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Data for ST000689
(Analysis AN001064):
Average values per metabolite and experimental factor (Units:Peak area)
Metabolite structure
All data
F1
F2
F3
10-HYDROXYDECANOATE (CAS# 1679-53-4); (M+NA)+
87090.67
45086.33
11-DEOXYCORTISOL (CAS# 152-58-9); (M+NA)+
18905.50
-
1-(5^-PHOSPHORIBOSYL)-5-AMINO-4-IMIDAZOLECARBOXAMIDE (CAS# 3...
23824.67
27864.67
16:0-18:0 PC (CAS# 59403-51-9); (M+H)+
240440.33
176535.67
16:0-18:0 PC (CAS# 59403-51-9); (M+NA)+
5675778.00
5369745.00
16:0 LYSO PC (CAS# 17364-16-8); (M+H)+
49440.67
29959.33
16:0 LYSO PC (CAS# 17364-16-8); (M+NA)+
1241481.67
974571.33
18:0 LYSO-PE (CAS# 69747-55-3); (M+H)+
19976.00
-
1-AMINOCYCLOPROPANE-1-CARBOXYLATE (CAS# 22059-21-8); (M+H)+
149079.67
24607.33
1-METHYLADENOSINE (CAS# 15763-06-1); (M+H)+
-
1428.00
1-OLEOYL-RAC-GLYCEROL (CAS# 111-03-5); (M+H)+[-H2O]
105130.00
81958.00
1-OLEOYL-RAC-GLYCEROL (CAS# 111-03-5); (M+NA)+
187097.00
147904.00
20:0 LYSO PC (CAS# 108341-80-6); (M+H)+
9685.00
1509.00
20:0 LYSO PC (CAS# 108341-80-6); (M+NA)+
21699.00
15412.00
2-AMINO-2-METHYLPROPANOATE (CAS# 62-57-7); (M+H)+
2079.67
5633.00
2^-DEOXYCYTIDINE 5^-MONOPHOSPHATE (CAS# 1032-65-1); (M+H)+
2439.00
3802.33
2-DEOXY-D-GLUCOSE (CAS# 154-17-6); (M+NA)+
1454.00
7877.00
2^-DEOXYGUANOSINE (CAS# 961-07-9); (M+H)+
42702.67
40185.67
2-HYDROXY-3-METHYLBUTYRIC ACID (CAS# 4026-18-0); (M+NA)+
2263.00
3717.00
2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID (CAS# 583-91-5); (M+NA)...
-
1530.00
2-METHYLGLUTARIC ACID (CAS# 18069-17-5); (M+H)+
-
5184.33
2-METHYLGLUTARIC ACID (CAS# 18069-17-5); (M+NA)+
44362.00
28641.00
2-METHYLPROPANAL OXIME (CAS# 151-00-8); (M+H)+[-H2O]
65909.00
58995.00
3-(4-HYDROXYPHENYL)LACTATE (CAS# 6482-98-0); (M+NA)+
38165.67
79281.33
3-AMINOISOBUTANOATE (CAS# 144-90-1); (M+H)+[-H2O]
27768.33
32259.67
3^-CMP (CAS# 63-37-6); (M+H)+
145575.00
126179.33
3-DEHYDROXYCARNITINE (CAS# 407-64-7); (M+H)+
620049.33
550137.00
3-HYDROXY-3-METHYLGLUTARATE (CAS# 503-49-1); (M+H)+
-
8852.00
3-HYDROXY-3-METHYLGLUTARATE (CAS# 503-49-1); (M+H)+[-H2O]
-
11542.33
3-HYDROXY-3-METHYLGLUTARATE (CAS# 503-49-1); (M+NA)+
19034.00
355115.00
3-HYDROXYBENZALDEHYDE (CAS# 100-83-4); (M+H)+[-H2O]
6071.67
7820.33
3-HYDROXYKYNURENINE (CAS# 2147-61-7); (M+H)+
-
1852.00
3-METHOXYTYROSINE (CAS# 4214-13-5); (M+H)+
5463.50
4078.00
3-METHYGLUTARIC ACID (CAS# 626-51-7); (M+NA)+
46180.00
28657.67
3-METHYLADENINE (CAS# 5142-23-4); (M+NA)+
5709.00
7860.00
3-METHYLXANTHINE (CAS# 1076-22-8); (M+H)+
32745.00
-
3-PHOSPHOGLYCERATE (CAS# ); (M+NA)+
-
2297.00
4-ACETAMIDOBUTANOATE (CAS# 3025-96-5); (M+NA)+
49461.00
46797.33
4-AMINOBENZOATE (CAS# 150-13-0); (M+H)+
7146.00
6094.00
4-AMINOBUTANOATE (CAS# 56-12-2); (M+H)+
-
1117.00
4-COUMARATE (CAS# 501-98-4); (M+NA)+
1356.00
-
4-HYDROXY-2-QUINOLINECARBOXYLIC ACID-KRYNURENIC ACID (CAS# 4...
2193.00
3670.00
4-HYDROXY-3-METHOXY-BENZENEMETHANOL (CAS# 498-00-0); (M+H)+[...
8476.00
-
4-HYDROXY-L-PROLINE (CAS# 2584-71-6); (M+H)+
18500.33
20651.33
4-QUINOLINECARBOXYLIC ACID (CAS# 486-74-8); (M+H)+
2314.00
1863.00
5ALPHA-CHOLEST-7-EN-3BETA-OL (CAS# 80-99-9); (M+H)+[-H2O]
257634.33
164866.67
5-AMINOLEVULINATE (CAS# 106-60-5); (M+H)+
20177.67
20463.67
5-AMINOPENTANOATE (CAS# 660-88-8); (M+H)+
314752.33
283752.00
5^-DEOXYADENOSINE (CAS# 4754-39-6); (M+H)+
50883.67
53317.00
5^-METHYLTHIOADENOSINE (CAS# 2457-80-9); (M+H)+
4000156.67
3695002.33
5^-METHYLTHIOADENOSINE (CAS# 2457-80-9); (M+NA)+
37914.67
32602.67
5-OXOPROLINE (CAS# 4042-36-8); (M+H)+
9696128.33
8666934.33
5-OXOPROLINE (CAS# 4042-36-8); (M+NA)+
2174876.00
2092372.67
ABRINE (CAS# 526-31-8); (M+H)+
5148.00
2089.00
ACETYLCHOLINE (CAS# 51-84-3); M+
14919.00
20279.67
ADENINE (CAS# 73-24-5); (M+H)+
264302.33
188537.00
ADENOSINE 5^-DIPHOSPHATE (CAS# 58-64-0); (M+H)+
346469.00
298663.67
ADENOSINE 5^-MONOPHOSPHATE (CAS# 61-19-8); (M+H)+
790575.00
692218.00
ADENOSINE (CAS# 58-61-7); (M+H)+
41054.33
52760.33
ADIPIC ACID (CAS# 124-04-9 ); (M+NA)+
46180.00
28647.33
ADPGLUCOSE (CAS# ); (M+H)+
9271.00
10535.67
ADPGLUCOSE (CAS# ); (M+NA)+
3060.00
3474.33
ADP-RIBOSE (CAS# ); (M+H)+
18279.00
11970.67
ADP-RIBOSE (CAS# ); (M+H)+[-H2O]
257554.67
419409.00
ADP-RIBOSE (CAS# ); (M+NA)+
8247.33
8119.67
ALANINE (CAS# 56-41-7); (2M+H)+[-H2O]
18725.00
35108.33
ALANINE (CAS# 56-41-7); (M+H)+
11558.00
26967.67
ALLANTOIN (CAS# 97-59-6); (M+NA)+
-
1070.00
ALLOSE (CAS# 2595-97-3); (M+H)+[-H2O]
6215.00
9307.33
ALLOSE (CAS# 2595-97-3); (M+NA)+[-H2O]
12319.00
355115.00
ALPHA-D-GALACTOSE 1-PHOSPHATE (CAS# 2255-14-3); (M+NA)+
-
2946.00
ANDROSTERONE (CAS# 53-41-8); (M+NA)+
-
1402.00
ANTHRANILATE (CAS# 118-92-3); (M+H)+
68827.00
-
ASCORBATE (CAS# 50-81-7); (M+H)+[-H2O]
-
1911.00
ASPARTATE (CAS# 56-84-8); (M+H)+
23590.00
64336.67
AZELAIC ACID (CAS# 123-99-9); (M+NA)+
104934.67
67480.33
BETA-ALANINE (CAS# 107-95-9); (M+H)+
139974.33
75789.33
BETAINE (CAS# 107-43-7); (M+H)+
309717.33
253614.33
BETAINE (CAS# 107-43-7); (M+NA)+
4438.00
4918.33
BETA-MALTOSE (CAS# 69-79-4); (M+NA)+
35216.00
20573.33
BILIVERDIN (CAS# 114-25-0); (M+H)+
18450.33
15230.00
BILIVERDIN (CAS# 114-25-0); (M+NA)+
3669.00
2933.00
BIOTIN (CAS# 58-85-5); (2M+NA)+
-
1539.00
BIOTIN (CAS# 58-85-5); (M+H)+
39567.00
74327.33
BIOTIN (CAS# 58-85-5); (M+H)+[-H2O]
6788.00
12555.00
BIOTIN (CAS# 58-85-5); (M+NA)+
57707.00
116206.00
BIS(2-ETHYLHEXYL)PHTHALATE (CAS# 117-81-7); (M+H)+
38622.33
25000.67
BIS(2-ETHYLHEXYL)PHTHALATE (CAS# 117-81-7); (M+NA)+
5931635.00
4338889.67
BIURET (CAS# 108-19-0); (M+NA)+
-
3016.00
BOC-ALA-OH (CAS# 15761-38-3); (M+NA)+
4510.50
6270.50
C12 GALACTOSYL(BETA) CERAMIDE (D18:1/12:0) (CAS# 41613-14-3)...
2028.00
1767.00
CAFFEINE (CAS# 58-08-2); (M+H)+
11548.50
36814.50
CAFFEINE (CAS# 58-08-2); (M+NA)+
3004.00
12269.00
CAPECITABINE (CAS# 154361-50-9); (M+NA)+
-
5287.00
CELLOBIOSE (CAS# 528-50-7); (M+NA)+
35216.00
20983.33
CHOLESTEROL (CAS# 57-88-5); (M+H)+[-H2O]
241058.67
169590.00
CHOLINE (CAS# 62-49-7); M+
121754.33
132533.00
CHOLINE PHOSPHATE (CAS# 107-73-3); (M+H)+
1809107.67
2631185.33
CHOLINE PHOSPHATE (CAS# 107-73-3); (M+NA)+
776980.67
644786.00
CIS-ZEATIN (CAS# 1637-39-4); (M+H)+
23766666.67
22933333.33
CITRAMALATE (CAS# 2306-22-1); (2M+NA)+
-
10172.00
CITRAMALATE (CAS# 2306-22-1); (M+NA)+
3428.00
4897.00
CITRATE (CAS# 77-92-9); (M+H)+[-H2O]
2673.00
1764.00
CITRATE (CAS# 77-92-9); (M+NA)+
485631.00
538336.00
CMP (CAS# 63-37-6); (M+H)+
142358.33
128070.67
CORTICOSTERONE (CAS# 50-22-6); (M+NA)+
3739.33
-
CORTISOL 21-ACETATE (CAS# 50-03-3); (M+H)+
2371.00
-
CORTISONE (CAS# 53-06-5); (M+H)+
125537.00
-
CORTISONE (CAS# 53-06-5); (M+NA)+
1332489.00
25917.00
CREATINE (CAS# 57-00-1); (M+H)+
2935725.67
1790281.67
CREATININE-(GUANIDINO-13C) [ISTD] (CAS# ); (2M+H)+
9157.00
11395.33
CREATININE-(GUANIDINO-13C) [ISTD] (CAS# ); (M+NA)+
12759.00
11481.00
CYTIDINE 5^-DIPHOSPHATE (CAS# 63-38-7); (M+H)+
8854.00
-
CYTIDINE 5^-DIPHOSPHOCHOLINE (CAS# 987-78-0); (M+H)+
6812.67
5246.67
CYTIDINE 5^-DIPHOSPHOCHOLINE (CAS# 987-78-0); (M+K)+
2297.33
2910.67
CYTIDINE 5^-DIPHOSPHOCHOLINE (CAS# 987-78-0); (M+NA)+
3494.33
4412.00
CYTIDINE (CAS# 65-46-3); (M+H)+
-
1867.00
CYTOSINE (CAS# 71-30-7); (M+H)+
41317.67
36412.00
CYTOSINE (CAS# 71-30-7); (M+NA)+
7065.33
16971.50
DAMP (CAS# 653-63-4); (M+H)+
32038.00
-
DECANOATE (CAS# 334-48-5); (2M+NA)+
114985.33
110464.67
DEHYDROASCORBATE (CAS# 490-83-5); (M+H)+
2673.00
1764.00
DEHYDROASCORBATE (CAS# 490-83-5); (M+H)+[-H2O]
361837.00
35731.00
DEOXYADENOSINE (CAS# 16373-93-6); (M+NA)+
7092.00
7532.33
DEOXYCHOLIC ACID (CAS# 83-44-3); (2M+NA)+
1494.00
-
DEOXYCYTIDINE (CAS# 951-77-9); (M+H)+
-
2760.00
DEPHOSPHO-COA (CAS# 3633-59-8); (M+2H)+2
3081.33
1488.00
DEPHOSPHO-COA (CAS# 3633-59-8); (M+H)+
1856.50
-
DETHIOBIOTIN (CAS# 533-48-2); (M+NA)+
4085.33
4516.00
D-GALACTOSAMINE (CAS# 7535-00-4); (2M+NA)+
4578.00
-
D-GALACTOSAMINE (CAS# 7535-00-4); (M+H)+[-H2O]
496479.67
622810.67
DGDP (CAS# 653-63-4); (M+H)+
32038.00
5158.00
D-GLUCOSAMINE 6-SULFATE (CAS# 91674-26-9); (M+H)+
1554.00
3805.00
D-GLUCOSE 6-PHOSPHATE (CAS# 56-73-5); (M+K)+
2154.00
-
D-GLUCOSE 6-PHOSPHATE (CAS# 56-73-5); (M+NA)+
-
2946.00
DGMP (CAS# 902-04-5); (M+H)+
101611.33
78293.00
DIMETHYL MALEATE (CAS# 624-48-6); (M+NA)+
1901.00
-
DI-TERT-BUTYL DICARBONATE (CAS# 24424-99-5); (M+NA)+
4749.00
7233.67
D-MANNOSAMINE (CAS# 14307-02-9); (M+H)+[-H2O]
477906.00
628824.33
D-ORNITHINE (CAS# 348-66-3); (M+H)+[-H2O]
4109.00
1616.00
DOXYLAMINE (CAS# 469-21-6); (M+H)+
-
1270.00
D-PSICOSE (CAS# 551-68-8); (2M+NA)+[-H2O]
38506.67
20283.33
EDTA (CAS# 60-00-4); (M+NA)+
-
1720.00
ELAIDIC ACID (CAS# 112-79-8); (M+NA)+
16951.50
49195.33
ERUCIC ACID (CAS# 112-86-7); (M+NA)+
-
1355.00
ERYTHRITOL (CAS# 149-32-6); (M+NA)+
6742.33
7336.67
ESTRONE (CAS# 53-16-7); (M+H)+
-
1261.00
ETHYLMALONIC ACID (CAS# 601-75-2); (M+NA)+
18846.67
15208.67
FERULATE (CAS# 1135-24-6); (M+H)+
1401.00
4298.00
FLAVIN ADENINE DINUCLEOTIDE (CAS# 146-14-5); (M+H)+
57464.67
57887.00
FLAVIN ADENINE DINUCLEOTIDE (CAS# 146-14-5); (M+NA)+
26844.00
27309.33
FOLIC ACID (CAS# 59-30-3); (M+H)+
2068.00
2892.67
FOLIC ACID (CAS# 59-30-3); (M+NA)+
-
1209.00
FRUCTOSE (CAS# 57-48-7); (M+NA)+
320490.33
253693.67
GAMMA-BUTYROLACTONE (CAS# 96-48-0); (M+H)+
1538.00
2102.50
GAMMA-L-GLUTAMYL-L-CYSTEINE (CAS# 686-58-8); (M+H)+
24958.00
32451.33
GAMMA-L-GLUTAMYL-L-CYSTEINE (CAS# 686-58-8); (M+H)+[-H2O]
694216.67
560367.00
GDPMANNOSE (CAS# ); (M+H)+
17106.00
12701.00
GDPMANNOSE (CAS# ); (M+NA)+
20771.00
20686.00
GIBBERELLIC ACID [ISTD] (CAS# 77-06-5); (2M+NA)+
15841.33
14604.67
GIBBERELLIC ACID [ISTD] (CAS# 77-06-5); (M+NA)+
659428.00
594051.00
GLUCOSE (CAS# 50-99-7); (2M+NA)+
-
3146.00
GLUCOSE (CAS# 50-99-7); (2M+NA)+[-H2O]
38327.33
21074.67
GLUCOSE (CAS# 50-99-7); (M+NA)+
306821.67
363050.00
GLUCURONIC ACID (CAS# 6556-12-3); (M+NA)+
1188.00
-
GLUTAMATE (CAS# 56-86-0); (M+H)+
1359464.33
2105749.33
GLUTAMATE (CAS# 56-86-0); (M+H)+[-H2O]
1483470.67
1273417.67
GLUTAMINE (CAS# 56-85-9); (M+NA)+
124259.33
122456.50
GLUTARATE (CAS# 110-94-1); (M+NA)+
7352.00
4873.33
GLUTATHIONE (CAS# 27025-41-8); (M+H)+
9354605.67
7421846.33
GLUTATHIONE (CAS# 27025-41-8); (M+H2)+2
8675221.67
5764147.67
GLYCERALDEHYDE (CAS# 367-47-5); (2M+H)+[-H2O]
-
8604.33
GLYCERALDEHYDE (CAS# 367-47-5); (2M+NA)+[-H2O]
-
356977.67
GLYCOCHENODEOXYCHOLATE (CAS# 640-79-9); (M+NA)+
1535.00
1330.00
GLYCOLITHOCHOLATE (CAS# 474-74-8 ); (M+NA)+
3513.50
-
GUANINE (CAS# 73-40-5); (M+H)+
34086.67
70223.67
GUANOSINE 5^-DIPHOSPHO-BETA-L-FUCOSE (CAS# 0); (M+H)+
7597.33
10644.00
GUANOSINE 5^-DIPHOSPHO-BETA-L-FUCOSE (CAS# 0); (M+NA)+
2087.33
3215.33
GUANOSINE 5^-PHOSPHATE (CAS# 85-32-5); (M+H)+
39034.33
42543.67
GUANOSINE (CAS# 118-00-3); (M+H)+
1689.00
3227.00
HIPPURATE (CAS# 495-69-2); (M+NA)+
71691.67
126635.00
HOMOSERINE (CAS# 672-15-1); (M+H)+
10391.00
14996.67
HOMOSERINE (CAS# 672-15-1); (M+NA)+
-
3444.00
HYPOXANTHINE (CAS# 68-94-0); (M+H)+
27204.00
29945.00
HYPOXANTHINE (CAS# 68-94-0); (M+NA)+
-
1911.00
IBUPROFEN CARBOXYLIC ACID (CAS# 15935-54-3); (M+H)+[-H2O]
-
2364.00
INDOLE-3-ACETALDEHYDE (CAS# 2591-98-2); (M+H)+
145255.67
162187.00
INDOLE (CAS# 120-72-9); (2M+NA)+
-
4535.00
INOSINE 5^-PHOSPHATE (CAS# 131-99-7); (M+H)+
4791.00
2736.00
INOSINE (CAS# 58-63-9); (M+H)+
3006.00
3649.33
ISOLEUCINE (CAS# 73-32-5); (M+H)+
11166666.67
10766666.67
ISOLEUCINE (CAS# 73-32-5); (M+NA)+
90151.00
84353.33
JASMONIC ACID [ISTD] (CAS# 77026-92-7); (M+H)+
1377999.67
1452084.67
JASMONIC ACID [ISTD] (CAS# 77026-92-7); (M+NA)+
5937085.00
5722901.33
KYNURENINE (CAS# 343-65-7); (M+H)+
76755.00
70689.33
KYNURENINE (CAS# 343-65-7); (M+NA)+
1605.00
-
L-[15N]ANTHRANILIC ACID [ISTD] (CAS# ); (M+H)+
3218619.33
3335051.00
LACTOSE (CAS# 63-42-3); (M+K)+
29343.67
15043.33
LACTOSE (CAS# 63-42-3); (M+NA)+
34734.67
20116.00
L-ALLOTHREONINE (CAS# 28954-12-3); (M+H)+
9697.33
11922.33
L-ALLOTHREONINE (CAS# 28954-12-3); (M+H)+[-H2O]
162543.33
159862.33
LANOSTEROL (CAS# 79-63-0); (M+NA)+
2583.00
2247.00
LANTHIONINE (CAS# 3183-08-2); (M+H)+
5931.67
4615.50
L-ARGININE (CAS# 74-79-3); (M+NA)+
7137.33
7076.50
LAUROYLCARNITINE (CAS# 25518-54-1); (M+H)+
1040.00
1685.00
L-CARNITINE (CAS# 541-15-1); (M+H)+
688248.00
680971.00
LEUCINE (CAS# 328-39-2); (M+H)+
14500000.00
14833333.33
LEUCINE (CAS# 328-39-2); (M+NA)+
102780.67
85555.00
LEUKOTRIENE B4 (CAS# 71160-24-2); (M+H)+
8896.00
9300.00
LEUKOTRIENE B4 (CAS# 71160-24-2); (M+NA)+
2609.00
3811.00
L-HISTIDINE (CAS# 71-00-1); (M+H)+
2030.00
4396.00
L-HISTIDINOL (CAS# 4836-52-6); (M+NA)+
7112.00
8598.00
LITHOCHOLIC ACID (CAS# 434-13-9); (M+NA)+
5559.00
25668.00
L-TRYPTOPHAN-15N2 [ISTD] (CAS# ); (M+H)+
3592815.33
3750793.00
LUMICHROME (CAS# 1086-80-2); (M+NA)+
24000.00
24230.00
LYSINE (CAS# 56-87-1); (M+H)+
4575.00
5382.67
MALATE (CAS# 636-61-3); (M+NA)+
408194.00
436710.00
MALEAMATE (CAS# 557-24-4); (M+H)+
4576.67
5158.33
MALTOSE (CAS# 69-79-4); (M+NA)+
39230.33
20573.33
MANNOSE-6-PHOSPHATE (CAS# 3672-15-9); (M+NA)+
-
2946.00
MELATONIN (CAS# 73-31-4); (M+NA)+
2793.00
2505.00
MELIBIOSE (CAS# 585-99-9); (M+K)+
29655.67
15043.33
MELIBIOSE (CAS# 585-99-9); (M+NA)+
35048.00
20611.67
METHIONINE (CAS# 63-68-3); (M+H)+
908885.00
1246216.67
METHYL BETA-D-GALACTOSIDE (CAS# 1824-94-8); (M+NA)+
2702.00
-
METHYL JASMONATE (CAS# 1211-29-6); (M+NA)+
133680.00
159291.00
METHYLMALONATE (CAS# 516-05-2); (M+NA)+
27951.67
26861.33
MEVALONIC ACID (CAS# 674-26-0); (M+NA)+
6575.67
4086.00
MONO-METHYL GLUTARATE (CAS# 1501-27-5); (M+NA)+
46180.00
28647.33
MYO-INOSITOL (CAS# 87-89-8); (M+NA)+
298354.00
359849.00
N1-ACETYLSPERMINE (CAS# 77928-70-2); (M+H)+
34163.33
50211.00
N-ACETYL-D-GLUCOSAMINE (CAS# 7512-17-6); (2M+NA)+
-
1588.00
N-ACETYL-D-GLUCOSAMINE (CAS# 7512-17-6); (M+H)+[-H2O]
94627.00
84968.33
N-ACETYL-DL-GLUTAMIC ACID (CAS# 5817-08-3); (M+H)+
163135.33
193978.00
N-ACETYL-DL-GLUTAMIC ACID (CAS# 5817-08-3); (M+H)+[-H2O]
59371.00
68779.33
N-ACETYL-DL-GLUTAMIC ACID (CAS# 5817-08-3); (M+NA)+
347490.00
466890.67
N-ACETYL-DL-METHIONINE (CAS# 1115-47-5); (M+H)+
235913.67
419249.33
N-ACETYL-DL-METHIONINE (CAS# 1115-47-5); (M+H)+[-H2O]
81015.00
133071.33
N-ACETYL-DL-METHIONINE (CAS# 1115-47-5); (M+NA)+
1454824.33
2470918.67
N-ACETYL-DL-SERINE (CAS# 97-14-3); (M+H)+
674291.67
825118.67
N-ACETYL-DL-SERINE (CAS# 97-14-3); (M+H)+[-H2O]
1066395.67
951777.00
N-ACETYL-DL-SERINE (CAS# 97-14-3); (M+NA)+
269229.00
534768.00
N-ACETYLGALACTOSAMINE (CAS# 1811-31-0); (M+H)+[-H2O]
96740.67
84297.00
N-ACETYL-L-ALANINE (CAS# 97-69-8); (M+H)+
-
44363.00
N-ACETYL-L-ALANINE (CAS# 97-69-8); (M+H)+[-H2O]
4223.00
-
N-ACETYL-L-ALANINE (CAS# 97-69-8); (M+NA)+
118013.00
133855.67
N-ACETYL-L-ASPARTIC ACID (CAS# 997-55-7); (M+H)+
49744.00
77707.33
N-ACETYL-L-ASPARTIC ACID (CAS# 997-55-7); (M+H)+[-H2O]
34805.00
58343.67
N-ACETYL-L-ASPARTIC ACID (CAS# 997-55-7); (M+NA)+
69312.33
143832.67
N-ACETYL-L-CYSTEINE (CAS# 616-91-1); (M+H)+
2170.00
-
N-ACETYL-L-LEUCINE (CAS# 1188-21-2); (M+H)+
1392.00
1559.00
N-ACETYL-L-LEUCINE (CAS# 1188-21-2); (M+NA)+
7523.50
9250.67
N-ACETYL-L-PHENYLALANINE (CAS# 2018-61-3); (M+NA)+
2376.00
4950.67
N-ACETYLNEURAMINATE (CAS# 131-48-6); (M+H)+
25258.33
26419.33
N-ACETYLNEURAMINATE (CAS# 131-48-6); (M+NA)+
59307.00
64910.67
NAD (CAS# 53-84-9); (M+2H)+2
987536.00
1548148.00
NAD (CAS# 53-84-9); (M+H)+
4185076.67
5098929.67
NAD (CAS# 53-84-9); (M+NA)+
152719.33
239359.00
N-ALPHA-ACETYL-L-ASPARAGINE (CAS# 4033-40-3); (M+H)+
2290.00
-
N-ALPHA-ACETYL-L-ASPARAGINE (CAS# 4033-40-3); (M+NA)+
2665.00
-
N-ALPHA-ACETYL-L-LYSINE (CAS# 1946-82-3); (M+H)+
9781.00
11414.50
N-CYCLOHEXYLFORMAMIDE (CAS# 766-93-8); (M+H)+
7325.67
6588.00
N-CYCLOHEXYLFORMAMIDE (CAS# 766-93-8); (M+NA)+
32150.33
23389.50
NICOTINAMIDE (CAS# 98-92-0); (M+H)+
1242787.33
1246249.33
NICOTINAMIDE MONONUCLEOTIDE (CAS# 1094-61-7); (M+H)+
-
3576.67
NICOTINAMIDE MONONUCLEOTIDE (CAS# 1094-61-7); (M+NA)+
1676.50
-
NICOTINE (CAS# 54-11-5); (M+H)+
16252.00
-
NICOTINIC ACID ADENINE DINUCLEOTIDE PHOSPHATE (CAS# 5502-96-...
-
1124.00
N-METHYL-D-ASPARTIC ACID (CAS# 6384-92-5); (M+H)+
1161752.00
2108856.00
N-METHYL-D-ASPARTIC ACID (CAS# 6384-92-5); (M+NA)+
302342.00
320161.67
N-METHYL-L-GLUTAMATE (CAS# 6753-62-4); (M+H)+[-H2O]
20608.33
18379.00
N-METHYLNICOTINATE (CAS# 535-83-1); (M+H)+
26908.33
46372.67
NORLEUCINE (CAS# 327-57-1); (M+H)+
14466666.67
14900000.00
NORMETANEPHRINE (CAS# 0); (M+H)+[-H2O]
13033333.33
12700000.00
NORVALINE (CAS# 6600-40-4); M+[-CO2H]
1374792.33
1361733.00
NORVALINE (CAS# 6600-40-4); (M+H)+
1750572.33
1713017.33
O-ACETYLCARNITINE (CAS# 461-77-8); (M+H)+
5806841.67
7220244.00
OLEAMIDE (CAS# 301-02-0); (M+H)+
-
7184.00
OLEIC ACID (CAS# 112-80-1); (M+H)+
4420.00
-
OLEIC ACID (CAS# 112-80-1); (M+NA)+
1131790.33
879706.67
O-PHOSPHO-DL-SERINE (CAS# 17885-08-4); (2M+NA)+
6674.00
9137.00
O-PHOSPHO-DL-SERINE (CAS# 17885-08-4); (M+H)+
23264.00
38177.33
O-PHOSPHO-DL-SERINE (CAS# 17885-08-4); (M+NA)+
34113.00
73900.67
O-PHOSPHOSERINE (CAS# 407-41-0); (M+H)+
24325.67
38031.67
O-PHOSPHOSERINE (CAS# 407-41-0); (M+NA)+
34023.33
35861.00
OPHTHALMIC ACID (CAS# 495-27-2); (M+H)+
363424.67
838475.00
OXIDIZED GLUTATHIONE (CAS# 27025-41-8); (M+2H)+2
8705823.67
5906925.00
OXIDIZED GLUTATHIONE (CAS# 27025-41-8); (M+H)+
9307230.00
7474026.00
PALATINOSE (CAS# 343336-76-5); (M+NA)+
37939.67
20245.00
PALMITOYLCARNITINE (CAS# 2364-67-2); (M+H)+
1634.50
3768.00
PALMITOYLCARNITINE (CAS# 2364-67-2); (M+NA)+
1296.00
2150.00
PANTOLACTONE (CAS# 599-04-2); (M+H)+[-H2O]
-
2059.67
PANTOTHENATE (CAS# 79-83-4); (M+H)+
4478013.67
6815139.33
PANTOTHENATE (CAS# 79-83-4); (M+NA)+
4231914.67
5540041.67
PARAXANTHINE (CAS# 611-59-6); (M+NA)+
13595.67
15175.00
PHENYL ACETATE (CAS# 122-79-2); (M+H)+
8688.00
-
PHENYLACETIC ACID (CAS# 103-82-2); (M+H)+
8476.00
-
PHENYLALANINE (CAS# 63-91-2); (M+H)+
13033333.33
12700000.00
PHENYLALANINE (CAS# 63-91-2); (M+NA)+
159155.00
147599.67
PHOSPHOCREATINE (CAS# 67-07-2); (M+H)+
95193.00
69902.00
PHTHALATE (CAS# 88-99-3); (M+NA)+
6524.67
4848.33
PINITOL (CAS# 10284-63-6); (M+NA)+
2702.00
-
PIPECOLATE (CAS# 535-75-1); (M+NA)+
143770.00
190524.00
PROLINE (CAS# 147-85-3); (M+H)+
5294512.33
4448391.00
PROLINE (CAS# 147-85-3); (M+NA)+
185099.33
170277.33
PROSTAGLANDIN E2 (CAS# 363-24-6); (M+H)+[-H2O]
2716.00
3886.33
PROTOPORPHYRIN (CAS# 553-12-8); (M+H)+
16910.00
8270.33
PURINE (CAS# 120-73-0); (M+NA)+
4076.00
-
PYRIDOXAL (CAS# 66-72-8); (M+H)+
41622.67
51138.67
PYRIDOXAL PHOSPHATE (CAS# 853645-22-4); (M+H)+
55156.00
43452.67
PYRIDOXINE (CAS# 65-23-6); (M+H)+
1341248.00
1441695.67
PYRROLE-2-CARBOXYLIC ACID (CAS# 634-97-9); (M+H)+
1455.00
3100.00
RAC-GLYCEROL 1-MYRISTATE (CAS# 75685-84-6); (M+NA)+
100531.67
119779.00
RAFFINOSE (CAS# 512-69-6); (M+K)+
3446.33
2495.67
RAFFINOSE (CAS# 512-69-6); (M+NA)+
4858.00
2182.50
RETINOATE (CAS# 302-79-4); (M+H)+
-
1110.00
RIBITOL (CAS# 488-81-3); (M+NA)+
7547.33
8630.67
RIBOFLAVIN (CAS# 83-88-5); (M+H)+
18700.33
27790.00
RIBOFLAVIN (CAS# 83-88-5); (M+NA)+
24960.67
40257.67
S-ADENOSYL-L-HOMOCYSTEINE (CAS# 979-92-0); (M+H)+
216885.67
190331.00
S-ADENOSYLMETHIONINE (CAS# 29908-03-0); (M+H)+
723535.00
546113.00
SALICYLAMIDE (CAS# 65-45-2); (M+H)+
68827.00
-
(-)-SALSOLINOL (CAS# 27740-96-1); (M+H)+
9738.00
10007.67
SARCOSINE (CAS# 107-97-1); (M+H)+
141784.67
65283.67
(S)-DIHYDROOROTATE (CAS# 5988-19-2); (M+H)+
15987.67
9086.67
SEBACIC ACID (CAS# 111-20-6); (M+NA)+
4675.00
-
SELENOCYSTAMINE (CAS# 2697-61-2); (M+H)+
-
7733.00
SERINE (CAS# 56-45-1); (M+H)+
43356.67
74532.67
SN-GLYCERO-3-PHOSPHOCHOLINE (CAS# 28319-77-9); (M+H)+
2398640.67
2702717.33
SORBIC ACID (CAS# 110-44-1); (M+H)+
-
2306.00
SPERMIDINE (CAS# 124-20-9); (M+H)+
695399.00
852800.67
SPERMIDINE (CAS# 124-20-9); (M+NA)+
2877.33
3570.67
SPERMINE (CAS# 71-44-3); (M+H)+
15156.00
12066.67
SPHINGANINE (CAS# 764-22-7); (M+H)+
13774.00
10553.00
SPHINGANINE (CAS# 764-22-7); (M+NA)+
32362.00
21467.50
SPHINGOSINE (CAS# 123-78-4); (M+H)+
3185.33
2394.00
STACHYOSE (CAS# 54261-98-2); (M+K)+
1646.00
-
STACHYOSE (CAS# 54261-98-2); (M+NA)+
4446.00
3241.00
SUBERIC ACID (CAS# 505-48-6); (M+H)+[-H2O]
3709.00
-
SUBERIC ACID (CAS# 505-48-6); (M+NA)+
44729.33
32700.00
SUCROSE (CAS# 57-50-1); (M+NA)+
38712.67
20611.67
TAURINE (CAS# 107-35-7); (M+H)+
75802.50
50990.50
TAURINE (CAS# 107-35-7); (M+K)+
7411.00
3577.00
TAURINE (CAS# 107-35-7); (M+NA)+
67782.33
87211.67
TAUROCHOLATE (CAS# 81-24-3); (M+NA)+
1349.00
-
TAUROLITHOCHOLATE (CAS# 516-90-5); (M+H)+[-H2O]
6197.00
1766.00
TAUROLITHOCHOLATE (CAS# 516-90-5); (M+NA)+
3294.67
-
THEOBROMINE (CAS# 83-67-0); (M+H)+
2655.00
-
THEOBROMINE (CAS# 83-67-0); (M+NA)+
15223.00
14704.00
THEOPHYLLINE (CAS# 58-55-9); (M+NA)+
12284.67
10537.33
THIAMIN (CAS# 59-43-8); M+
348698.67
435252.00
THIAMIN (CAS# 59-43-8); M+[-C6H9NOS]
75067.33
99467.33
THREONINE (CAS# 72-19-5); (M+H)+[-H2O]
159051.33
93938.00
THYMIDINE 5^-MONOPHOSPHATE (CAS# 365-07-1); (2M+NA)+
66269.50
20609.00
THYMIDINE 5^-MONOPHOSPHATE (CAS# 365-07-1); (M+NA)+
2507.00
2534.00
TRANS-4-HYDROXYPROLINE (CAS# 51-35-4); (M+H)+
17450.33
18791.67
TRIMETHYLAMINE (CAS# 75-50-3); (M+H)+
-
19540.00
TRYPTOPHAN (CAS# 73-22-3); (M+H)+
2332557.67
2364570.67
TRYPTOPHAN (CAS# 73-22-3); (M+NA)+
117943.33
105597.50
TYROSINE (CAS# 60-18-4); (M+H)+
5055252.00
5214019.67
TYROSINE (CAS# 60-18-4); (M+NA)+
12572.67
13962.33
UDP-N-ACETYL-D-GALACTOSAMINE (CAS# ); (M+H)+[-H2O]
-
9200.00
UDP-N-ACETYL-D-GALACTOSAMINE (CAS# ); (M+NA)+
301403.00
328995.00
UDP-N-ACETYL-D-GLUCOSAMINE (CAS# 528-04-1); (M+H)+
9616.00
13690.33
UDP-N-ACETYL-D-GLUCOSAMINE (CAS# 528-04-1); (M+NA)+
9496.00
9195.00
URACIL 5-CARBOXYLATE (CAS# 23945-44-0); (M+H)+
7328.00
8122.00
URATE (CAS# 69-93-2); (M+H)+
18119.50
29371.67
URIDINE-5-MONOPHOSPHATE (CAS# 58-97-9); (M+H)+
11660.67
4518.67
URIDINE (CAS# 58-96-8); (M+H)+
2592.50
-
URIDINE (CAS# 58-96-8); (M+NA)+
2300.00
2846.00
UROCANATE (CAS# 104-98-3); (M+H)+
38660.00
20337.67
VALINE (CAS# 72-18-4); (M+H)+
1729633.00
1727122.00
VALINE (CAS# 72-18-4); (M+NA)+
8597.50
18988.50
XANTHINE (CAS# 69-89-6); (M+H)+
158086.33
155806.33
XANTHOSINE (CAS# 146-80-5); (M+H)+
5702.00
5917.00
XYLOSE (CAS# 58-86-6); (2M+NA)+[-H2O]
4451.00
5794.00
ZEATIN [ISTD] (CAS# 13114-27-7); (M+H)+
23633333.33
23066666.67
Factors:
F1
Construct:-
F2
Construct:Control lentivirus
F3
Construct:Noxa knockdown
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