Data for ST000725   

(Analysis AN001137): Average values per metabolite and experimental factor (Units:Peak area)

Metabolite structureAll dataF1F2
16:0-18:0 PC (M+H)+
240589.75 218246.29
16:0 LYSO PC (M+H)+
18425000.00 16185714.29
16:0 LYSO PC (M+NA)+
4187758.25 3928465.57
18:0 LYSO-PE (M+H)+
132080.50 124490.86
18:0 LYSO-PE (M+NA)+
30209.50 31825.00
1-METHYLADENOSINE (M+H)+
11652.00 13823.86
1-METHYLXANTHINE (M+H)+
1946130.75 2009057.29
1-METHYLXANTHINE (M+NA)+
27054.25 29046.14
20:0 LYSO PC (M+H)+
93280.50 96114.43
24:0 SM (D18:1/24:0) (M+H)+
445649.25 379539.00
24:0 SM (D18:1/24:0) (M+NA)+
634697.25 494059.14
25-HYDROXYCHOLESTEROL (M+H)+[-H2O]
3596.00 6626.00
2-AMINOETHYL DIHYDROGEN PHOSPHATE (M+H)+
5169.33 5488.67
2-AMINOETHYL DIHYDROGEN PHOSPHATE (M+NA)+
- 6844.25
2-DEOXY-D-GLUCOSE (M+NA)+
17928.00 15778.00
2-HYDROXY-4-(METHYLTHIO)BUTYRIC ACID (M+H)+
48500.00 87048.00
3-AMINO-4-HYDROXYBENZOIC ACID (M+H)+
69714.75 76682.00
3-DEHYDROSHIKIMIC ACID (M+H)+[-H2O]
9919.00 9672.17
3-HYDROXYANTHRANILIC ACID (M+H)+
1630.50 3497.00
3-HYDROXYBENZALDEHYDE (M+H)+[-H2O]
56005.50 71968.14
3-METHOXYTYROSINE (M+H)+
26541.75 27645.20
3-METHYLXANTHINE (M+H)+
18675000.00 19428571.43
4-HYDROXY-3-METHOXYPHENYLGLYCOL (M+H)+[-H2O]
43761.67 45112.50
4-PYRIDOXIC ACID (M+NA)+
5659.00 4338.50
4-QUINOLINECARBOXYLIC ACID #2 (M+H)+
10022.00 14626.71
5-AMINOPENTANOIC ACID (M+H)+
2470853.50 2050484.43
5-HYDROXYTRYPTOPHAN (M+H)+
24334.50 35937.71
5^-METHYLTHIOADENOSINE (M+H)+
10562.50 11216.86
5-OXOPROLINE (M+H)+
211523.25 204286.29
ACETYLCARNITINE (M+H)+
491628.25 378287.86
ADENOSINE 5^-MONOPHOSPHATE (M+H)+
20691.00 21491.25
ADENOSINE (M+H)+
14462.25 20792.14
ADIPIC ACID (M+NA)+
14641.67 14492.50
ALANINE (M+H)+
21574.50 19333.80
ALLANTOIN (M+H)+
8261.50 6604.00
ALPHA-D-GALACTOSE 1-PHOSPHATE (M+NA)+
3170.00 -
ALPHA-TOCOPHEROL (M+H)+
62666.00 63630.43
ASPARAGINE (M+H)+
15304.50 18782.33
ASPARTIC ACID (M+NA)+
19604.00 -
AZELAIC ACID (M+H)+
1890.00 2703.00
AZELAIC ACID (M+H)+[-H2O]
16200.00 22221.57
AZELAIC ACID (M+NA)+
41883.50 60867.86
BETA-ALANYL-N(PAI)-METHYL-L-HISTIDINE (M+H)+
- 2148.00
BETA-ALANYL-N(PAI)-METHYL-L-HISTIDINE (M+NA)+
2133.00 1922.75
BILIVERDIN (M+H)+
104742.75 116745.14
BILIVERDIN (M+NA)+
8393.50 8637.43
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+H)+
90312.50 69778.43
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+NA)+
1105162.75 959434.71
BUTYRYLCARNITINE (*) (M+H)+
99078.50 151560.00
CAFFEINE (M+H)+
27571.25 194797.25
CALCIDIOL (M+H)+[-H2O]
17154.25 19184.29
CALCIDIOL (M+NA)+
3387.00 13075.00
CARNITINE (M+H)+
273294.75 92151.43
CARNOSINE (M+NA)+
20213.50 22902.00
CHOLESTEROL HYDROGEN SULFATE M+[-HSO4]
23862.25 42420.00
CHOLESTEROL (M+H)+[-H2O]
757316.50 715892.29
CHOLINE PHOSPHATE (M+H)+
19396.75 23609.57
CITRIC ACID (M+NA)+
318969.75 286419.86
CORTICOSTERONE (M+H)+
7906.00 7805.00
CORTICOSTERONE (M+NA)+
8497.00 5859.29
CORTISOL (M+H)+
127445.00 120556.86
CORTISOL (M+NA)+
165406.50 158588.43
CORTISONE (M+H)+
37096.75 35477.00
CORTISONE (M+NA)+
33994.25 31717.29
CREATINE (M+H)+
93464.00 66164.75
CREATININE (M+H)+
11475.00 16086.33
CYSTATHIONINE (M+H)+
15720.00 16848.25
CYSTEIC ACID (M+H)+
11460.75 15022.14
CYSTINE (M+NA)+
2526.00 1360.00
CYTIDINE 5^-DIPHOSPHOCHOLINE (M+K)+
4635.67 4772.14
CYTIDINE 5^-DIPHOSPHOCHOLINE (M+NA)+
7217.00 8359.20
CYTOSINE (M+NA)+
4584.00 4036.67
DECENOYLCARNITINE (*) (M+H)+
6782.00 128666.50
DEOXYCHOLIC ACID (2M+NA)+
17732.00 64048.00
DEOXYCHOLIC ACID (M+H)+[-H2O]
21033.00 16723.00
DEOXYCHOLIC ACID (M+NA)+
23078.00 27802.00
DESMOSTEROL (M+H)+[-H2O]
9119.67 7823.00
DIETHYLSTILBESTROL (M+NA)+
- 6453.50
DIPALMITOYL-GLYCEROL (M+NA)+
111145.50 160965.29
DODECENOYLCARNITINE (*) II M+
47716.00 107367.14
DUMP (M+H)+
8142.33 6278.67
EICOSADIENOYLCARNITINE (*) (M+H)+
8526.00 7920.86
EICOSANOYLCARNITINE (*) (M+H)+
7079.50 7866.71
EICOSENOYLCARNITINE (*) (M+H)+
17456.67 12901.00
ELAIDIC ACID (M+H)+
52637.00 55536.50
EPIBRASSINOLIDE [ISTD] (M+H)+
1964587.50 1928569.14
EPIBRASSINOLIDE [ISTD] (M+NA)+
1361555.50 1349308.29
ESTRONE (M+H)+
6294.50 7830.20
GAMMA-LINOLENIC ACID (M+NA)+
34052.00 36957.00
GENTISURIC ACID (M+H)+
3360.00 3022.20
GLUCOSAMINIC ACID (M+NA)+
8483.75 10471.43
GLUCOSE (M+NA)+
72154.67 68679.00
GLUTATHIONE OXIDIZED (M+H)+
1186.00 2044.00
GLUTATHIONE OXIDIZED (M+H2)+2
14726.25 15418.50
GLYCEROL MYRISTATE (M+H)+[-H2O]
2324.50 2975.60
GLYCOCHENODEOXYCHOLIC ACID (M+H)+
24860.50 30936.67
GLYCOCHENODEOXYCHOLIC ACID (M+H)+[-H2O]
368901.75 389144.14
GLYCOCHENODEOXYCHOLIC ACID (M+NA)+
206908.75 217938.43
GLYCOCHOLIC ACID (M+H)+
58073.75 101217.29
GLYCOCHOLIC ACID (M+H)+[-H2O]
22958.25 38475.67
GLYCOCHOLIC ACID (M+NA)+
31466.75 54439.29
GUANINE (M+H)+
39397.25 22838.50
GUANOSINE (M+H)+
5498.00 3942.33
HEXANOYLCARNITINE (*) M+
115346.75 123131.43
HIPPURIC ACID (M+H)+
125994.50 160396.43
HIPPURIC ACID (M+NA)+
159501.00 202410.43
HISTAMINE (M+NA)+
2643.00 1441.00
HOMOGENTISIC ACID (M+H)+
57067.00 49123.80
HOMOSERINE (M+NA)+
1600.00 1541.50
HYODEOXYCHOLIC ACID (M+NA)+
- 10431.50
HYPOXANTHINE (M+H)+
302075.75 195660.57
HYPOXANTHINE (M+NA)+
116220.00 21269.00
INDOLE-3-ACETALDEHYDE (M+H)+
287396.50 452958.14
INDOLE-3-ACETIC ACID (M+H)+
186080.50 174217.29
INDOLE-3-ACETIC ACID (M+NA)+
46416.75 47163.43
INOSINE 5^-PHOSPHATE (M+H)+
10750.75 11647.57
ISO-BUTYRYLCARNITINE (*) (M+H)+
183594.00 308126.71
ISOLEUCINE (M+H)+
24750000.00 23228571.43
ISOLEUCINE (M+NA)+
273806.25 270552.14
ISOVALERYLCARNITINE (*) (M+H)+
196467.75 214573.71
KYNURENIC ACID (M+H)+
20256.25 29328.67
KYNURENINE (M+H)+
474787.25 631786.14
KYNURENINE (M+NA)+
13914.25 17902.86
L-ARGININE (M+H)+
7534.75 6949.00
L-ARGININE (M+NA)+
5999.67 5182.17
LAUROYLCARNITINE (M+H)+
36351.00 37341.29
L-HISTIDINE (M+H)+
3776.00 4005.25
L-HISTIDINOL (M+H)+
1493.00 1609.50
LITHOCHOLIC ACID (M+NA)+
9606.00 8680.00
L-TRYPTOPHAN-15N2 [ISTD] (M+H)+
5111028.25 4997482.86
LYSINE (M+H)+
41985.50 37517.29
LYSINE (M+NA)+
8719.00 7295.00
METHIONINE (M+H)+
2672694.50 2557322.86
METHYL BETA-D-GALACTOSIDE (M+NA)+
127046.50 123915.86
METHYL INDOLE-3-ACETATE (M+H)+
7934.00 12747.00
METHYL JASMONATE (M+NA)+
23556.25 28122.43
M-HYDROXYMANDELIC ACID (M+H)+[-H2O]
1661.00 1352.00
N-ACETYL-DL-METHIONINE (M+H)+
4471.00 1783.00
N-ACETYL-DL-SERINE (M+H)+[-H2O]
167249.25 158344.57
N-ACETYL-D-TRYPTOPHAN (M+H)+
1850.33 3784.00
N-ACETYLGLYCINE (M+NA)+
3160.33 5192.60
N-ACETYL-L-ALANINE (M+NA)+
3937.00 7408.33
N-ACETYL-L-LEUCINE (M+H)+
- 1363.00
N-ACETYL-L-PHENYLALANINE (M+NA)+
1090.00 2783.00
N-ACETYLNEURAMINIC ACID (M+H)+
4706.75 4785.00
N-ACETYLSEROTONIN (M+NA)+
1625.00 2098.00
NAD (M+H)+
4006.00 3615.00
N-CYCLOHEXYLFORMAMIDE (M+H)+
7259.50 6873.71
N-CYCLOHEXYLFORMAMIDE (M+NA)+
4520.33 4445.60
NICOTINAMIDE (M+H)+
73186.50 88664.43
NICOTINAMIDE MONONUCLEOTIDE (M+NA)+
- 1776.00
NONANOIC ACID (M+NA)+
3303.67 3966.40
OCTANOYLCARNITINE (*) (M+H)+
543465.75 538637.86
OCTENOYLCARNITINE (*) M+
212664.00 204774.14
OLEAMIDE (M+H)+
452610.75 438103.57
OLEAMIDE (M+NA)+
355972.33 354227.50
OLEIC ACID (M+H)+
19011.75 17597.50
OLEIC ACID (M+NA)+
139707.25 133883.83
OLEOYLCARNITINE (*) (M+H)+
483050.75 433575.14
OLEOYL-GLYCEROL (M+NA)+
84470.00 85626.57
ORNITHINE (M+H)+
13156.75 11095.57
PANTOTHENIC ACID (M+H)+
32598.25 38193.14
PANTOTHENIC ACID (M+NA)+
19309.67 21179.00
PHENYLALANINE (M+H)+
276972.50 341380.43
PHENYLALANINE (M+NA)+
2754.67 2104.67
PIMELIC ACID (M+NA)+
3841.00 5771.00
PIPECOLIC ACID (M+H)+
298033.00 347024.43
PROCOLLAGEN 5-HYDROXY-L-LYSINE (M+H)+
13582.67 12902.33
PROGESTERONE (M+NA)+
3445.00 -
PROLINE (M+H)+
177095.00 237607.60
PROPIONYLCARNITINE (*) (M+H)+
205673.50 160680.57
PROSTAGLANDIN E2 (M+H)+
24892.50 27622.83
RIBOFLAVIN (M+H)+
3436.00 4681.80
SEBACIC ACID (M+NA)+
6137.50 15405.33
SELENOMETHIONINE (M+H)+
4468.00 6382.60
SEROTONIN (M+H)+
246973.00 415174.33
SEROTONIN (M+NA)+
6973.00 8390.60
SN-GLYCERO-3-PHOSPHOCHOLINE (M+H)+
42112.67 60272.71
SPERMIDINE (M+H)+
25930.50 23204.00
SPERMINE (M+H)+
10885.00 12024.00
SPHINGANINE (M+H)+
- 2318.00
STEAROYLCARNITINE (*) (M+H)+
114281.75 103050.71
SUBERIC ACID (M+H)+[-H2O]
5883.00 8236.00
SUBERIC ACID (M+NA)+
13345.75 18856.57
TAUROCHENODEOXYCHOLIC ACID (M+NA)+
12305.00 17100.00
TAUROLITHOCHOLIC ACID (M+H)+[-H2O]
3781.00 3718.33
TETRADECENOYLCARNITINE (*) M+
36031.50 31508.71
THEOBROMINE (M+H)+
240340.00 318427.57
THEOPHYLLINE (M+H)+
4385.00 59457.00
THEOPHYLLINE (M+NA)+
4391.67 39935.00
THREONINE (M+H)+[-H2O]
52241.00 45897.00
THYROXINE (M+H)+
72678.00 61426.14
TRANS-4-HYDROXYPROLINE (M+H)+
93161.50 105171.67
TRYPTOPHAN (M+H)+
14100000.00 15300000.00
TRYPTOPHAN (M+NA)+
549318.00 579391.57
TYROSINE (M+H)+
6356338.00 6111550.29
TYROSINE (M+NA)+
166952.75 187158.71
URIC ACID (M+H)+
1802060.00 1678019.00
URIC ACID (M+NA)+
62652.50 63101.86
URIDINE (M+H)+
22380.50 23132.29
URIDINE (M+NA)+
38987.00 36391.14
UROCANIC ACID (M+H)+
11308.67 9124.33
URSODIOL (M+NA)+
115804.00 174319.20
VALINE (M+H)+
4198253.50 4068271.29
VALINE (M+NA)+
6115.67 8367.00
XANTHURENIC ACID (M+H)+
- 5155.80
ZEATIN [ISTD] (M+H)+
839710.00 852172.86

Factors:

F1gender:Female
F2gender:Male
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