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Return to study ST001114 main page
Analysis: Other POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
1,5-Anhydrosorbitol
1,5-Anhydrosorbitol
ME266457
-
-
-
-
2-Hydroxy-3-methylbutyric acid
2-Hydroxy-3-methylbutyric acid
ME266458
-
-
-
-
2-Hydroxybutyric acid
2-Hydroxybutyric acid
ME266459
-
C05984
-
-
2-Hydroxypyridine
2-Hydroxypyridine
ME266460
-
-
-
-
3-hydroxypyridine
3-Hydroxypyridine
ME266461
-
-
-
-
3-Methyl-2-oxovaleric acid
3-Methyl-2-oxovaleric acid
ME266462
-
-
-
-
Alpha-ketoisovaleric acid
Ketoisovaleric acid
ME266463
-
C00141
-
-
Alpha-Lactose
Lactose
ME266464
-
C00243
-
-
Arachidic acid
Arachidic acid
ME266465
-
C06425
-
-
Arachidonic acid
Arachidonic acid
ME266466
-
C00219
-
-
Benzoic acid
Benzoic acid
ME266467
-
C00180
-
-
Beta-Alanine
beta-Alanine
ME266468
-
C00099
-
-
C10
CAR 10:0
ME266536
-
-
-
-
C10:1
CAR 10:1
ME266537
-
-
-
-
C10:2
CAR 10:2
ME266538
-
-
-
-
C12
CAR 12:0
ME266539
-
-
-
-
C12:1
CAR 12:1
ME266541
-
-
-
-
C12-DC
CAR DC12:0
ME266540
-
-
-
-
C14
CAR 14:0
ME266542
-
-
-
-
C14:1
CAR 14:1
ME266543
-
-
-
-
C14:1-OH
CAR 14:1;OH
ME266544
-
-
-
-
C14:2
CAR 14:2
ME266545
-
-
-
-
C14:2-OH
CAR 14:2;OH
ME266546
-
-
-
-
C16
CAR 16:0
ME266547
-
-
-
-
C16:1
CAR 16:1
ME266549
-
-
-
-
C16:1-OH
CAR 16:1;OH
ME266550
-
-
-
-
C16:2
CAR 16:2
ME266551
-
-
-
-
C16:2-OH
CAR 16:2;OH
ME266552
-
-
-
-
C16-OH
CAR 16:0;OH
ME266548
-
-
-
-
C18
CAR 18:0
ME266553
-
-
-
-
C18:1
CAR 18:1
ME266554
-
-
-
-
C18:1-OH
CAR 18:1;OH
ME266555
-
-
-
-
C18:2
CAR 18:2
ME266556
-
-
-
-
C2
CAR 2:0
ME266557
-
-
-
-
C3
CAR 3:0
ME266558
-
-
-
-
C3:1
CAR 3:1
ME266561
-
-
-
-
C3-DC (C4-OH)
CAR DC3:0
ME266563
-
-
-
-
C3-OH
CAR 3:0;OH
ME266560
-
-
-
-
C4
CAR 4:0
ME266562
-
-
-
-
C4:1
CAR 4:1
ME266564
-
-
-
-
C5
CAR 5:0
ME266565
-
-
-
-
C5:1
CAR 5:1
ME266568
-
-
-
-
C5:1-DC
CAR DC5:1
ME266569
-
-
-
-
C5-DC (C6-OH)
CAR DC5:0
ME266566
-
-
-
-
C5-M-DC
CAR DC5:0;3Me
ME266567
-
-
-
-
C5-OH (C3-DC-M)
CAR 5:0;OH
ME266559
-
-
-
-
C6:1
CAR 6:1
ME266571
-
-
-
-
C6 (C4:1-DC)
CAR 6:0
ME266570
-
-
-
-
C7-DC
CAR DC7:0
ME266572
-
-
-
-
C8
CAR 8:0
ME266573
-
-
-
-
C9
CAR 9:0
ME266574
-
-
-
-
Caproic acid
Caproic acid
ME266469
-
-
-
-
Carnosine
Carnosine
ME266470
-
C00386
-
-
Citric acid
Citric acid
ME266471
-
C00158
-
-
Creatinine
Creatinine
ME266472
-
C00791
-
-
D-2-Hydroxyglutaric acid
D-2-Hydroxyglutaric acid
ME266473
-
-
-
-
D-Fructose
Fructose
ME266474
-
C02336
-
-
D-Galactose
Galactose
ME266475
-
C00984
-
-
D-Glucose
Glucose
ME266476
-
C00031
-
-
Docosahexaenoic acid
Docosahexaenoic acid
ME266479
-
C06429
-
-
Dodecanoic acid
Lauric acid
ME266480
-
C02679
-
-
D-Threitol
Threitol
ME266477
-
-
-
-
D-Xylose
Xylose
ME266478
-
C00181
-
-
Erythrose
Erythrose
ME266481
-
-
-
-
Fumaric acid
Fumaric acid
ME266482
-
C00122
-
-
Galactonic acid
Galactonic acid
ME266483
-
C00880
-
-
Glutaric acid
Glutaric acid
ME266484
-
C00489
-
-
Glyceric acid
Glyceric acid
ME266485
-
C00258
-
-
Glycerol
Glycerol
ME266486
-
C00116
-
-
Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME266487
-
C00093
-
-
Glycine
Glycine
ME266488
-
C00037
-
-
Glycolic acid
Glycolic acid
ME266489
-
C00160
-
-
Histidine
Histidine
ME266446
-
-
-
-
Indoxyl sulfate
Indoxyl sulfate
ME266490
-
-
-
-
Isocitric acid
Isocitric acid
ME266491
-
C00311
-
-
isoleucine
Isoleucine
ME266447
-
-
-
-
Kynurenine
Kynurenine
ME266451
-
-
-
-
L-Alanine
Alanine
ME266492
-
C00041
-
-
L-Alloisoleucine
Alloisoleucine
ME266493
-
-
-
-
L-Alpha-aminobutyric acid
2S-Aminobutyric acid
ME266494
-
C02356
-
-
L-Arabitol
L-Arabitol
ME266495
-
C00532
-
-
L-Arginine
Arginine
ME266496
-
C00062
-
-
L-Asparagine
Asparagine
ME266497
-
C00152
-
-
L-Aspartic acid
Aspartic acid
ME266498
-
C00049
-
-
L-Cysteine
Cysteine
ME266499
-
-
-
-
L-Cystine
Cystine
ME266500
-
C00491
-
-
L-Glutamic acid
Glutamic acid
ME266501
-
C00025
-
-
L-Glutamine
Glutamine
ME266502
-
C00064
-
-
Linoleic acid
Linoleic acid
ME266514
-
C01595
-
-
L-Lactic acid
Lactic acid
ME266503
-
C00186
-
-
L-Leucine
Leucine
ME266504
-
C00123
-
-
L-Lysine
Lysine
ME266505
-
C00047
-
-
L-Methionine
Methionine
ME266506
-
C00073
-
-
L-Phenylalanine
Phenylalanine
ME266507
-
C00079
-
-
L-Pipecolic acid
Pipecolic acid
ME266508
-
C00408
-
-
L-Serine
Serine
ME266509
-
C00065
-
-
L-Sorbose
Sorbose
ME266510
-
-
-
-
L-Threonine
Threonine
ME266511
-
C00188
-
-
L-Tyrosine
Tyrosine
ME266512
-
C00082
-
-
L-Valine
Valine
ME266513
-
C00183
-
-
lysoPC a C14:0
LPC 14:0
ME266575
-
-
-
-
lysoPC a C16:0
LPC 16:0
ME266576
-
-
-
-
lysoPC a C16:1
LPC 16:1
ME266577
-
-
-
-
lysoPC a C17:0
LPC 17:0
ME266578
-
-
-
-
lysoPC a C18:0
LPC 18:0
ME266579
-
-
-
-
lysoPC a C18:1
LPC 18:1
ME266580
-
-
-
-
lysoPC a C18:2
LPC 18:2
ME266581
-
-
-
-
lysoPC a C20:3
LPC 20:3
ME266582
-
-
-
-
lysoPC a C20:4
LPC 20:4
ME266583
-
-
-
-
lysoPC a C24:0
LPC 24:0
ME266584
-
-
-
-
lysoPC a C26:0
LPC 26:0
ME266585
-
-
-
-
lysoPC a C26:1
LPC 26:1
ME266586
-
-
-
-
lysoPC a C28:0
LPC 28:0
ME266587
-
-
-
-
lysoPC a C28:1
LPC 28:1
ME266588
-
-
-
-
Maleic acid
Maleic acid
ME266515
-
C01384
-
-
Malic acid
Malic acid
ME266516
-
-
-
-
Mannitol
Mannitol
ME266517
-
C00392
-
-
Methionine sulfoxide
Methionine sulfoxide
ME266452
-
-
-
-
Methylcysteine
Methylcysteine
ME266518
-
-
-
-
Myoinositol
Myo-inositol
ME266519
-
C00137
-
-
N-Acetyl-l-ornithine
N-Acetylornithine
ME266450
-
-
-
-
Oleic acid
Oleic acid
ME266521
-
C00712
-
-
O-Phosphoethanolamine
Phosphoethanolamine
ME266520
-
C00346
-
-
Ornithine
Ornithine
ME266522
-
C00077
-
-
Palmitic acid
Palmitic acid
ME266523
-
C00249
-
-
PC aa C24:0
PC 24:0
ME266589
-
-
-
-
PC aa C26:0
PC 26:0
ME266590
-
-
-
-
PC aa C28:1
PC 28:1
ME266591
-
-
-
-
PC aa C30:0
PC 30:0
ME266592
-
-
-
-
PC aa C32:0
PC 32:0
ME266593
-
-
-
-
PC aa C32:1
PC 32:1
ME266594
-
-
-
-
PC aa C32:3
PC 32:3
ME266595
-
-
-
-
PC aa C34:1
PC 34:1
ME266596
-
-
-
-
PC aa C34:2
PC 34:2
ME266597
-
-
-
-
PC aa C34:3
PC 34:3
ME266598
-
-
-
-
PC aa C34:4
PC 34:4
ME266599
-
-
-
-
PC aa C36:0
PC 36:0
ME266600
-
-
-
-
PC aa C36:1
PC 36:1
ME266601
-
-
-
-
PC aa C36:2
PC 36:2
ME266602
-
-
-
-
PC aa C36:3
PC 36:3
ME266603
-
-
-
-
PC aa C36:4
PC 36:4
ME266604
-
-
-
-
PC aa C36:5
PC 36:5
ME266605
-
-
-
-
PC aa C36:6
PC 36:6
ME266606
-
-
-
-
PC aa C38:0
PC 38:0
ME266607
-
-
-
-
PC aa C38:3
PC 38:3
ME266608
-
-
-
-
PC aa C38:4
PC 38:4
ME266609
-
-
-
-
PC aa C38:5
PC 38:5
ME266610
-
-
-
-
PC aa C38:6
PC 38:6
ME266611
-
-
-
-
PC aa C40:1
PC 40:1
ME266612
-
-
-
-
PC aa C40:2
PC 40:2
ME266613
-
-
-
-
PC aa C40:3
PC 40:3
ME266614
-
-
-
-
PC aa C40:4
PC 40:4
ME266615
-
-
-
-
PC aa C40:5
PC 40:5
ME266616
-
-
-
-
PC aa C40:6
PC 40:6
ME266617
-
-
-
-
PC aa C42:0
PC 42:0
ME266618
-
-
-
-
PC aa C42:1
PC 42:1
ME266619
-
-
-
-
PC aa C42:2
PC 42:2
ME266620
-
-
-
-
PC aa C42:4
PC 42:4
ME266621
-
-
-
-
PC aa C42:5
PC 42:5
ME266622
-
-
-
-
PC aa C42:6
PC 42:6
ME266623
-
-
-
-
PC ae C30:0
PC O-30:0
ME266624
-
-
-
-
PC ae C30:1
PC O-30:1
ME266625
-
-
-
-
PC ae C30:2
PC O-30:2
ME266626
-
-
-
-
PC ae C32:1
PC O-32:1
ME266627
-
-
-
-
PC ae C32:2
PC O-32:2
ME266628
-
-
-
-
PC ae C34:0
PC O-34:0
ME266629
-
-
-
-
PC ae C34:1
PC O-34:1
ME266630
-
-
-
-
PC ae C34:2
PC O-34:2
ME266631
-
-
-
-
PC ae C34:3
PC O-34:3
ME266632
-
-
-
-
PC ae C36:0
PC O-36:0
ME266633
-
-
-
-
PC ae C36:1
PC O-36:1
ME266634
-
-
-
-
PC ae C36:2
PC O-36:2
ME266635
-
-
-
-
PC ae C36:3
PC O-36:3
ME266636
-
-
-
-
PC ae C36:4
PC O-36:4
ME266637
-
-
-
-
PC ae C36:5
PC O-36:5
ME266638
-
-
-
-
PC ae C38:0
PC O-38:0
ME266639
-
-
-
-
PC ae C38:1
PC O-38:1
ME266640
-
-
-
-
PC ae C38:2
PC O-38:2
ME266641
-
-
-
-
PC ae C38:3
PC O-38:3
ME266642
-
-
-
-
PC ae C38:4
PC O-38:4
ME266643
-
-
-
-
PC ae C38:5
PC O-38:5
ME266644
-
-
-
-
PC ae C38:6
PC O-38:6
ME266645
-
-
-
-
PC ae C40:1
PC O-40:1
ME266646
-
-
-
-
PC ae C40:2
PC O-40:2
ME266647
-
-
-
-
PC ae C40:3
PC O-40:3
ME266648
-
-
-
-
PC ae C40:4
PC O-40:4
ME266649
-
-
-
-
PC ae C40:5
PC O-40:5
ME266650
-
-
-
-
PC ae C40:6
PC O-40:6
ME266651
-
-
-
-
PC ae C42:0
PC O-42:0
ME266652
-
-
-
-
PC ae C42:1
PC O-42:1
ME266653
-
-
-
-
PC ae C42:2
PC O-42:2
ME266654
-
-
-
-
PC ae C42:3
PC O-42:3
ME266655
-
-
-
-
PC ae C42:4
PC O-42:4
ME266656
-
-
-
-
PC ae C42:5
PC O-42:5
ME266657
-
-
-
-
PC ae C44:3
PC O-44:3
ME266658
-
-
-
-
PC ae C44:4
PC O-44:4
ME266659
-
-
-
-
PC ae C44:5
PC O-44:5
ME266660
-
-
-
-
PC ae C44:6
PC O-44:6
ME266661
-
-
-
-
Pelargonic acid
Pelargonic acid
ME266524
-
-
-
-
Petroselinic acid
6-Octadecylenic acid
ME266525
-
-
-
-
Proline
Proline
ME266448
-
-
-
-
Putrescine
Putrescine
ME266454
-
-
-
-
Pyroglutamic acid
Pyroglutamic acid
ME266526
-
C01879
-
-
Pyruvic acid
Pyruvic acid
ME266527
-
C00022
-
-
Ribitol
Ribitol
ME266528
-
C00474
-
-
Ribonolactone
Ribonolactone
ME266529
-
-
-
-
SM C16:0
SM 18:1;O2/16:0
ME266667
-
-
-
-
SM C16:1
SM 18:1;O2/16:1
ME266668
-
-
-
-
SM C18:0
SM 18:1;O2/18:0
ME266669
-
-
-
-
SM C18:1
SM 18:1;O2/18:1
ME266670
-
-
-
-
SM C20:2
SM 18:1;O2/20:2
ME266671
-
-
-
-
SM C24:0
SM 18:1;O2/24:0
ME266672
-
-
-
-
SM C24:1
SM 18:1;O2/24:1
ME266673
-
-
-
-
SM C26:0
SM 18:1;O2/26:0
ME266674
-
-
-
-
SM C26:1
SM 18:1;O2/26:1
ME266675
-
-
-
-
SM (OH) C14:1
SM 18:1;O2/14:1;O
ME266662
-
-
-
-
SM (OH) C16:1
SM 18:1;O2/16:1;O
ME266663
-
-
-
-
SM (OH) C22:1
SM 18:1;O2/22:1;O
ME266664
-
-
-
-
SM (OH) C22:2
SM 18:1;O2/22:2;O
ME266665
-
-
-
-
SM (OH) C24:1
SM 18:1;O2/24:1;O
ME266666
-
-
-
-
Sorbitol
Sorbitol
ME266530
-
C00794
-
-
Spermidine
Spermidine
ME266455
-
-
-
-
Spermine
Spermine
ME266456
-
-
-
-
Stearic acid
Stearic acid
ME266531
-
C01530
-
-
Taurine
Taurine
ME266532
-
C00245
-
-
trans-4-Hydroxy-L-proline
trans-4-Hydroxyproline
ME266453
-
-
-
-
Tryptophan
Tryptophan
ME266449
-
-
-
-
Uracil
Uracil
ME266533
-
C00106
-
-
Urea
Urea
ME266534
-
C00086
-
-
Uric acid
Uric acid
ME266535
-
C00366
-
-
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