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Data for ST003362
(Analysis AN005504):
Average values per metabolite and experimental factor (Units:Counts)
Metabolite structure
All data
F1
F2
F3
(10E,12E)-9,14-Dihydroxy-10,12-octadecadienoic acid*,*9,10-D...
724897.02
769426.49
10-Undecenoic acid(None)
510666.38
461960.53
11-Nitro-1-undecene(13C_1)
61571.76
42761.06
11-Nitro-1-undecene(None)
1584080.31
1178018.74
1-[(1Z)-octadec-1-enyl]-sn-glycero-3-phosphoethanolamine(Non...
360046.01
475489.12
1,2-Dipalmitoleoyl-sn-glycero-3-phosphocholine(13C_1)
447494.52
-
1,2-Dipalmitoleoyl-sn-glycero-3-phosphocholine(None)
2725463.00
2846510.97
1-[(3a^R,6^S,6a^S)-4^,4^-Dimethylhexahydro-2^H-spiro[1,3-dio...
500960.31
448899.20
1-[(3a^R,6^S,6a^S)-4^,4^-Dimethylhexahydro-2^H-spiro[1,3-dio...
2574356.00
1621251.96
1,3-Dicyclohexylurea(13C_1)
90155.76
97763.70
1,3-Dicyclohexylurea(None)
3639756.98
3911345.33
13S-hydroxyoctadecadienoic acid(13C_1)
84633.03
193721.25
13S-hydroxyoctadecadienoic acid(13C_11)
238471.84
631350.10
13S-hydroxyoctadecadienoic acid(None)
3051310.99
3070831.47
1,5,7-Trimethyltetralin*,*1-Methyl-4-(1-methyl-2-propenyl)-b...
73990.36
24171.45
1,5,7-Trimethyltetralin*,*1-Methyl-4-(1-methyl-2-propenyl)-b...
681835.37
521905.08
15-Crown-5(None)
1820613.25
1837524.63
1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine(None)
151459.16
477769.26
1-[(9Z)-octadecenoyl]-2-tetradecanoyl-sn-glycero-3-phosphoch...
1704862.27
2230336.21
1-[(9Z)-octadecenoyl]-2-tetradecanoyl-sn-glycero-3-phosphoch...
1682521.06
1452622.43
1-[(9Z)-octadecenoyl]-2-tetradecanoyl-sn-glycero-3-phosphoch...
-
48829.59
1-[(9Z)-octadecenoyl]-2-tetradecanoyl-sn-glycero-3-phosphoch...
205897.08
191284.77
1-[(9Z)-octadecenoyl]-2-tetradecanoyl-sn-glycero-3-phosphoch...
9421690.45
7773781.51
1-Aminocyclopropane-1-carboxylate*,*(Z)-dehydrobutyrine(13C_...
450699.79
418627.94
1-Aminocyclopropane-1-carboxylate*,*(Z)-dehydrobutyrine*,*1-...
4087915.25
5647638.47
1-Aminocyclopropane-1-carboxylate*,*(Z)-dehydrobutyrine(None...
2986877.88
2289421.96
1-arachidonoyl-sn-glycero-3-phosphoethanolamine(None)
101941.31
108558.21
1-Methyl-L-histidine/3-Methyl-L-histidine*,*1-Methyl-L-histi...
744890.41
368792.84
1-oleoyl phosphatidylethanolamine*,*1-Oleoyl-2-hydroxy-sn-gl...
4706.95
8921.47
1-oleoyl phosphatidylethanolamine*,*1-Oleoyl-2-hydroxy-sn-gl...
686806.36
1290087.95
1-Piperideine-2-carboxylate(13C_3)
821430.10
754570.61
1-Piperideine-2-carboxylate(None)
840635.63
1100756.21
1-pyrroline(13C_1)
24745.73
1901148.18
1-pyrroline(13C_2)
583212.48
904166.12
1-pyrroline(13C_3)
63418.67
214160.84
1-pyrroline(13C_4)
12232202.28
17910050.79
1-pyrroline(None)
53629009.49
50871434.43
(1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl 3-oxobutanoate(13C...
534095.49
510681.23
(1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl 3-oxobutanoate(Non...
499966.93
477183.98
1-Stearoyl-2-hydroxy-sn-glycero-3-PE(13C_1)
14363.82
2509.29
1-Stearoyl-2-hydroxy-sn-glycero-3-PE(None)
927695.00
1533702.58
(1Z,5Z)-1,5-Cyclooctadiene(13C_1)
-
18303.63
(1Z,5Z)-1,5-Cyclooctadiene(None)
1256502.30
1044148.20
2,3,4,5,6,7-Hexahydrocyclopent[b]azepin-8(1H)-one*,*Norephed...
280625.73
507982.17
2,6-DIPHENYLPYRIDINE(None)
169184.28
153572.75
2-Aminoacetophenone*,*1MVR(None)
13552996.84
12596479.77
2-Aminoprop-2-enoate(13C_1)
12186.25
-
2-Aminoprop-2-enoate(13C_2)
52624.97
38634.52
2-Aminoprop-2-enoate(13C_3)
751521.49
639208.09
2-Aminoprop-2-enoate(None)
1075037.12
687291.47
2-(Bromomethyl)-1,3-butadiene(13C_1)
277767.65
-
2-(Bromomethyl)-1,3-butadiene(None)
26235936.27
28096037.51
2-(Diethylamino)ethanol(None)
-
1937955.66
(2E,4E,7E)-2,4,7-Decatrienoic acid*,*(2E,6E,8E)-2,6,8-Decatr...
2874299.63
2401685.62
(2E,4Z,7Z)-ethyl 2,4,7-decatrienoate(13C_1)
503002.61
259374.72
(2E,4Z,7Z)-ethyl 2,4,7-decatrienoate(None)
14533535.16
16080261.53
(2E,6E,8E)-2,6,8-Decatrienoic acid(13C_1)
-
194655.73
(2E,6E,8E)-2,6,8-Decatrienoic acid(None)
2781988.10
3299311.35
2-Hexenoylcarnitine(13C_1)
185075.53
481478.55
2-Hexenoylcarnitine(None)
4467346.52
5194938.56
2-Hydroxy-2-methylbutyronitrile(None)
7600880.23
8305566.74
2-Hydroxycinnamic acid(13C_3)
371378.76
366968.86
2-Hydroxycinnamic acid(None)
15584471.47
11807706.46
2-Isopropylmaleate*,*dimethyl itaconate*,*(1S,4S)-4-Hydroxy-...
318129.57
336110.49
2-Isopropylmaleate*,*dimethyl itaconate*,*(1S,4S)-4-Hydroxy-...
19231360.79
20032826.15
2-Methyl-4-pyrimidinamine(13C_1)
1035706.16
1414810.21
2-Methyl-4-pyrimidinamine(None)
20772050.89
27339838.70
2-Methylthiazolidine(13C_1)
339394.43
439454.31
2-Methylthiazolidine(None)
9212012.93
11032462.76
2-Phenylethylamine(None)
24869054.91
24393533.95
(2S,3R,4E,6E)-2-Amino-4,6-tetradecadiene-1,3-diol(13C_1)
-
1470.76
(2S,3R,4E,6E)-2-Amino-4,6-tetradecadiene-1,3-diol(None)
508283.58
507758.31
(2Z,5Z)-11-Methyl-2,5-dodecadienoic acid*,*12-Tridecynoic ac...
8054.75
-
(2Z,5Z)-11-Methyl-2,5-dodecadienoic acid*,*12-Tridecynoic ac...
68758.02
25442.49
(2Z,5Z)-11-Methyl-2,5-dodecadienoic acid*,*12-Tridecynoic ac...
996244.89
1018649.67
3-(1-Methyl-1H-pyrrol-2-yl)pyridine(13C_1)
306044.42
260255.18
3-(1-Methyl-1H-pyrrol-2-yl)pyridine(None)
2785535.93
2676986.76
3-({2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy}methyl)heptanoic aci...
70381.62
105880.82
3-({2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy}methyl)heptanoic aci...
2806921.68
2863633.13
3-{[2-(2-Hydroxyethoxy)ethoxy]methyl}heptanoic acid(13C_1)
-
33819.48
3-{[2-(2-Hydroxyethoxy)ethoxy]methyl}heptanoic acid(None)
894726.27
890323.32
3-[(2,6-Dimethylheptanoyl)oxy]-4-(trimethylammonio)butanoate...
52067.46
17657.54
3-[(2,6-Dimethylheptanoyl)oxy]-4-(trimethylammonio)butanoate...
476351.34
623475.73
3-[(3-Hydroxypentadecanoyl)oxy]-4-(trimethylammonio)butanoat...
28769.64
25966.81
3-[(3-Hydroxypentadecanoyl)oxy]-4-(trimethylammonio)butanoat...
389990.93
303130.35
3,4-dehydrothiomorpholine-3-carboxylic acid(13C_1)
1981151.48
5851914.99
3,4-dehydrothiomorpholine-3-carboxylic acid(None)
111792410.72
92909897.27
3,7-Dimethyl-1,2,3-octanetriol(13C_1)
16688.94
261734.68
3,7-Dimethyl-1,2,3-octanetriol(None)
2289404.22
2779373.25
3-Aminobutanoic acid (BABA)*,*DL-2-Aminobutyric acid(None)
38890.98
-
3-BHA(None)
1063463.01
311634.35
3-Dehydrosphinganine(None)
259234.54
406150.72
3-Hydroxy-3-[(3-methylbutanoyl)oxy]-4-(trimethylammonio)buta...
45376.96
-
3-Hydroxy-3-[(3-methylbutanoyl)oxy]-4-(trimethylammonio)buta...
2024292.49
3087016.70
3-Hydroxyindolin-2-one(None)
7864543.99
7150576.43
3-Hydroxypyridine(None)
1195539.85
1287337.75
3-Indoleacetamide(13C_1)
4119.96
2946.83
3-Indoleacetamide(None)
1549563.47
1499236.32
3-Isopropyl-2,5-piperazinedione(None)
9325921.04
9528570.28
3-Methylsulfolene(None)
47703093.00
58803449.37
3-oxopalmitic acid(None)
67122.21
50925.74
3-Oxotetradecanoic acid(None)
25432.13
23866.17
3-Phospho-D-glyceric acid(None)
928349.59
1063656.66
3-Phospho-hydroxypyruvate(13C_2)
126784.39
81666.55
3-Phospho-hydroxypyruvate(None)
16835216.55
16577043.97
(3S)-3-(Pentanoyloxy)-4-(trimethylammonio)butanoate(None)
5422052.88
7328494.61
3-Thiomorpholinecarboxylic acid(13C_1)
97222.58
1605987.15
3-Thiomorpholinecarboxylic acid(None)
27855942.44
40792786.21
3-Tropanol(13C_1)
9454.79
6222.52
3-Tropanol(None)
8496382.18
2028721.21
4-{(1R,2R)-3-Oxo-2-[(2Z)-2-penten-1-yl]cyclopentyl}butanoic ...
1154190.91
1133733.70
4^,7-dimethoxy-2,2,4-trimethyl-Delta(3)-isoflavan*,*Nafenopi...
-
26919.66
4^,7-dimethoxy-2,2,4-trimethyl-Delta(3)-isoflavan*,*Nafenopi...
232104.64
185450.64
4,7-Dioxooctanoic acid(13C_1)
54790.58
-
4,7-Dioxooctanoic acid(None)
1191639.95
1524901.35
4-Aminobutanoate*,*D,L-alpha-Aminoisobutyric acid(None)
8028909.39
2358785.48
4-Guanidinobutyric acid(None)
3851858.45
4596412.45
4-Isopropyl-3-methyleneoctahydro-2H-cyclohepta[b]furan-2-one...
735541.62
812336.98
4-Methyl-5-thiazoleethanol(None)
1858321.98
1553982.91
(4S)-4-{[(9Z)-3-Hydroxy-9-hexadecenoyl]oxy}-4-(trimethylammo...
29474.02
50899.78
(4S)-4-{[(9Z)-3-Hydroxy-9-hexadecenoyl]oxy}-4-(trimethylammo...
534464.76
383444.66
5-ADP(None)
34830085.73
35263572.67
5-Aminopentanoate*,*L-(+)-Valine(None)
274751082.57
328597577.52
(5E)-7,7-Dimethyl-4-oxa-8-thia-2,5-diazanon-5-en-3-one(None)
3207099.98
3883063.79
5-GDP*,*GDP(13C_1)
97478.08
113661.02
5-GDP*,*GDP(None)
603165.62
979312.90
5-guanidino-3-methyl-2-oxopentanoic acid(13C_3)
129208.63
166955.73
5-guanidino-3-methyl-2-oxopentanoic acid(13C_4)
1259740.92
1531115.65
5-guanidino-3-methyl-2-oxopentanoic acid(13C_5)
43178057.46
55175906.66
5-guanidino-3-methyl-2-oxopentanoic acid(13C_6)
-
583389.35
5-guanidino-3-methyl-2-oxopentanoic acid(None)
2162138.73
2095776.34
5-Isopropyl-3,4-dihydro-2H-pyrrole*,*Heptanonitril(None)
2159292.23
1623061.17
5-Oxo-L-proline(13C_5)
427564.28
847569.02
5-Oxo-L-proline(None)
620206.62
641417.36
5^-S-Methyl-5^-thioadenosine(13C_1)
1962587.57
784288.70
5^-S-Methyl-5^-thioadenosine(None)
12086585.18
13026725.34
(5Z,8Z)-11-Oxo-5,8-undecadienoic acid(13C_1)
2473.41
-
(5Z,8Z)-11-Oxo-5,8-undecadienoic acid(None)
1129706.03
928555.07
6,9-Dioxodecanoic acid(None)
324732.68
417477.95
(6a-Methoxyoctahydro-2H-pentaleno[1,6-bc]furan-4-yl)methanol...
743766.56
720655.59
6-Methylnicotinamide(13C_1)
1362608.47
2487576.89
6-Methylnicotinamide(None)
80912030.36
147490602.57
(6Z,9S,10E,12Z)-9-Hydroxy-6,10,12-hexadecatrienoic acid*,*6-...
1250582.47
1237857.50
(6Z,9S,10E,12Z)-9-Hydroxy-6,10,12-hexadecatrienoic acid*,*6-...
624875.14
380330.53
7-(1-Ethoxyethoxy)-4,10-dimethyl-3,5,9,11-tetraoxatridecane(...
-
237740.16
7-(1-Ethoxyethoxy)-4,10-dimethyl-3,5,9,11-tetraoxatridecane(...
7929025.49
7430846.87
7-Hydroxy-3a-methylhexahydro-1H-indene-1,4(2H)-dione(None)
1138996.24
787685.65
7-Methyl-2,6,9,12-tetraoxahexadecane(13C_1)
339838.61
540743.88
7-Methyl-2,6,9,12-tetraoxahexadecane(None)
7576300.21
7351437.52
7-Methylguanine(13C_1)
76358.39
119748.61
7-Methylguanine(None)
2045836.13
3046793.38
8-Methyl-8-azabicyclo[3.2.1]oct-3-yl acetate(13C_1)
22057.95
178086.71
9,10-DiHODE(13C_11)
136486.78
146827.66
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid(13C_1)
8368.57
65546.42
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid(13C_3)
-
13280.64
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid(13C_6)
256535.80
242375.83
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid(13C_7)
120211.62
1099898.69
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid(None)
2286261.71
2103872.81
(9Z,12Z)-N-Hydroxy-9,12-octadecadienamide(None)
459582.88
482414.67
(9Z)-9-Octadecenamide(None)
670003.26
764823.91
Aceglutamide(13C_2)
48626.95
86104.41
Aceglutamide(13C_3)
451759.32
504665.34
Aceglutamide(13C_4)
66483.08
227135.61
Aceglutamide(13C_5)
3321538.52
6355890.62
Aceglutamide(13C_6)
-
79921.36
Aceglutamide(None)
2775733.96
2854592.97
acetic acid geranyl ester(13C_1)
26844.29
37777.02
acetic acid geranyl ester(None)
652191.41
643804.12
Acetylcarnitine(13C_1)
-
36312.54
Acetylcarnitine(None)
842919.05
757618.64
Acetylcholine(13C_1)
873394.98
4983739.82
Acetylcholine(None)
79313334.06
113104574.54
Acetyl-L-carnitine(13C_1)
8789782.55
2196267.61
Acetyl-L-carnitine(13C_2)
2059364.00
4856721.44
Acetyl-L-carnitine(None)
66564843.08
122908608.77
Acetyl-L-methionine(None)
3032881.53
2835355.84
Adenine(13C_1)
2916644.01
3802063.45
Adenine(None)
51402372.76
67784181.59
Adenophostin B(None)
955569.67
653214.16
Adenosine(None)
279086787.93
321644302.77
ALA-GLU(13C_5)
34345.07
270188.14
ALA-GLU(None)
3524573.86
2823682.94
(+)-Allopumiliotoxin 267A(None)
69976.02
64937.72
Am (2^-O-methyladenosine)*,*m1A (1-Methyladenosine)*,*m6A (1...
223779.62
318188.85
Am (2^-O-methyladenosine)*,*m1A (1-Methyladenosine)*,*m6A (1...
4767894.24
13854230.94
arachidonoyl glycine*,*Arachidonoyl-N,N-dimethyl amide*,*ara...
175046.15
272199.80
arachidonoyl glycine*,*Arachidonoyl-N,N-dimethyl amide*,*ara...
275744.68
365210.23
arachidonoyl glycine*,*Arachidonoyl-N,N-dimethyl amide(None)
461407.17
377981.53
Arginine(13C_1)
18232172.84
21216434.13
Arginine(None)
295786601.50
333022229.90
ascr#3(None)
173272.71
172085.68
Asparagine(None)
874837.46
1315944.01
benalaxyl(None)
34658.08
55992.00
Benzaldehyde(None)
448745.74
360499.04
benzylidenemethylamine*,*Indoline(13C_1)
2503182.49
-
benzylidenemethylamine*,*Indoline(None)
254814820.03
331943235.90
Bethanidine(None)
1077721.71
899059.23
Biphenyl(None)
827090.07
1005824.67
Butenylcarnitine(None)
14640.17
22783.96
Butopyronoxyl(13C_8)
1970834.76
2160282.79
Butopyronoxyl(None)
3906010.39
3239342.74
Caprolactam(13C_2)
934219.14
1108404.60
Caprolactam(None)
909572910.75
1073403831.92
Carnosine(None)
273759.28
338779.32
C (Cytidine)(None)
15225504.75
32768698.52
Chloroquine(13C_1)
86095919.88
70812332.27
Chloroquine(13C_4)
1183811.68
910805.97
Chloroquine(None)
324476521.07
357240769.94
Choline(13C_1)
21365303.12
32110692.99
Choline(13C_2)
-
117637.76
Choline(None)
1811848080.50
3328490832.25
cis-Naphthalene dihydrodiol(13C_1)
48252.93
69990.91
cis-Naphthalene dihydrodiol(None)
1503967.26
1767004.28
CMP*,*5-CMP(13C_1)
38142.33
434509.87
CMP*,*5-CMP(13C_3)
-
19078.21
CMP*,*5-CMP(None)
23402614.29
32436492.20
Creatine(13C_1)
10090495.90
12007204.40
Creatine(None)
229627009.55
270775115.62
Creatinine(13C_1)
757358.83
1115069.48
Creatinine(None)
18728066.66
26393202.79
Crotetamide*,*Cyclo(leucylleucine)(None)
10849767.54
14906269.20
Cystathionine(13C_3)
84234.91
81036.55
Cystathionine(None)
6412879.38
5762811.26
Cysteine(13C_1)
332581.01
278471.13
Cysteine(None)
10492565.66
9313302.99
Cystine(13C_6)
16716.49
-
Cystine(None)
53009.37
31948.79
Cytidine(13C_5)
125912.81
19368.41
Cytidine(None)
6752891.95
17768616.83
Cytosine(13C_1)
187930.79
647009.07
Cytosine(None)
6174027.58
14367700.08
Decanamide(13C_1)
-
255032.26
Decanamide(None)
15165198.70
22534110.36
Deoxyadenosine(13C_1)
1059570.05
943508.36
Deoxyadenosine(13C_3)
605459.84
1015806.73
Deoxyadenosine(None)
14208432.02
12036064.49
D-(+)-Glucose(None)
1192384.58
1727601.86
Diethyl (2-oxopropyl)malonate(13C_1)
18288.00
200157.00
Diethyl (2-oxopropyl)malonate(13C_3)
16839.38
18749.72
Diethyl (2-oxopropyl)malonate(None)
10118726.49
12306542.89
Diethylamine(None)
1315305.21
1357478.85
Diethylene glycol n-butyl ether(13C_1)
-
158975.83
Diethylene glycol n-butyl ether(None)
28115896.77
25426371.07
Diethyl N-acetylglutamate(None)
98010.45
72751.81
Diisodecyl phthalate(13C_3)
81774.74
97930.96
Diisodecyl phthalate(None)
431159.26
373163.33
Dimethyl sulfoxide(13C_1)
130325.78
316982.69
Dimethyl sulfoxide(None)
4895383.92
21585718.62
DL-2-Aminobutyric acid*,*L-alpha-Amino-n-butyric acid*,*DL-2...
379660.01
365625.42
D,L-alpha-Aminoisobutyric acid(None)
178161.49
144020.56
DL-Carnitine(13C_1)
-
4653390.03
DL-Carnitine(None)
237465200.18
269533217.25
D-Sphingosine(None)
176773.93
106254.81
(E,E)-2,4-Heptadienal*,*trans,trans-2,4-Heptadienal(None)
5370040.48
5972068.34
Elaeokanine C(13C_1)
30603.49
48425.41
Elaeokanine C(None)
4997324.67
12047740.44
epi-jasmonic acid(13C_1)
-
284825.89
epi-jasmonic acid(13C_3)
100479.80
22964.00
epi-jasmonic acid(None)
3785931.26
4300358.53
fosfocreatinine(None)
1277991.43
2009232.97
Furaspor(None)
22230.94
26891.67
gamma-Amino-n-butyric acid*,*L-alpha-Amino-n-butyric acid*,*...
4733840.71
6940594.55
Glutamine(13C_4)
1724556.66
2034015.24
Glutamine(13C_5)
57055599.69
72374835.88
Glutamine(None)
2649913.65
2307349.91
Glycerol 5-hydroxydodecanoate(None)
25341.56
68864.16
Glycerophosphocholine(None)
89308710.07
133084514.33
Glycine(13C_1)
76908.15
50617.08
Glycine(None)
9835810.23
8537586.45
Gly-Phe(13C_1)
1213402.52
111399.06
Gly-Phe(None)
7499353.24
8776239.29
Guanine(None)
1800083.94
2523018.77
Guanosine(None)
17613879.90
38137450.73
Guanosine triphosphate(13C_4)
44570.16
104022.99
Guanosine triphosphate(13C_5)
144565.11
249120.90
Guanosine triphosphate(None)
4405745.44
3968072.26
Hexadecanamide(None)
162659.42
167264.06
Hexanoylcarnitine(13C_2)
-
42729.10
Hexanoylcarnitine(None)
475821.81
685090.17
Hexyl (3S)-3-hydroxy-5-methoxypentanoate(None)
90364.15
84158.90
Hypoxanthine(13C_1)
199547.70
996650.74
Hypoxanthine(None)
3885179.81
17779992.57
Hypusine(13C_1)
46892.11
-
Hypusine(None)
618302.64
1940499.09
ieodomycin A(None)
135179.37
459496.21
Indole-3-acetaldehyde(None)
860716.58
1263170.41
indole-3-acetamide(None)
1434510.94
1721831.97
indole-3-propionic acid(13C_1)
108896.77
1011371.57
indole-3-propionic acid(None)
48981472.27
66903547.27
Inosine(13C_2)
569288.58
366678.33
Inosine(None)
1565848.55
8699117.58
Isoleucine(None)
481903908.15
636048988.17
Isopropyl catechol(13C_1)
698263.96
-
Isopropyl catechol(13C_2)
28180.87
14021.02
Isopropyl catechol(None)
38239917.56
10035111.86
Keto-L-rhamnulose(None)
39890.99
61591.88
kynurenine(13C_8)
172001.66
-
kynurenine(None)
3347341.83
3754203.92
L-alpha-Amino-n-butyric acid(None)
98576.66
111753.47
lentiginosine(None)
5209092.04
7789548.41
Leucine(None)
600408839.83
747169545.67
Leu-pro(None)
-
401333.05
Leu-Val(None)
122846.98
623348.50
L-Glutamic acid(13C_1)
1056028.53
1015733.58
L-Glutamic acid(13C_2)
2395203.76
2542574.74
L-Glutamic acid(13C_3)
14362963.12
13362396.27
L-Glutamic acid(13C_4)
3650456.56
5123807.64
L-Glutamic acid(13C_5)
123886994.85
174298062.60
L-Glutamic acid(None)
94762363.98
70870587.95
Linoleamide(None)
658083.98
609010.14
L-Methionine sulfoxide(None)
4367875.99
3019201.70
L-Pipecolic acid(None)
31794320.69
47677307.17
L-Saccharopine(13C_5)
380800.62
774920.06
L-Saccharopine(None)
7471438.09
7532002.36
Luciduline(None)
132318.79
116503.46
Lumichrome(None)
856873.00
942236.74
Lysine(None)
80947020.33
127671368.75
Lysolecithin(13C_1)
100947.43
217658.73
Lysolecithin(13C_2)
-
13614.66
Lysolecithin(None)
5179812.84
12842543.06
Maraniol(13C_1)
34153.75
84237.50
Maraniol(None)
765745.77
866630.00
MDMA(13C_2)
116528.35
-
MDMA(None)
28997726.60
25886126.38
Methionine(13C_1)
30373.68
10081425.38
Methionine(None)
213379835.75
243952410.80
Methyl (11E)-7-oxo-11-tetradecenoate(None)
7534403.25
8477914.36
Methylimidazoleacetic acid(None)
5848670.49
4238732.81
Methyl undec-10-enoate(None)
163824.36
318044.10
Mono(2-ethylhexyl) phthalate (MEHP)(None)
15806796.56
14881152.60
N-(11Z,14Z)-eicosadienoylethanolamine(None)
80024.28
87928.66
N-{4-[(4R)-4-Methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl]p...
1708523.37
1999776.85
N-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)FORMAMIDE(None)
27952895.62
35578442.38
N6-Acetyl-L-lysine(None)
167767.59
-
N6,N6,N6-Trimethyl-L-lysine(None)
8137572.00
15565550.57
N8-Acetylspermidine(13C_2)
230126.73
3318994.06
N8-Acetylspermidine(None)
14273680.17
157755324.76
N-Acetylputrescine(13C_2)
2058347.69
3472455.50
N-Acetylputrescine(None)
36945518.96
41891816.03
N-Boc-L-leucine Methyl Ester(13C_1)
37264.26
93356.95
N-Boc-L-leucine Methyl Ester(None)
5616913.91
6059986.87
Nicotinamide adenine dinucleotide (NAD)(13C_1)
35038.78
84589.42
Nicotinamide adenine dinucleotide (NAD)(None)
3619887.58
4159979.41
Nicotinamide(None)
40333580.46
53051030.44
Nicotinic acid(None)
328501.87
357576.01
NITROSOMORPHOLINE(13C_1)
391598.63
1516211.44
NITROSOMORPHOLINE(None)
21208727.09
25765114.25
N-Methylpyrrolidone(None)
7881567.28
7886811.75
N,N-Dimethylarginine*,*N3,N4-Dimethyl-L-arginine(None)
8512305.52
10811778.90
N-Nonanoylglycine(13C_1)
117595.96
31953.94
N-Nonanoylglycine(None)
6192903.45
9788646.00
N-Oleoyl-L-Serine*,*O-(2-tetradecenoyl)carnitine*,*trans-2-T...
259470.37
222100.50
N-Oleoyl-L-Serine*,*O-(2-tetradecenoyl)carnitine*,*trans-2-T...
2989.36
-
N-Oleoyl-L-Serine*,*O-(2-tetradecenoyl)carnitine*,*trans-2-T...
2011648.99
1661016.00
Nootkatone(13C_11)
14020.98
13182.37
Nootkatone(None)
56067.01
109833.67
N-Propyldodecanamide(None)
119865.20
180626.59
NPYR(None)
7397132.14
11103215.37
N-(tert-Butoxycarbonyl)-L-leucine(13C_2)
10111558.86
28260902.64
N-(tert-Butoxycarbonyl)-L-leucine(13C_3)
51015.67
144766.93
N-(tert-Butoxycarbonyl)-L-leucine(13C_4)
814067.92
3749208.80
N-(tert-Butoxycarbonyl)-L-leucine(None)
50665805.81
80899685.31
N-Undecanoylglycine(13C_1)
2986974.02
8924511.41
N-Undecanoylglycine(None)
52771243.68
116717126.79
nylon cyclic dimer(None)
6749874.71
5818807.63
O-(17-carboxyheptadecanoyl)carnitine(None)
139328.96
126477.47
Oleate(13C_1)
30098.92
19770.18
Oleate(13C_3)
229960.40
141925.10
Oleate(None)
599434.94
501166.47
Ornithine(13C_5)
145328.13
185917.28
Ornithine(None)
1849254.08
1887078.62
Palmitoleate(13C_1)
84739.50
25263.08
Palmitoleate(None)
921388.76
872565.33
Pantothenate(None)
720142107.90
886604932.75
PEG-4(13C_1)
157620.39
153231.13
PEG-4(None)
6219643.27
7952811.31
phe-asn(None)
539592.78
538080.34
Phenylalanine(13C_1)
201571.44
555537.60
Phenylalanine(None)
657261056.25
799512396.08
Platelet-activating factor(13C_1)
-
49448.48
Platelet-activating factor(None)
4805882.78
7858790.60
Proline(13C_2)
-
2912781.75
Proline(13C_3)
20233199.39
24393047.09
Proline(13C_4)
10652623.82
16499663.25
Proline(13C_5)
365312538.27
540137372.95
Proline(None)
1320888439.25
1212186177.10
Propionylcarnitine(13C_3)
1599993.68
1793492.07
Propionylcarnitine(None)
94510189.42
80650844.62
(+)-Prosopinine(13C_1)
-
43334.06
(+)-Prosopinine(13C_18)
109848.17
112063.18
(+)-Prosopinine(13C_8)
513333.86
450297.53
(+)-Prosopinine(None)
195647.70
237487.29
Putrescine(13C_1)
8954289.00
8391009.10
Putrescine(13C_4)
405121.62
393060.00
Putrescine(None)
199963369.38
187305107.65
Pyridoxal(13C_1)
217739.38
-
Pyridoxal(None)
11811035.63
12768543.74
Pyridoxine(None)
138628869.03
173292636.05
Reduced glutathione(13C_1)
-
277990.56
Reduced glutathione(13C_3)
139230.76
219635.88
Reduced glutathione(13C_4)
118007.56
351969.20
Reduced glutathione(13C_5)
7477484.39
14348467.17
Reduced glutathione(None)
31537920.23
20304162.88
Riboflavin(13C_6)
245019.85
194170.84
Riboflavin(None)
371873.56
411562.98
(S)-2-Amino-6-oxohexanoate(None)
199244.54
252871.32
S-Adenosylmethionine(13C_1)
428063.90
288969.49
S-Adenosylmethionine(13C_2)
-
42992.13
S-Adenosylmethionine(None)
5720633.58
7724920.42
senkyunolide B(None)
2341989.46
2924616.40
Serine(None)
15248075.50
17992345.12
S-(Hydroxyphenylacetothiohydroximoyl)-L-cysteine(None)
7766165.21
1309267.10
Spermidine(None)
37976126.18
28676882.77
Spermine(None)
52611241.97
48115941.76
Sphinganine (d17:0)(None)
291507.69
276398.69
syringol(13C_3)
15072.97
6608.58
syringol(None)
246684.96
376941.50
Temozolomide(None)
254446.47
176227.01
Thiamine(None)
33757657.55
31495617.52
trans-Cinnamate(13C_3)
3724057.38
225838.43
trans-Cinnamate(None)
3301099.47
4117001.46
trans-geranic acid(13C_1)
17046.74
-
trans-geranic acid(None)
810503.84
967930.06
Traumatin(13C_1)
396809.63
352681.67
Traumatin(13C_3)
548634.16
610079.97
Traumatin(None)
10578700.04
9669411.34
Tributyl citrate(None)
38753.56
42956.17
(Triethoxymethoxy)ethane*,*Tripropylene glycol(13C_1)
247881.71
92765.00
(Triethoxymethoxy)ethane*,*Tripropylene glycol(None)
4314500.51
4382604.78
Tryptophan(13C_1)
-
616786.27
Tryptophan(None)
92092800.03
110706664.50
Tyrosine(13C_1)
-
1057232.80
Tyrosine(13C_8)
50992.61
69386.13
Tyrosine(None)
102847496.59
76153475.27
UDP-N-acetyl-alpha-D-glucosamine(13C_1)
8763.09
293560.73
UDP-N-acetyl-alpha-D-glucosamine(13C_3)
-
239112.42
UDP-N-acetyl-alpha-D-glucosamine(None)
12410704.97
11290959.74
Urea(None)
1796371.84
1729996.74
Valeraldehyde, 2-methylene-, isopropylhydrazone(13C_1)
26056.03
-
Valeraldehyde, 2-methylene-, isopropylhydrazone(None)
4277784.74
4140960.84
Val-lys(13C_1)
32190.60
173462.75
Val-lys(None)
3534684.61
5319502.54
Valyl-4-hydroxyproline(13C_1)
171013.27
-
Valyl-4-hydroxyproline(13C_10)
850098.58
2033801.56
Valyl-4-hydroxyproline(13C_3)
203239.27
191565.85
Valyl-4-hydroxyproline(13C_5)
7097543.95
7915301.76
Valyl-4-hydroxyproline(None)
11995945.61
11183340.92
Valylproline(13C_1)
275852.00
180698.49
Valylproline(None)
5548200.25
5786775.59
Factors:
F1
Treatment:Control
F2
Treatment:NA
F3
Treatment:Pimozide
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