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Return to study ST002658 main page
Analysis: Reversed phase Negative ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
25-hydroxy-cholesterol
25-Hydroxycholesterol
ME629610
-
-
12.43
385.348876
2-piperidinone
2-Piperidinone
ME629500
-
-
3.05
100.075076
3-hydroxyphenyl-valerate
3-Hydroxyphenyl valeric acid
ME629539
-
-
9.2
195.101576
3-indolepropionate
3-Indolepropionic acid
ME629536
-
-
6.67
190.086076
5'-methylthioadenosine
5'-Methylthioadenosine
ME629583
-
-
3.95
298.097176
adipate
Adipic acid
ME629517
-
-
3.61
147.058676
Ala-Leu
Ala-Leu
ME629541
-
-
2.57
203.139176
alpha-tocopherol
alpha-Tocopherol
ME629620
-
-
13.39
431.387776
aminobutyrate
Aminobutyric acid
ME629501
-
-
0.71
104.072676
azelaate
Azelaic acid
ME629534
-
-
6.58
189.111376
benzylbutylphthalate
Benzyl butyl phthalate
ME629592
-
-
10.23
313.143676
biliverdin
Biliverdin
ME629637
-
-
9.19
583.255976
bis(2-ethylhexyl)phthalate
Bis(2-ethylhexyl)phthalate
ME629611
-
-
11.9
391.284776
caffeine
Caffeine
ME629538
-
-
4.76
195.091276
Car(10:0)
CAR 10:0
ME629595
-
-
7.98
316.248476
Car(10:0-OH)
CAR 10:0;OH
ME629598
-
-
7.19
332.242676
Car(10:1)
CAR 10:1
ME629594
-
-
7.52
314.232276
Car(11:0)
CAR 11:0
ME629596
-
-
8.45
330.263376
Car(12:0)
CAR 12:0
ME629600
-
-
8.85
344.280176
Car(12:1)
CAR 12:1
ME629599
-
-
8.4
342.263576
Car(14:0)
CAR 14:0
ME629608
-
-
9.5
372.311676
Car(14:1)
CAR 14:1
ME629607
-
-
9.19
370.295676
Car(14:2)
CAR 14:2
ME629605
-
-
8.82
368.279776
Car(16:0)
CAR 16:0
ME629616
-
-
9.99
400.342976
Car(16:1)
CAR 16:1
ME629615
-
-
9.69
398.327376
Car(16:2)
CAR 16:2
ME629614
-
-
9.38
396.311576
Car(16:3)
CAR 16:3
ME629613
-
-
9.2
394.295176
Car(18:0)
CAR 18:0
ME629619
-
-
10.36
428.374276
Car(18:1)
CAR 18:1
ME629618
-
-
10.1
426.358676
Car(18:2)
CAR 18:2
ME629617
-
-
9.85
424.343176
Car(2:0)
CAR 2:0
ME629543
-
-
1.09
204.123776
Car(20:0)
CAR 20:0
ME629621
-
-
10.65
456.405376
Car(3:0)
CAR 3:0
ME629546
-
-
2.21
218.139276
Car(3:0, 2-CH3)
CAR 3:0;2Me
ME629553
-
-
3.05
232.154676
Car(4:0)
CAR 4:0
ME629554
-
-
3.12
232.154976
Car(4:0,3-CH3)
CAR 4:0;3Me
ME629563
-
-
3.9
246.170576
Car(4:0-OH)
CAR 4:0;OH
ME629564
-
-
1.84
248.146476
Car(5:0)
CAR 5:0
ME629562
-
-
3.96
246.170376
Car(5:0) isomers
CAR 5:0
ME629561
-
-
3.96
246.170376
Car(5:0-OH)
CAR 5:0;OH
ME629571
-
-
2.43
262.164976
Car(5:1)
CAR 5:1
ME629556
-
-
3.7
244.154276
Car(6:0)
CAR 6:0
ME629568
-
-
5.02
260.186376
Car(8:0)
CAR 8:0
ME629581
-
-
6.75
288.217176
Car(8:0-OH)
CAR 8:0;OH
ME629588
-
-
5.62
304.211776
Car(8:1)
CAR 8:1
ME629580
-
-
6
286.200876
Car(9:0)
CAR 9:0
ME629585
-
-
7.26
302.232076
carnitine
Carnitine
ME629525
-
-
0.64
162.105876
cholesterol
Cholesterol
ME629606
-
-
13.5
369.351776
choline
Choline
ME629503
-
-
0.62
104.107676
citrate
Citric acid
ME629537
-
-
1.25
193.034476
cortisol
Cortisol
ME629603
-
-
7.62
363.215576
creatine
Creatine
ME629509
-
-
0.69
132.077476
cytidine
Cytidine
ME629555
-
-
0.99
244.092376
deoxycholate
Deoxycholic acid
ME629612
-
-
10.61
393.299476
deoxyguanosine
Deoxyguanosine
ME629572
-
-
2.42
268.104476
DG(32:0)
DG 32:0
ME629636
-
-
15.12
569.514276
DG(32:1)
DG 32:1
ME629635
-
-
14.31
567.498876
DG(34:1)
DG 34:1
ME629640
-
-
15.36
595.530776
DG(34:2)
DG 34:2
ME629638
-
-
14.62
593.515376
DG(36:2)DG(18:1_18:1_0:0)
DG 18:1_18:1
ME629642
-
-
15.61
621.546276
DG(36:3)
DG 36:3
ME629641
-
-
14.84
619.530876
diethylphthalate
Diethyl phthalate
ME629549
-
-
8.27
223.098176
dimethylglycine
Dimethylglycine
ME629502
-
-
0.71
104.072776
dUMP
dUMP
ME629589
-
-
1.03
309.049576
FA(12:0-NH2)
Aminododecanoic acid
ME629545
-
-
8.04
216.195276
FA(16:1)
Hexadecenoic acid
ME629565
-
-
11.1
255.231676
FA(18:1)
Octadecenoic acid
ME629579
-
-
11.48
283.265876
FA(18:2)
Octadecadienoic acid
ME629577
-
-
11.51
281.243676
FA(8:0, 2-NH2)
2-Aminocaprylic acid
ME629523
-
-
5.04
160.133376
gamma-glutamylisoleucine
gamma-Glutamylisoleucine
ME629569
-
-
4.02
261.142476
gamma-glutamylleucine
gamma-Glutamylleucine
ME629570
-
-
4.17
261.144876
gamma-glutamyltyrosine
gamma-Glutamyltyrosine
ME629591
-
-
3.14
311.123576
glucose
Glucose
ME629533
-
-
0.61
181.070776
Glu-Phe
Glu-Phe
ME629582
-
-
4.37
295.128776
glutamine
Glutamine
ME629518
-
-
0.62
147.076576
glycocholate
Glycocholic acid
ME629622
-
-
9.56
466.316876
GMP
GMP
ME629604
-
-
1.26
364.065476
guanine
Guanine
ME629522
-
-
0.93
152.057076
hippurate
Hippuric acid
ME629532
-
-
4.35
180.065876
hypoxanthine
Hypoxanthine
ME629514
-
-
1.35
137.046476
Ile-Ile
Ile-Ile
ME629559
-
-
4.63
245.185576
Ile-Pro
Ile-Pro
ME629550
-
-
1.89
229.152176
Ile-Val
Ile-Val
ME629552
-
-
3.49
231.169876
indoleacetate
Indoleacetic acid
ME629530
-
-
5.93
176.070576
inosine
Inosine
ME629573
-
-
2.47
269.089276
Isoleucine
Isoleucine
ME629510
-
-
1.84
132.101876
leucine
Leucine
ME629512
-
-
1.95
132.102176
leucine+ isoleucine
Leucine/Isoleucine
ME629511
-
-
1.84
132.101876
Leu-Ile
Leu-Ile
ME629560
-
-
4.86
245.187776
Leu-Pro
Leu-Pro
ME629551
-
-
2.09
229.154376
lysine
Lysine
ME629519
-
-
0.52
147.112676
methionine
Methionine
ME629521
-
-
1.14
150.055976
MG(14:0_0:0_0:0)
MG 14:0
ME629587
-
-
10.98
303.252276
MG(16:0_0:0_0:0)
MG 16:0
ME629597
-
-
11.38
331.285076
MG(18:1_0:0_0:0)
MG 18:1
ME629602
-
-
11.48
357.300876
monoethylhexyl phthalate
Monoethylhexyl phthalic acid
ME629576
-
-
10.23
279.159076
N-acetylleucine
N-Acetylleucine
ME629528
-
-
5.43
174.112776
N-acetyllysine
N(2)-Acetyllysine
ME629535
-
-
2.38
189.123876
N-acetylneuraminate
N-Acetylneuraminic acid
ME629590
-
-
1.01
310.112676
N-acetylserine
N-Acetylserine
ME629520
-
-
0.93
148.060676
N-gammaglutamylmethionine
N-gamma-Glutamylmethionine
ME629575
-
-
2.84
279.100776
niacinamide
Niacinamide
ME629507
-
-
1.36
123.055976
N-lauroylglycine
NA-Gly 12:0
ME629567
-
-
9.23
258.206476
N-undecanoylglycine
NA-Gly 11:0
ME629557
-
-
8.44
244.190376
oleamide
Oleamide
ME629578
-
-
11.38
282.278476
Ornithine
Ornithine
ME629513
-
-
0.69
133.098276
pantothenate
Pantothenic acid
ME629548
-
-
3.43
220.118576
PC(14:0)PC(14:0_0:0)
LPC 14:0
ME629623
-
-
10.56
468.308876
PC(15:0)PC(15:0_0:0)
LPC 15:0
ME629625
-
-
10.83
482.323776
PC(16:0)PC(16:0_0:0)
LPC 16:0
ME629628
-
-
11.03
496.340876
PC(16:1)PC(16:1_0:0)
LPC 16:1
ME629627
-
-
10.73
494.324776
PC(17:0)PC(17:0_0:0)
LPC 17:0
ME629629
-
-
11.25
510.356376
PC(18:1)PC(18:1_0:0)
LPC 18:1
ME629631
-
-
11.16
522.356576
PC(18:2)PC(18:2_0:0)
LPC 18:2
ME629630
-
-
10.9
520.340676
PC(20:0)PC(20:0_0:0)
LPC 20:0
ME629634
-
-
11.73
552.402776
PC(20:3)PC(20:3_0:0)
LPC 20:3
ME629633
-
-
11.45
546.354376
PC(20:4)PC(20:4_0:0)
LPC 20:4
ME629632
-
-
10.91
544.340876
PC(28:0)
PC 28:0
ME629645
-
-
12.53
678.505376
PC(30:0)
PC 30:0
ME629647
-
-
12.99
706.537676
PC(32:0)
PC 32:0
ME629654
-
-
13.48
734.571076
PC(32:1)
PC 32:1
ME629653
-
-
13.04
732.555376
PC(32:2)
PC 32:2
ME629651
-
-
12.72
730.538776
PC(33:2)
PC 33:2
ME629655
-
-
12.95
744.551676
PC(34:1)
PC 34:1
ME629659
-
-
13.61
760.586676
PC(34:2)
PC 34:2
ME629658
-
-
13.24
758.570976
PC(34:3)
PC 34:3
ME629657
-
-
12.81
756.554176
PC(34:4)
PC 34:4
ME629656
-
-
12.68
754.539076
PC(35:2)
PC 35:2
ME629660
-
-
13.51
772.589576
PC(36:2)
PC 36:2
ME629664
-
-
13.86
786.602276
PC(36:3)
PC 36:3
ME629663
-
-
13.34
784.586576
PC(36:4)
PC 36:4
ME629662
-
-
13.13
782.571176
PC(38:6)
PC 38:6
ME629666
-
-
13.08
806.570976
PC(40:6)
PC 40:6
ME629670
-
-
13.7
834.602276
PC(40:8)
PC 40:8
ME629669
-
-
13.28
830.567176
PE(18:0)PE(18:0_0:0)
LPE 18:0
ME629626
-
-
11.44
482.324376
PE(18:2)PE(18:2_0:0)
LPE 18:2
ME629624
-
-
10.93
478.293476
Phe-Phe
Phe-Phe
ME629593
-
-
5.52
313.154876
Phe-Trp
Phe-Trp
ME629601
-
-
5.45
352.165076
proline
Proline
ME629505
-
-
0.71
116.071876
pyridoxamine
Pyridoxamine
ME629527
-
-
0.55
169.094576
pyroglutamate
Pyroglutamic acid
ME629508
-
-
1.49
130.050076
S-allylcysteine
S-Allylcysteine
ME629524
-
-
2.42
162.058976
sebacate
Sebacic acid
ME629540
-
-
7.68
203.127976
Ser-Leu
Ser-Leu
ME629547
-
-
2.83
219.133876
serotonin
Serotonin
ME629531
-
-
2.36
177.099176
SM(d32:1)
SM 32:1;O2
ME629644
-
-
12.42
675.543276
SM(d32:2)
SM 32:2;O2
ME629643
-
-
12.16
673.524776
SM(d34:2)
SM 34:2;O2
ME629646
-
-
12.53
701.560476
SM(d35:1)
SM 35:1;O2
ME629648
-
-
13.11
717.589776
SM(d36:1)
SM 36:1;O2
ME629652
-
-
13.39
731.606276
SM(d36:2)
SM 36:2;O2
ME629650
-
-
12.99
729.590276
SM(d36:3)
SM 36:3;O2
ME629649
-
-
12.62
727.570276
SM(d40:1)
SM 40:1;O2
ME629665
-
-
15.09
787.667976
SM(d42:1)
SM 42:1;O2
ME629668
-
-
16.38
815.700076
SM(d42:2)
SM 42:2;O2
ME629667
-
-
15.21
813.684876
sn-glycero-3-phosphocholine
sn-Glycero-3-phosphocholine
ME629566
-
-
0.63
258.110876
spermidine
Spermidine
ME629516
-
-
0.49
146.165176
spermine
Spermine
ME629542
-
-
0.47
203.222876
sphinganine (C16)
C16 Sphinganine
ME629574
-
-
8.52
274.274576
sphinganine (C18)
Sphinganine
ME629586
-
-
9.81
302.305176
sphingosine-1P (C18)
Sphingosine 1-phosphate
ME629609
-
-
10.66
380.255976
sphingosine (C18)
Sphingosine
ME629584
-
-
9.67
300.290076
suberate
Suberic acid
ME629529
-
-
5.84
175.097276
thyroxine
Thyroxine
ME629661
-
-
8.46
777.690876
tryptophan
Tryptophan
ME629544
-
-
3.61
205.097376
uracil
Uracil
ME629504
-
-
1.87
113.034576
urate
Uric acid
ME629526
-
-
1.25
169.035876
uridine
Uridine
ME629558
-
-
1.88
245.075776
urobilin
L-Urobilin
ME629639
-
-
7.1
595.343776
urocanate
Urocanic acid
ME629515
-
-
1.35
139.050776
valine
Valine
ME629506
-
-
0.81
118.086776
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