CAS# 83-67-0); (M+NA)+	60061.00	185052.00	169796.00
THEOPHYLLINE (CAS# 58-55-9); (M+NA)+	37384.50	6490.00	121680.50
THIAMIN (CAS# 59-43-8); M+	4139.00	1686.00	1469.00
THREONINE (CAS# 72-19-5); (M+H)+[-H2O]	15978.00	-	22633.33
THYMIDINE (CAS# 50-89-5); (M+NA)+	116886.33	298290.00	166044.00
TRIBUTYRIN (CAS# 60-01-5); (M+NA)+	-	-	1097.00
TRIMETHYLAMINE (CAS# 75-50-3); (M+H)+	-	-	8366.00
TRYPTOPHANAMIDE (CAS# 20696-57-5); (M+H)+	-	-	15058.00
TRYPTOPHAN (CAS# 73-22-3); (M+H)+	4121512.00	9096288.00	4082644.00
TRYPTOPHAN (CAS# 73-22-3); (M+NA)+	1646252.00	3068789.00	1413816.67
TYROSINE (CAS# 60-18-4); (M+H)+	5473503.00	6115757.00	4634979.00
TYROSINE (CAS# 60-18-4); (M+NA)+	125563.00	-	105774.00
URATE (CAS# 69-93-2); (M+H)+	17871.00	16611.00	10584.67
URIDINE (CAS# 58-96-8); (M+NA)+	20066.00	13342.00	3150.00
UROCANATE (CAS# 104-98-3); (M+H)+	146717.00	19837.00	48691.00
URSODIOL (CAS# 128-13-2); (M+NA)+	24872.00	31684.00	277147.67
VALINE (CAS# 72-18-4); (M+H)+	2722578.00	2249151.00	3416696.67
VALINE (CAS# 72-18-4); (M+NA)+	145379.00	14439.00	20820.33
XANTHOSINE (CAS# 146-80-5); (M+H)+	1098.00	-	-
XANTHOSINE (CAS# 146-80-5); (M+NA)+	2773.33	7465.00	4035.00
ZEATIN [ISTD] (CAS# 13114-27-7); (M+H)+	8063925.33	12100000.00	9345752.67

Factors:

F1	Days post-STZ:-
F2	Days post-STZ:3
F3	Days post-STZ:30
F4	Days post-STZ:POOLED