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Data for ST001040
(Analysis AN001703):
Average values per metabolite and experimental factor (Units:Peak intensity)
Metabolite structure
All data
F1
F2
10-Hydroxydecanoate
-
-
2,3-Dihydroxybenzoate
16099.66
16274.64
2^,4^-Dihydroxyacetophenone
-
-
2-Hydroxy-4-(Methylthio)Butanoate
6020.71
6093.75
2-Hydroxybutyrate
152703.62
146808.44
2-Hydroxyphenylacetate
9761.14
9842.71
2-Methylglutarate
51880.46
29085.42
2-Methylmaleate
174204.60
195525.92
2OH-MBP (Mono(2-hydroxy-isobutyl)phthalate) / 3OH-MBP (Mono-...
3101.29
2989.65
3-(2-Hydroxyphenyl)Propanoate
13559.44
9875.32
3-Hydroxybenzoate
7508.13
4887.65
3-Methoxy-4-Hydroxymandelate
31746.84
28173.48
3-Methoxytyramine
263744.09
260636.84
3-Methyglutarate
18417.97
11459.82
3-Methyl-2-Oxindole
7464.49
6649.89
3-Methyl-2-Oxovalerate
22046.91
22249.77
4-Coumarate
-
-
4-Hydroxybenzoate
12700.47
10282.06
4-Quinolinecarboxylate
6697.24
7519.88
6-Carboxyhexanoate
46101.75
33412.26
Acetyl-L-Leucine
4924.33
3984.98
Adipate
27599.07
17305.64
Anthranilate / 4-Aminobenzoate
2213.77
2174.66
Arachidate
2310.99
2465.15
Azelate
195831.60
157189.16
Benzylamine
195315.77
165236.32
Biotin
-
-
Bisphenol S
4197.10
11093.55
Butyl Paraben
41104.04
22419.43
Caffeate
-
-
Caprylate
9342.15
8116.17
Cholate
178690.45
158653.43
Cis-Resveratrol
-
-
Cortisol
3064.51
3834.48
Cortisone
8844.57
6889.09
cx-MiDP (MCNP) (Mono(2,7-dimethyl-7-carboxyheptyl) phthalate...
1423.55
2838.41
Deoxycholate
-
-
Dihydroxyacetone Phosphate
9320.57
8974.68
Dodecanedioic Acid
12174.88
12930.66
Elaidate / Oleate /Petroselinate
8837.89
11473.96
Erucate
680.43
2217.89
Estriol
143622.58
126381.44
Ethylmalonate
20422.91
15164.45
Ferulate
-
5625.11
Glycochenodeoxycholate
-
-
Glycocholate
12969.26
11121.25
Glycolithocholic Acid
814.12
773.73
Guaiacol
10954.19
9063.12
Hippurate
4896083.24
4264297.32
Homovanillate
5614.24
4985.24
Hydroxyphenyllactate
116726.50
101129.14
Hyodeoxycholic Acid
-
-
Indole-3-Acetate
3350.74
4115.31
Indole-3-Carboxylic Acid
-
-
Indoleacetaldehyde
1264.98
2223.73
Indoxyl Sulfate
2882143.62
2886081.10
Itaconate
215678.51
224518.65
Linoleate
1020.75
2060.36
Lumichrome
-
-
MBzP
8970.64
7620.02
m-Coumaric acid
6787.01
9661.98
MECPP (Mono-2-ethyl-5-carboxypentyl phthalate)
1270.05
2369.92
MEHHP (Mono-2-ethyl-5-hydroxyhexyl phthalate)
-
1997.47
MEHP
2177.55
1689.51
Melatonin
1812.30
2978.99
MEP (Mono-ethyl phthalate)
2968.51
2268.17
Methyl Paraben
-
-
MMP (Mono-methyl phthalate)
-
-
N-Acetylphenylalanine / Indole-3-Ethanol
3477.64
3065.44
N-Formyl-L-Methionine
1722.03
1340.50
Normetanephrine
4622.78
4223.94
OH-MiNP (7-OH-(Mono-methyl-octyl) phthalate / Mono-(4-methyl...
-
-
Oxoadipate
39487.53
33966.73
Palmitate
60866.28
68485.17
Phenylacetate
114832.63
100123.20
Phenylpyruvate
-
-
P-Hydroxyphenylacetate
9732.41
9485.49
Pregnenolone Sulfate
1678.06
2682.57
Riboflavin
12526.13
11204.50
Rosmarinate
1221.86
1075.41
Salicylate / Hydroquinone
10673.01
11110.27
Salsolinol
244664.24
246712.20
Sorbate
7503.93
6630.04
Stearic Acid
82757.26
89092.30
Suberate
71610.98
58522.77
Taurodeoxycholic Acid
12184.50
11783.79
Thiopurine S-Methylether
-
3859.19
Trans-Resveratrol
-
-
Ursodeoxycholic Acid
-
-
Factors:
F1
Sample Type/Matrix:Pooled quality control sample
F2
Sample Type/Matrix:urine
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