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Return to study ST002680 main page
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
1-methylurate
1-Methyluric acid
ME633860
-
-
2.73
183.050276
2-acetylpyrrolidine
2-Acetylpyrrolidine
ME633833
-
-
4.17
114.091376
3-hydroxyphenyl-valerate
3-Hydroxyphenyl valeric acid
ME633865
-
-
9.2
195.102976
3-indolepropionate
3-Indolepropionic acid
ME633863
-
-
6.69
190.085776
5-hydroxy-L-tryptophan
5-Hydroxy-tryptophan
ME633876
-
-
2.31
221.092476
5'-methylthioadenosine
5'-Methylthioadenosine
ME633910
-
-
3.97
298.096976
adipate
Adipic acid
ME633844
-
-
3.63
147.058676
Ala-Leu
Ala-Leu
ME633866
-
-
2.54
203.139776
alpha-tocopherol
alpha-Tocopherol
ME633945
-
-
13.39
431.388076
aminobutyrate
Aminobutyric acid
ME633830
-
-
0.71
104.073276
azelaate
Azelaic acid
ME633861
-
-
6.71
189.111876
benzylbutylphthalate
Benzyl butyl phthalate
ME633918
-
-
10.24
313.148276
bilirubin
Bilirubin
ME633963
-
-
7.93
585.270076
bis(2-ethylhexyl)phthalate
Bis(2-ethylhexyl)phthalate
ME633936
-
-
11.9
391.284676
Car(10:0)
CAR 10:0
ME633921
-
-
7.98
316.248376
Car(10:0-OH)
CAR 10:0;OH
ME633924
-
-
7.2
332.242676
Car(10:1)
CAR 10:1
ME633920
-
-
7.52
314.232076
Car(11:0)
CAR 11:0
ME633922
-
-
8.34
330.263076
Car(12:0)
CAR 12:0
ME633926
-
-
8.85
344.279676
Car(12:1)
CAR 12:1
ME633925
-
-
8.46
342.263676
Car(14:0)
CAR 14:0
ME633934
-
-
9.48
372.311376
Car(14:1)
CAR 14:1
ME633933
-
-
9.18
370.297376
Car(14:2)
CAR 14:2
ME633931
-
-
8.82
368.279576
Car(16:0)
CAR 16:0
ME633941
-
-
9.96
400.342876
Car(16:1)
CAR 16:1
ME633940
-
-
9.67
398.327176
Car(16:2)
CAR 16:2
ME633939
-
-
9.37
396.311376
Car(16:3)
CAR 16:3
ME633938
-
-
9.38
394.295676
Car(18:0)
CAR 18:0
ME633944
-
-
10.33
428.374276
Car(18:1)
CAR 18:1
ME633943
-
-
10.08
426.358476
Car(18:2)
CAR 18:2
ME633942
-
-
9.62
424.344076
Car(2:0)
CAR 2:0
ME633868
-
-
1.1
204.123676
Car(20:0)
CAR 20:0
ME633947
-
-
10.63
456.405076
Car(3:0)
CAR 3:0
ME633872
-
-
2.22
218.139276
Car(3:0, 2-CH3)
CAR 3:0;2Me
ME633881
-
-
3.06
232.154876
Car(4:0)
CAR 4:0
ME633882
-
-
3.14
232.154976
Car(4:0,3-CH3)
CAR 4:0;3Me
ME633888
-
-
3.91
246.170176
Car(4:0-OH)
CAR 4:0;OH
ME633891
-
-
1.86
248.146476
Car(5:0)
CAR 5:0
ME633890
-
-
3.98
246.170276
Car(5:0) isomers
CAR 5:0
ME633889
-
-
3.98
246.170276
Car(5:0-OH)
CAR 5:0;OH
ME633897
-
-
2.56
262.165176
Car(5:1)
CAR 5:1
ME633884
-
-
3.8
244.154176
Car(6:0)
CAR 6:0
ME633894
-
-
5.04
260.185976
Car(8:0)
CAR 8:0
ME633908
-
-
6.76
288.216976
Car(8:0-OH)
CAR 8:0;OH
ME633915
-
-
5.64
304.211476
Car(8:1)
CAR 8:1
ME633907
-
-
5.96
286.200976
Car(9:0)
CAR 9:0
ME633912
-
-
7.14
302.232376
cholesterol
Cholesterol
ME633932
-
-
13.5
369.351976
choline
Choline
ME633831
-
-
0.62
104.107576
citrate
Citric acid
ME633864
-
-
1.22
193.032876
cortisol
Cortisol
ME633929
-
-
7.68
363.216276
creatine
Creatine
ME633839
-
-
0.69
132.081876
cytidine
Cytidine
ME633883
-
-
1.01
244.092176
deoxycholate
Deoxycholic acid
ME633937
-
-
10.62
393.300276
deoxyguanosine
Deoxyguanosine
ME633899
-
-
2.44
268.104476
DG(32:0)
DG 32:0
ME633962
-
-
15.12
569.513776
DG(32:1)
DG 32:1
ME633961
-
-
14.32
567.498176
DG(34:1)
DG 34:1
ME633967
-
-
15.37
595.530776
DG(34:2)
DG 34:2
ME633965
-
-
14.63
593.515476
DG(36:2)DG(18:1_18:1_0:0)
DG 18:1_18:1
ME633969
-
-
15.61
621.545676
DG(36:3)
DG 36:3
ME633968
-
-
14.84
619.530876
diethylphthalate
Diethyl phthalate
ME633877
-
-
8.27
223.096876
dimethylglycine
Dimethylglycine
ME633829
-
-
0.84
104.072676
FA(12:0-NH2)
Aminododecanoic acid
ME633871
-
-
8.05
216.195476
FA(18:1)
Octadecenoic acid
ME633906
-
-
11.62
283.263176
FA(18:2)
Octadecadienoic acid
ME633904
-
-
11.51
281.242076
FA(8:0, 2-NH2)
2-Aminocaprylic acid
ME633849
-
-
5.14
160.135276
gamma-glutamylisoleucine
gamma-Glutamylisoleucine
ME633895
-
-
4.03
261.141676
gamma-glutamylleucine
gamma-Glutamylleucine
ME633896
-
-
4.19
261.144076
gamma-glutamyltyrosine
gamma-Glutamyltyrosine
ME633916
-
-
3.16
311.125476
glucose
Glucose
ME633859
-
-
0.67
181.073076
Glu-Phe
Glu-Phe
ME633909
-
-
4.38
295.128476
glutamine
Glutamine
ME633845
-
-
0.62
147.076576
glycochenodeoxycholate
Glycochenodeoxycholic acid
ME633946
-
-
10.2
450.322676
glycocholate
Glycocholic acid
ME633948
-
-
9.57
466.317176
GMP
GMP
ME633930
-
-
1.28
364.065176
guanine
Guanine
ME633848
-
-
0.97
152.057076
hippurate
Hippuric acid
ME633858
-
-
4.36
180.065376
hypoxanthine
Hypoxanthine
ME633842
-
-
1.29
137.046376
Ile-Ile
Ile-Ile
ME633886
-
-
4.36
245.185276
Ile-Pro
Ile-Pro
ME633879
-
-
2.12
229.154376
Ile-Val
Ile-Val
ME633880
-
-
3.5
231.170176
indoleacetate
Indoleacetic acid
ME633856
-
-
5.95
176.070376
inosine
Inosine
ME633900
-
-
2.48
269.088476
Isoleucine
Isoleucine
ME633840
-
-
1.85
132.101876
kynurenine
Kynurenine
ME633870
-
-
2.78
209.091276
leucine
Leucine
ME633841
-
-
1.97
132.102076
Leu-Ile
Leu-Ile
ME633887
-
-
4.72
245.188476
Leu-Pro
Leu-Pro
ME633878
-
-
2.12
229.154376
lysine
Lysine
ME633846
-
-
0.52
147.112776
mesobilirubinogen
Mesobilirubinogen
ME633964
-
-
7.03
593.331876
methionine
Methionine
ME633847
-
-
1.15
150.056176
MG(14:0_0:0_0:0)
MG 14:0
ME633914
-
-
10.99
303.251176
MG(16:0_0:0_0:0)
MG 16:0
ME633923
-
-
11.38
331.284976
MG(18:1_0:0_0:0)
MG 18:1
ME633928
-
-
11.48
357.300476
monoethylhexyl phthalate
Monoethylhexyl phthalic acid
ME633903
-
-
10.28
279.159176
N2,N2-dimethylguanosine
N2,N2-Dimethylguanosine
ME633917
-
-
3.52
312.142176
N-acetylleucine
N-Acetylleucine
ME633854
-
-
5.35
174.114776
N-acetyllysine
N(2)-Acetyllysine
ME633862
-
-
2.67
189.123576
N-acetylserotonin
N-Acetylserotonin
ME633873
-
-
4.66
219.113876
N-gammaglutamylmethionine
N-gamma-Glutamylmethionine
ME633902
-
-
2.76
279.096776
niacinamide
Niacinamide
ME633837
-
-
1.38
123.055976
N-lauroylglycine
NA-Gly 12:0
ME633893
-
-
9.23
258.208176
N-undecanoylglycine
NA-Gly 11:0
ME633885
-
-
8.45
244.190476
oleamide
Oleamide
ME633905
-
-
11.39
282.278476
pantothenate
Pantothenic acid
ME633875
-
-
3.44
220.118276
PC(14:0)PC(14:0_0:0)
LPC 14:0
ME633949
-
-
10.56
468.308676
PC(15:0)PC(15:0_0:0)
LPC 15:0
ME633951
-
-
10.84
482.323676
PC(16:0)PC(16:0_0:0)
LPC 16:0
ME633954
-
-
11.05
496.340776
PC(16:1)PC(16:1_0:0)
LPC 16:1
ME633953
-
-
10.73
494.324476
PC(17:0)PC(17:0_0:0)
LPC 17:0
ME633955
-
-
11.25
510.356076
PC(18:1)PC(18:1_0:0)
LPC 18:1
ME633957
-
-
11.16
522.356476
PC(18:2)PC(18:2_0:0)
LPC 18:2
ME633956
-
-
10.91
520.340776
PC(20:0)PC(20:0_0:0)
LPC 20:0
ME633960
-
-
11.74
552.402476
PC(20:3)PC(20:3_0:0)
LPC 20:3
ME633959
-
-
11.45
546.354076
PC(20:4)PC(20:4_0:0)
LPC 20:4
ME633958
-
-
10.91
544.340776
PC(28:0)
PC 28:0
ME633971
-
-
12.53
678.504276
PC(30:0)
PC 30:0
ME633973
-
-
12.99
706.537276
PC(32:0)
PC 32:0
ME633979
-
-
13.49
734.571076
PC(32:1)
PC 32:1
ME633978
-
-
13.03
732.555476
PC(32:2)
PC 32:2
ME633976
-
-
12.71
730.539676
PC(33:2)
PC 33:2
ME633980
-
-
12.95
744.553976
PC(34:1)
PC 34:1
ME633984
-
-
13.61
760.586776
PC(34:2)
PC 34:2
ME633983
-
-
13.22
758.571176
PC(34:3)
PC 34:3
ME633982
-
-
12.95
756.555176
PC(34:4)
PC 34:4
ME633981
-
-
12.68
754.539676
PC(35:2)
PC 35:2
ME633986
-
-
13.51
772.586776
PC(35:3)
PC 35:3
ME633985
-
-
13.04
770.565476
PC(36:2)
PC 36:2
ME633990
-
-
13.87
786.602376
PC(36:3)
PC 36:3
ME633989
-
-
13.52
784.586376
PC(36:4)
PC 36:4
ME633988
-
-
13.12
782.570976
PC(38:6)
PC 38:6
ME633992
-
-
13.07
806.571076
PC(40:6)
PC 40:6
ME633996
-
-
13.7
834.602576
PC(40:8)
PC 40:8
ME633995
-
-
13.27
830.567476
PE(18:0)PE(18:0_0:0)
LPE 18:0
ME633952
-
-
11.44
482.324176
PE(18:2)PE(18:2_0:0)
LPE 18:2
ME633950
-
-
10.83
478.293176
phenylalanine
Phenylalanine
ME633851
-
-
2.79
166.086476
Phe-Phe
Phe-Phe
ME633919
-
-
5.53
313.155876
Phe-Trp
Phe-Trp
ME633927
-
-
5.62
352.160176
proline
Proline
ME633834
-
-
0.71
116.075076
Pro-Phe
Pro-Phe
ME633898
-
-
4.59
263.140976
pyridoxamine
Pyridoxamine
ME633853
-
-
0.54
169.094576
pyroglutamate
Pyroglutamic acid
ME633838
-
-
1.22
130.049576
S-allylcysteine
S-Allylcysteine
ME633850
-
-
2.43
162.058676
Ser-Leu
Ser-Leu
ME633874
-
-
3
219.130176
serotonin
Serotonin
ME633857
-
-
2.38
177.101776
SM(d32:1)
SM 32:1;O2
ME633970
-
-
12.43
675.542776
SM(d34:2)
SM 34:2;O2
ME633972
-
-
12.53
701.560076
SM(d35:1)
SM 35:1;O2
ME633974
-
-
13.11
717.589876
SM(d36:1)
SM 36:1;O2
ME633977
-
-
13.4
731.606976
SM(d36:2)
SM 36:2;O2
ME633975
-
-
13
729.590176
SM(d40:1)
SM 40:1;O2
ME633991
-
-
15.09
787.669176
SM(d42:1)
SM 42:1;O2
ME633994
-
-
16.39
815.700676
SM(d42:2)
SM 42:2;O2
ME633993
-
-
15.21
813.685376
sn-glycero-3-phosphocholine
sn-Glycero-3-phosphocholine
ME633892
-
-
0.63
258.110876
spermidine
Spermidine
ME633843
-
-
0.5
146.165176
spermine
Spermine
ME633867
-
-
0.5
203.222876
sphinganine (C16)
C16 Sphinganine
ME633901
-
-
8.51
274.274476
sphinganine (C18)
Sphinganine
ME633913
-
-
9.76
302.305076
sphingosine-1P (C18)
Sphingosine 1-phosphate
ME633935
-
-
10.67
380.255776
sphingosine (C18)
Sphingosine
ME633911
-
-
9.78
300.289676
suberate
Suberic acid
ME633855
-
-
5.85
175.096076
thyroxine
Thyroxine
ME633987
-
-
8.49
777.691776
trans-cyclohexane-1,2-diol
trans-Cyclohexane-1,2-diol
ME633835
-
-
3.78
117.091176
tryptophan
Tryptophan
ME633869
-
-
3.63
205.097376
uracil
Uracil
ME633832
-
-
1.89
113.034276
urate
Uric acid
ME633852
-
-
1.28
169.035676
urobilin
L-Urobilin
ME633966
-
-
7.11
595.348276
valine
Valine
ME633836
-
-
0.78
118.086876
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