Metabolomics Workbench : NIH Data Repository : Analyze Studies

Data for ST000756

(Analysis AN001186): Average values per metabolite and experimental factor (Units:Peak area)

Metabolite structure	F1	F2	F3
10-HYDROXYDECANOATE (CAS# 1679-53-4); (M-H)-	-	6251.50	-
11-DEOXYCORTISOL (CAS# 152-58-9); (M+CL)-	47928.33	107220.67	90062.67
11-DEOXYCORTISOL (CAS# 152-58-9); (M+HCOO)-	216009.00	573208.33	405231.67
16:0-18:0 PC (CAS# 59403-51-9); (M+CL)-	3440.00	6223.00	6209.00
16:0 LYSO PC (CAS# 17364-16-8); (M+CL)-	27279.67	25664.33	26040.67
16:0 LYSO PC (CAS# 17364-16-8); (M+HCOO)-	901622.33	944381.33	854943.67
18:0 LYSO-PE (CAS# 69747-55-3); (M-H)-	68030.67	77600.33	114699.67
1-METHYLADENOSINE (CAS# 15763-06-1); (M+CL)-	1881.00	-	13037.00
1-METHYLURIC ACID (CAS# 708-79-2); (M-H)-	8392.00	-	36039.00
20:0 LYSO PC (CAS# 108341-80-6); (M+CL)-	-	1287.00	-
20:0 LYSO PC (CAS# 108341-80-6); (M+HCOO)-	13946.50	14823.67	14218.00
2-DEOXY-D-GLUCOSE (CAS# 154-17-6); (M+CL)-	216871.50	-	-
2-DEOXY-D-GLUCOSE (CAS# 154-17-6); (M+HCOO)-	23639.00	1981.00	-
2^-DEOXYGUANOSINE (CAS# 961-07-9); (M-H)-	-	-	5120.00
2-HYDROXY-3-METHYLBUTYRIC ACID (CAS# 4026-18-0); (M-H)-	81720.67	198331.33	1230324.00
2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID (CAS# 583-91-5); (M-H)-	4792.50	-	26282.50
2-HYDROXYBUTYRATE (CAS# ); (M-H)-	39629.00	118189.00	171894.00
2-METHYLGLUTARIC ACID (CAS# 18069-17-5); (M-H)-	46985.00	70718.33	136931.67
2-METHYLMALEATE (CAS# 498-23-7); (M-H)-	39928.67	62575.67	23052.67
2-OXOADIPATE (CAS# 3184-35-8); (M-H)-	46386.00	21816.00	-
3-(2-HYDROXYPHENYL)PROPANOATE (CAS# 495-78-3); (M-H)-	21781.00	23979.00	13972.00
3-(4-HYDROXYPHENYL)LACTATE (CAS# 6482-98-0); (M-H)-	98450.00	223022.00	125176.67
3BETA-HYDROXY-5ALPHA-PREGNAN-20-ONE (CAS# 516-55-2); (M+CL)-...	6661.00	-	3740.00
3-HYDROXY-3-METHYLGLUTARATE (CAS# 503-49-1); (M-H)-	139405.00	330487.00	969477.67
3-HYDROXYBENZALDEHYDE (CAS# 100-83-4); (M-H)-	61754.00	15879.33	25272.00
3-HYDROXYBENZOATE (CAS# 99-06-9); (M-H)-	4185.33	4512.00	5936.00
3-HYDROXYPHENYLACETATE (CAS# 621-37-4); (M-H)-	1348.00	2055.00	1428.00
3-HYDROXYPYRUVIC ACID (CAS# 1113-60-6); (M-H)-	37331.67	18995.50	30410.00
3-METHOXYTYROSINE (CAS# 4214-13-5); (M-H)-	1911.00	4080.50	-
3-METHYGLUTARIC ACID (CAS# 626-51-7); (M-H)-	48223.00	70718.33	137927.00
3-METHYLADIPIC ACID (CAS# 3058-01-3); (M-H)-	23102.67	29186.33	31545.33
3-NITRO-L-TYROSINE (CAS# 621-44-3); (M-H)-	2806.00	52731.00	-
3-PHOSPHOGLYCERATE (CAS# ); (M-H)-	-	1147.00	-
4-ACETAMIDOBUTANOATE (CAS# 3025-96-5); (M-H)-	16872.33	-	-
4-ACETAMINOPHEN SULFATE (CAS# 32113-41-0); (M-H)-	1363.00	-	-
4-COUMARATE (CAS# 501-98-4); (M-H)-	12966.67	11920.33	20416.67
4-HYDROXY-2-QUINOLINECARBOXYLIC ACID-KRYNURENIC ACID (CAS# 4...	7828.00	12686.50	-
4-HYDROXYBENZALDEHYDE (CAS# 123-08-0); (M-H)-	61754.00	16338.33	25546.67
4-HYDROXYBENZOATE (CAS# 99-96-7); (M-H)-	7994.33	4627.00	13963.00
4-HYDROXYPHENYLACETATE (CAS# 156-38-7); (M-H)-	1646.00	3339.00	6203.00
4-METHYL-2-OXOPENTANOATE (CAS# 816-66-0); (M-H)-	1466892.67	2818790.33	2737080.67
4-METHYL-2-OXOVALERIC ACID (CAS# 816-66-0); (M-H)-	1466697.33	2818501.00	2736856.33
4-NITROCATECHOL (CAS# 3316-09-4); (M-H)-	32294.00	-	23245.00
4-NITROPHENOL (CAS# 100-02-7); (M-H)-	49144.00	24392.33	71288.67
4-PYRIDOXATE (CAS# 82-82-6); (M-H)-	362531.00	585585.67	358936.33
5-AMINOPENTANOATE (CAS# 660-88-8); (M-H)-	5105.00	8785.50	11786.00
5-HYDROXYTRYPTOPHAN (CAS# 4350-09-8); (M-H)-	10026.50	34273.50	18160.50
5-METHYLTETRAHYDROFOLATE (CAS# 134-35-0); (M-H)-	8136.00	-	-
5^-METHYLTHIOADENOSINE (CAS# 2457-80-9); (M+CL)-	3778.00	8292.00	6863.50
5^-METHYLTHIOADENOSINE (CAS# 2457-80-9); (M+HCOO)-	2165.00	4840.00	5565.00
5-OXOPROLINE (CAS# 4042-36-8); (M-H)-	689461.00	-	-
5-VALEROLACTONE (CAS# 542-28-9); (M+HCOO)-	19127.33	137733.00	202924.50
6-CARBOXYHEXANOATE (CAS# 111-16-0); (M-H)-	23102.67	29186.33	32299.00
ACETOACETATE (CAS# 541-50-4); (M-H)-	21582.67	27388.67	29957.67
ADENOSINE 5^-MONOPHOSPHATE (CAS# 61-19-8); (M-H)-	-	105823.33	44276.50
ADENOSINE 5^-PHOSPHOSULFATE (CAS# 485-84-7); (M-H)-	1007.00	4220.67	1920.50
ADIPIC ACID (CAS# 124-04-9 ); (M-H)-	48223.00	70718.33	137927.00
ALLANTOIN (CAS# 97-59-6); (M-H)-	164858.00	43353.00	107847.00
ALLOSE (CAS# 2595-97-3); (M-H)+[-H2O]	166562.50	330487.00	969477.67
ALPHA-HYDROXYISOBUTYRIC ACID (CAS# 594-61-6); (M-H)-	39629.00	118189.00	171894.00
ALPHA-KETO-GLUTARATE (CAS# 328-50-7); (M-H)-	182433.00	119109.50	160573.00
ALPHA-LINOLENIC ACID (CAS# 463-40-1); (M+HCOO)-	72838.67	78679.50	120035.50
ARACHIDIC ACID (CAS# 506-30-9); (M-H)-	-	-	2049.00
ARACHIDONATE (CAS# 506-32-1); (M-H)-	867487.67	1026284.67	1225775.67
AZELAIC ACID (CAS# 123-99-9); (M-H)-	92180.67	729474.00	144698.33
BEHENIC ACID (CAS# 112-85-6); (M-H)-	-	-	1419.00
BENZALDEHYDE (CAS# 100-52-7); (M+HCOO)-	-	3339.00	6203.00
BENZOATE (CAS# 65-85-0); (M-H)-	61754.00	15832.33	24956.33
BETA-ALANYL-N(PAI)-METHYL-L-HISTIDINE (CAS# 584-85-0); (M-H)...	1437.00	-	-
BETA-CAROTENE (CAS# 7235-40-7); (M-H)-	-	1586.00	-
BETA-MALTOSE (CAS# 69-79-4); (M+CL)-	79195.00	-	-
BETA-MALTOSE (CAS# 69-79-4); (M+HCOO)-	-	2138.50	-
BIOTIN (CAS# 58-85-5); (M-H)-	6902.67	11038.00	34857.00
BOC-LYS-OH (CAS# 13734-28-6); (M-H)-	1337.00	3092.00	-
C12 GALACTOSYL(BETA) CERAMIDE (D18:1/12:0) (CAS# 41613-14-3)...	9865.00	11656.00	12768.00
CATECHOL (CAS# 120-80-9); (M-H)-	22662.67	46547.50	38082.33
CELLOBIOSE (CAS# 528-50-7); (M+CL)-	79195.00	-	-
CHOLATE (CAS# 81-25-4); (2M-H)-	85409.00	723622.33	4747556.33
CHOLATE (CAS# 81-25-4); (M+CL)-	64106.67	208654.67	843931.67
CHOLATE (CAS# 81-25-4); (M-H)-	1216033.00	3218110.00	6748373.00
CINNAMIC ACID (CAS# 140-10-3); (M-H)-	1190.00	-	-
CIS-11-EICOSENOIC ACID (CAS# 5561-99-9); (M-H)-	5254.67	7379.00	12778.00
CIS-ACONITATE (CAS# 585-84-2); (M-H)-	1264668.50	2270686.33	2228578.00
CIS-VACCENIC ACID (CAS# 506-17-2); (M-H)-	205298.33	432223.33	441702.00
CIS-ZEATIN (CAS# 1637-39-4); (M+CL)-	2043007.33	2694126.33	2540603.33
CIS-ZEATIN (CAS# 1637-39-4); (M-H)-	3677087.67	5045461.00	4472928.33
CITRAMALATE (CAS# 2306-22-1); (M-H)-	125054.00	186949.33	273886.67
CITRATE (CAS# 77-92-9); (M-H)-	5896364.00	14766666.67	14366666.67
CITRULLINE (CAS# 372-75-8); (M-H)-	124408.67	59528.00	131343.33
CORTICOSTERONE (CAS# 50-22-6); (M+CL)-	47708.00	106779.00	89868.67
CORTICOSTERONE (CAS# 50-22-6); (M+HCOO)-	216110.67	573351.33	405342.67
CYCLOHEPTANECARBOXYLIC ACID (CAS# 1460-16-8); (M+HCOO)-	92166.67	729244.00	144830.33
CYTIDINE 5^-DIPHOSPHOCHOLINE (CAS# 987-78-0); (M+CL)-	-	2533.50	-
CYTIDINE (CAS# 65-46-3); (M+CL)-	4174.00	-	-
D-(-)-ARABINOSE (CAS# 10323-20-3); (M+HCOO)-	314780.33	131364.33	295108.00
DECANOATE (CAS# 334-48-5); (M-H)-	-	1249.00	-
DEHYDROASCORBATE (CAS# 490-83-5); (M+CL)-	71053.00	-	4060.67
DEHYDROASCORBATE (CAS# 490-83-5); (M-H)-	1144866.00	2658870.67	3180476.33
DEHYDROASCORBATE (CAS# 490-83-5); (M+HCOO)-	-	4476.50	-
DEOXYADENOSINE (CAS# 16373-93-6); (M+CL)-	15841.50	22263.33	40647.33
DEOXYCHOLIC ACID (CAS# 83-44-3); (2M-H)-	3474.00	6644.00	112064.33
DEOXYCHOLIC ACID (CAS# 83-44-3); (M+CL)-	3988.00	4606.00	37177.33
DEOXYCHOLIC ACID (CAS# 83-44-3); (M-H)-	121969.00	162400.00	1049823.67
DEOXYCYTIDINE (CAS# 951-77-9); (M+CL)-	45939.00	41988.00	22315.50
DEOXYCYTIDINE (CAS# 951-77-9); (M+HCOO)-	7662.00	-	2757.00
DEOXYURIDINE (CAS# 951-78-0); (M+CL)-	236391.00	558517.50	359266.00
DEOXYURIDINE (CAS# 951-78-0); (M-H)-	29665.67	45991.33	17785.50
DEOXYURIDINE (CAS# 951-78-0); (M+HCOO)-	36563.33	61805.00	-
DGMP (CAS# 902-04-5); (M-H)-	-	98629.00	86399.00
DIACETYL (CAS# 431-03-8); (M+HCOO)-	46807.50	40671.00	53648.67
D-LYXOSE (CAS# 1114-34-7); (M+CL)-	5763.50	-	3363.50
D-LYXOSE (CAS# 1114-34-7); (M-H)-	34121.33	44583.67	39023.00
D-LYXOSE (CAS# 1114-34-7); (M+HCOO)-	310416.67	176266.50	297326.00
DOCOSAHEXAENOIC ACID (CAS# 6217-54-5 ); (M-H)-	354488.67	468493.67	810766.00
D-ORNITHINE (CAS# 348-66-3); (M-H)-	44863.50	21393.33	42449.33
D-PSICOSE (CAS# 551-68-8); (M+CL)-	20266666.67	19200000.00	24733333.33
D-TAGATOSE (CAS# 87-81-0); (M+CL)-	20266666.67	19200000.00	24700000.00
DUMP (CAS# 964-26-1); (M-H)-	7755.00	-	-
EDTA (CAS# 60-00-4); (M-H)-	7818126.00	32100000.00	4846372.50
ELAIDIC ACID (CAS# 112-79-8); (M-H)-	205298.33	432223.33	441702.00
EPIBRASSINOLIDE [ISTD] (CAS# 78821-43-9); (M+CL)-	1011282.33	1522498.67	1347779.33
EPIBRASSINOLIDE [ISTD] (CAS# 78821-43-9); (M+HCOO)-	7881157.33	11501355.33	10032025.67
ERUCIC ACID (CAS# 112-86-7); (M-H)-	1625.00	1548.33	1575.67
ETHANOLAMINE PHOSPHATE (CAS# 1071-23-4); (M-H)-	-	36861.00	33278.00
ETHYLMALONIC ACID (CAS# 601-75-2); (M-H)-	70722.00	34041.33	21113.00
FRUCTOSE (CAS# 57-48-7); (M+CL)-	20266666.67	19200000.00	24700000.00
FRUCTOSE (CAS# 57-48-7); (M+HCOO)-	51210.00	213724.00	112639.33
FUMARATE (CAS# 110-17-8); (M-H)-	33633.67	23407.00	46617.00
GALACTARATE (CAS# 526-99-8); (M-H)-	-	9994.00	12889.67
GALACTURONIC ACID (CAS# 91510-62-2); (M-H)-	10047.00	9238.50	-
GAMMA-BUTYROLACTONE (CAS# 96-48-0); (M+HCOO)-	46807.50	40927.33	53658.67
GAMMA-LINOLENIC ACID (CAS# 506-26-3); (M+HCOO)-	72838.67	78717.50	120035.50
GIBBERELLIC ACID [ISTD] (CAS# 77-06-5); (2M-H)-	18250.67	54092.00	31646.67
GIBBERELLIC ACID [ISTD] (CAS# 77-06-5); (M+CL)-	52751.67	75600.33	66545.33
GIBBERELLIC ACID [ISTD] (CAS# 77-06-5); (M-H)-	718093.00	1111343.33	944874.00
GLUCARIC ACID (CAS# 87-73-0); (M-H)-	-	9994.00	12889.67
GLUCARIC ACID (CAS# 87-73-0); (M-H)+[-H2O]	4769613.67	15033333.33	18966666.67
GLUCONIC ACID (CAS# 526-95-4); (M-H)-	314780.33	131364.33	295108.00
GLUCOSE (CAS# 50-99-7); (2M+CL)-[-H2O]	81598.00	-	-
GLUCOSE (CAS# 50-99-7); (2M+HCOO)-[-H2O]	-	2318.00	-
GLUCOSE (CAS# 50-99-7); (M+CL)-	20266666.67	19200000.00	24700000.00
GLUCURONIC ACID (CAS# 6556-12-3); (M+CL)-	-	-	4588.00
GLUCURONIC ACID (CAS# 6556-12-3); (M-H)-	10047.00	6846.00	-
GLUTAMINE (CAS# 56-85-9); (M-H)-	320126.50	146217.67	185242.67
GLUTARATE (CAS# 110-94-1); (M-H)-	44637.00	40927.33	53658.67
GLUTATHIONE (CAS# 27025-41-8); (M-H)-	9077.67	21724.00	8580.33
GLYCERALDEHYDE (CAS# 367-47-5); (2M-H)-[-H2O]	139405.00	330487.00	969477.67
GLYCERATE (CAS# 473-81-4); (M-H)-	7405.33	6871.00	5436.00
GLYCEROL 2-PHOSPHATE (CAS# ); (M-H)-	9922.00	-	-
GLYCINE (CAS# 56-40-6); (M-H)-	7035.00	-	-
GLYCOCHOLATE (CAS# 475-31-0); (2M-H)-	-	-	15540.00
GLYCOCHOLATE (CAS# 475-31-0); (M-H)-	130112.00	186917.00	1549586.67
GLYOXYLATE (CAS# 298-12-4); (M-H)-	-	-	1413.00
GUANINE (CAS# 73-40-5); (M-H)-	1815.00	-	-
GUANOSINE 5^-PHOSPHATE (CAS# 85-32-5); (2M-H)+	286287.00	240101.00	285941.00
GUANOSINE 5^-PHOSPHATE (CAS# 85-32-5); (M-H)-	4660.00	5340.00	3367.00
GUANOSINE (CAS# 118-00-3); (M+CL)-	-	1169.00	-
HEPTADECANOATE (CAS# 506-12-7); (M-H)-	4174.67	4943.33	10170.67
HEXACOSANOIC ACID (CAS# 506-46-7); (M-H)-	-	1065.00	-
HIPPURATE (CAS# 495-69-2); (M-H)-	1164066.67	1732283.00	1672592.00
HOMOVANILLATE (CAS# 306-08-1); (M-H)-	-	1576.00	-
HYODEOXYCHOLATE (CAS# 83-49-8); (M-H)-	712190.67	403609.33	464995.33
HYPOTAURINE (CAS# 300-84-5); (M-H)-	-	-	1828.00
INDOLE-3-ACETATE (CAS# 87-51-4); (M-H)-	4759.50	5809.00	4289.00
INOSINE 5^-DIPHOSPHATE (CAS# 86-04-4); (M-H)-	192286.00	109693.50	186409.33
INOSINE (CAS# 58-63-9); (M+CL)-	18211.00	-	24110.00
INOSINE (CAS# 58-63-9); (M-H)-	58656.00	15018.00	24324.00
ISOCITRATE (CAS# 320-77-4); (M-H)-	4870112.67	15233333.33	19400000.00
ISOLEUCINE (CAS# 73-32-5); (M-H)-	433290.00	522347.50	497648.67
ITACONATE (CAS# 97-65-4); (M-H)-	42493.50	62575.67	24041.00
JASMONIC ACID [ISTD] (CAS# 77026-92-7); (2M-H)-	30081.00	93381.33	54568.50
JASMONIC ACID [ISTD] (CAS# 77026-92-7); (M-H)-	2499970.00	4224369.00	3335857.33
KYNURENINE (CAS# 343-65-7); (M-H)-	33982.00	-	-
L-[15N]ANTHRANILIC ACID [ISTD] (CAS# ); (M-H)-	209254.00	313965.33	274189.67
LACTOSE (CAS# 63-42-3); (M+CL)-	79195.00	-	-
LACTOSE (CAS# 63-42-3); (M-H)-	-	5840.00	7796.00
LANTHIONINE (CAS# 3183-08-2); (M-H)-	2620.00	-	9077.00
L-ARGININE (CAS# 74-79-3); (M-H)-	12284.00	12621.00	10024.00
L-ARGININE-(GUANIDINEIMINO-15N2) [ISTD] (CAS# ); (M-H)-	2104.00	2165.00	1935.00
LAURIC ACID (CAS# 143-07-7); (M-H)-	-	4043.00	1886.00
LEUCINE (CAS# 328-39-2); (M-H)-	433290.00	523973.50	496785.00
LEUKOTRIENE B4 (CAS# 71160-24-2); (M-H)-	1677.00	12464.00	56668.50
L-GULONATE (CAS# 6322-07-2); (M+CL)+[-H2O]	-	1665.00	1333.00
L-GULONATE (CAS# 6322-07-2); (M-H)-	310369.67	127930.33	295108.00
L-GULONATE (CAS# 6322-07-2); (M-H)+[-H2O]	16284.00	12817.50	32748.67
L-HISTIDINE (CAS# 71-00-1); (M-H)-	69258.67	52853.00	72828.33
LIGNOCERIC ACID (CAS# 557-59-5); (M-H)-	3403.33	3697.67	3664.67
LINOLEATE (CAS# 60-33-3); (M-H)-	327222.33	406166.00	691295.67
L-METHIONINE SULFOXIMINE (CAS# 15985-39-4); (M-H)-	1201.00	-	-
L-ORNITHINE (CAS# 70-26-8); (M-H)-	44863.50	21393.33	42449.33
L-RHAMNOSE (CAS# 10030-85-0); (M+CL)-	218569.00	-	-
L-RHAMNOSE (CAS# 10030-85-0); (M+HCOO)-	23639.00	2971.00	-
L-TRYPTOPHAN-15N2 [ISTD] (CAS# ); (M-H)-	218368.33	337100.33	247560.67
LYSINE (CAS# 56-87-1); (M-H)-	15901.00	24511.00	20424.00
MALATE (CAS# 97-67-6); (M-H)-	367685.33	477875.33	370128.33
MALEIC ACID (CAS# 110-16-7); (M-H)-	77684.33	44170.67	45217.33
MALONATE (CAS# 141-82-2); (M-H)-	37429.33	18995.50	30410.00
MALONIC ACID-D4 (CAS# 813-56-9); (M-H)-	37429.33	18995.50	30410.00
MALTOSE (CAS# 69-79-4); (M+CL)-	79195.00	-	-
MALTOSE (CAS# 69-79-4); (M+HCOO)-	-	2138.50	-
MANDELIC ACID (CAS# 611-71-2); (M-H)-	2810.67	4161.00	7138.33
MELIBIOSE (CAS# 585-99-9); (M+CL)-	79195.00	-	-
MELIBIOSE (CAS# 585-99-9); (M+HCOO)-	-	2138.50	-
METHIONINE (CAS# 63-68-3); (M-H)-	56315.67	-	-
METHYL BETA-D-GALACTOSIDE (CAS# 1824-94-8); (M+CL)-	-	14874.00	-
METHYL BETA-D-GALACTOSIDE (CAS# 1824-94-8); (M+HCOO)-	2437.00	5648.00	5619.00
METHYLMALONATE (CAS# 516-05-2); (M-H)-	292837.00	197436.33	448555.33
MONO-METHYL GLUTARATE (CAS# 1501-27-5); (M-H)-	48039.33	70718.33	137927.00
MYRISTIC ACID (CAS# 544-63-8); (M-H)-	10055.67	11414.33	12595.00
MYRISTOLEIC ACID (CAS# 544-64-9); (M-H)-	2574.67	3834.67	4207.00
N1-ACETYLSPERMINE (CAS# 77928-70-2); (M+CL)-	1807.00	-	-
N-ACETYL-D-GLUCOSAMINE (CAS# 7512-17-6); (M+CL)-	174090.00	49388.50	53461.00
N-ACETYL-DL-METHIONINE (CAS# 1115-47-5); (M-H)-	15156.00	-	-
N-ACETYL-D-MANNOSAMINE (CAS# 3615-17-6); (M+CL)-	174090.00	49388.50	53461.00
N-ACETYL-D-TRYPTOPHAN (CAS# 2280-01-5); (M-H)-	17593.67	31561.33	22906.33
N-ACETYLGALACTOSAMINE (CAS# 1811-31-0); (M+CL)-	174090.00	49388.50	53461.00
N-ACETYLGLYCINE (CAS# 543-24-8); (M-H)-	9572.00	-	30740.50
N-ACETYL-L-ALANINE (CAS# 97-69-8); (M-H)-	70379.00	-	-
N-ACETYL-L-CYSTEINE (CAS# 616-91-1); (M-H)-	-	17489.00	-
N-ACETYL-L-LEUCINE (CAS# 1188-21-2); (M-H)-	52471.00	96472.33	479280.00
N-ACETYL-L-PHENYLALANINE (CAS# 2018-61-3); (M-H)-	36538.00	47451.00	86712.33
N-ACETYLNEURAMINATE (CAS# 131-48-6); (M-H)-	41228.00	23268.00	15240.33
NAD (CAS# 53-84-9); (M-H)-	-	-	1022.00
NERVONIC ACID (CAS# 506-37-6); (M-H)-	5030.00	5888.67	6379.00
NICOTINAMIDE HYPOXANTHINE DINUCLEOTIDE (CAS# 22052-73-9); (M...	-	1393.00	-
NICOTINATE (CAS# 59-67-6); (M-H)-	9219.50	1492.50	-
N-NITROSODIETHANOLAMINE (CAS# 1116-54-7); (M+CL)-	2320.50	-	8388.00
N-OLEOYLGLYCINE (CAS# 2601-90-3); (2M-H)-	-	1628.00	-
NORLEUCINE (CAS# 327-57-1); (M-H)-	431457.67	420318.50	478401.33
OLEIC ACID (CAS# 112-80-1); (M-H)-	205793.00	432223.33	441677.00
OMEGA-HYDROXYDODECANOIC ACID (CAS# 505-95-3); (M-H)-	-	1454.00	3436.33
OROTATE (CAS# 65-86-1); (M-H)-	13073.50	-	-
OXALOACETATE (CAS# 328-42-7); (M-H)-[-H2O]	13201.00	-	-
OXIDIZED GLUTATHIONE (CAS# 27025-41-8); (M-H)-	9077.67	21724.00	8580.33
PALATINOSE (CAS# 343336-76-5); (M+CL)-	79195.00	-	-
PALATINOSE (CAS# 343336-76-5); (M+HCOO)-	-	2138.50	-
PALMITATE (CAS# 57-10-3); (M-H)-	77539.33	96468.33	141907.67
PALMITOLEIC ACID (CAS# 373-49-9); (M-H)-	49289.00	74659.00	75691.67
PANTOTHENATE (CAS# 79-83-4); (M+CL)-	30322.67	98413.00	60745.67
PANTOTHENATE (CAS# 79-83-4); (M-H)-	583854.33	1048503.67	982934.00
PHENYL ACETATE (CAS# 122-79-2); (M-H)-	-	2631.00	-
PHENYL ACETATE (CAS# 122-79-2); (M+HCOO)-	98450.00	223022.00	125176.67
PHENYLALANINE (CAS# 63-91-2); (M-H)-	1193044.33	1399557.33	1028670.67
PHENYLPYRUVATE (CAS# 156-06-9); (M-H)-	3700.00	5781.67	10747.67
PHOSPHOCREATINE (CAS# 67-07-2); (M-H)-	-	6095.00	-
PHTHALATE (CAS# 88-99-3); (M-H)-	16986.50	4117.50	28547.00
PICOLINIC ACID (CAS# 98-98-6); (M-H)-	9219.50	1640.00	-
PROCOLLAGEN 5-HYDROXY-L-LYSINE (CAS# 1190-94-9); (M-H)-	-	2128.00	-
PROSTAGLANDIN E2 (CAS# 363-24-6); (M-H)-	-	1636.00	-
PURINE (CAS# 120-73-0); (M-H)-	1871479.50	1343250.00	1003893.50
PYRUVATE (CAS# 127-17-3); (M-H)-	34753.00	-	-
RAC-GLYCEROL 1-MYRISTATE (CAS# 75685-84-6); (M+CL)-	16983.00	-	33824.00
RAC-GLYCEROL 1-MYRISTATE (CAS# 75685-84-6); (M+HCOO)-	-	-	2194.00
RAFFINOSE (CAS# 512-69-6); (M+CL)-	4765.50	1947.00	1353.00
RETINOATE (CAS# 302-79-4); (M-H)-	3678.00	3162.00	4060.67
RIBOFLAVIN (CAS# 83-88-5); (M+CL)-	-	2875.33	-
RIBOFLAVIN (CAS# 83-88-5); (M-H)-	-	3529.00	2227.00
RIBOFLAVIN (CAS# 83-88-5); (M+HCOO)-	-	5305.33	3079.00
RIBOSE 5-PHOSPHATE (CAS# 4300-28-1); (M-H)-	-	3808.00	-
RIBOSE (CAS# 50-69-1); (M+CL)-	5763.50	-	3363.50
ROSMARINIC ACID (CAS# 20283-92-5); (M-H)-	-	6111.00	4888.00
(S)-2-AMINO-3-(3-HYDOXY-4-OXO-4H-PYRIDIN-1-YL)PROPANOATE OR ...	-	4850.00	-
(S)-3-METHYL-2-OXOPENTANOATE (CAS# 1460-34-0); (M-H)-	803530.00	1834972.00	1947854.33
S-ADENOSYL-L-HOMOCYSTEINE (CAS# 979-92-0); (M-H)-	23794.33	11714.50	27516.50
SALICYLATE (CAS# 69-72-7); (M-H)-	84034.33	171391.33	285445.00
SALICYLURIC ACID (CAS# 487-54-7); (M-H)-	-	-	5223.00
(S)-DIHYDROOROTATE (CAS# 5988-19-2); (M-H)-	2333.50	-	-
SEBACIC ACID (CAS# 111-20-6); (M-H)-	29684.33	18656.67	20390.00
SERINE (CAS# 56-45-1); (M-H)-	10838.67	9994.00	13004.00
SN-GLYCERO-3-PHOSPHOCHOLINE (CAS# 28319-77-9); (M+HCOO)-	5999.00	-	-
STACHYOSE (CAS# 54261-98-2); (M+CL)-	3432.00	-	-
STEARATE (CAS# 57-11-4); (M-H)-	65574.00	81455.67	126407.33
SUBERIC ACID (CAS# 505-48-6); (M-H)-	61064.50	142988.67	92037.67
SUCCINATE (CAS# 110-15-6); (M-H)-	398506.33	307756.67	448555.33
SUCROSE (CAS# 57-50-1); (M+CL)-	79195.00	-	-
SUCROSE (CAS# 57-50-1); (M+HCOO)-	-	2138.50	-
TAURINE (CAS# 107-35-7); (M-H)-	138573.00	144794.00	152148.00
TEREPHTHALATE (CAS# 100-21-0); (M-H)-	29980.00	-	24215.50
THROMBOXANE B2 (CAS# 54397-85-2); (M-H)-	-	-	15156.50
THROMBOXANE B2 (CAS# 54397-85-2); (M-H)-[-H2O]	-	1636.00	2143.00
THYMIDINE (CAS# 50-89-5); (M+CL)-	345152.00	997279.33	649329.33
THYMIDINE (CAS# 50-89-5); (M-H)-	73747.67	132189.33	103300.00
THYMIDINE (CAS# 50-89-5); (M+HCOO)-	136594.67	243099.00	185262.00
THYMINE (CAS# 65-71-4); (M-H)-	-	-	1485.00
THYROXINE (CAS# 51-48-9); (M-H)-	5640.33	9370.50	8553.00
TRANS-ACONITATE (CAS# 4023-65-8); (M-H)-	1264668.50	2237373.00	2192840.67
TRANS-VACCENIC ACID (CAS# 693-72-1); (M-H)-	205793.00	432223.33	441677.00
TRICARBALLYLIC ACID (CAS# 99-14-9); (M-H)-	61744.00	125804.67	1586807.67
TRICARBALLYLIC ACID (CAS# 99-14-9); (M-H)-[-H2O]	65681.67	85346.00	339636.67
TRICOSANOIC ACID (CAS# 2433-96-7); (M-H)-	-	1045.00	-
TRYPTOPHAN (CAS# 73-22-3); (M-H)-	2108135.67	3234117.67	1945398.50
TYROSINE (CAS# 60-18-4); (M-H)-	668963.67	727268.67	545678.67
URATE (CAS# 69-93-2); (M-H)-	709029.00	551662.00	490860.33
URIDINE-5-MONOPHOSPHATE (CAS# 58-97-9); (M-H)-	-	-	3508.00
URIDINE (CAS# 58-96-8); (M+CL)-	406233.67	429041.67	187790.67
URIDINE (CAS# 58-96-8); (M-H)-	85982.33	225077.50	112167.00
URIDINE (CAS# 58-96-8); (M+HCOO)-	26187.00	71520.00	29542.00
UROCANATE (CAS# 104-98-3); (M-H)-	37474.33	2141.00	8472.00
URSODIOL (CAS# 128-13-2); (M-H)-	108806.50	144722.67	1005088.67
URSODIOL (CAS# 128-13-2); (M+HCOO)-	127155.67	222470.00	328524.67
VALINE (CAS# 72-18-4); (M-H)-	5122.00	13890.00	13493.00
XANTHOSINE (CAS# 146-80-5); (M-H)-	4705.67	15258.00	10344.00
XANTHURENIC ACID (CAS# 59-00-7); (M-H)-	1839.00	1954.00	2642.00
XYLOSE (CAS# 58-86-6); (M+HCOO)-	147638.33	49914.00	74567.33
ZEATIN [ISTD] (CAS# 13114-27-7); (M+CL)-	2043007.33	2694087.67	2540603.33
ZEATIN [ISTD] (CAS# 13114-27-7); (M-H)-	3677754.00	5048389.00	4472928.33

Factors:

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