Data for ST000756   

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

Metabolite structureAll dataF1F2F3F4
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:

F1Days post-STZ:-
F2Days post-STZ:3
F3Days post-STZ:30
F4Days post-STZ:POOLED
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