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Return to study ST003177 main page
Analysis: HILIC POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Indole
Indole
ME829651
798
C00463
0.79
-
alpha-Tocopherol
alpha-Tocopherol
ME829716
14985
C02477
0.8
-
Bilirubin
Bilirubin
ME829717
5280352
C00486
0.8
-
Melatonin
Melatonin
ME829703
896
C01598
0.85
-
Indole-3-acetate
Indoleacetic acid
ME829687
802
C00954
1.1
-
3-Acetamidopropanal
Acetamidopropanal
ME829718
5460495
C18170
1.17
-
Methylthioadenosine
Methylthioadenosine
ME829712
439176
C00170
1.17
-
Nicotinamide
Niacinamide
ME829655
936
C00153
1.19
-
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME829693
1826
C05635
1.21
-
Pyridoxine
Pyridoxine
ME829685
1054
C00314
1.28
-
Indolelactate
Indolelactic acid
ME829698
676157
C02043
1.33
-
Salicyluric acid
Salicyluric acid
ME829694
10253
C07588
1.35
-
Deoxyuridine
Deoxyuridine
ME829702
13712
C00526
1.37
-
Tryptamine
Tryptamine
ME829681
1150
C00398
1.38
-
6-Methyladenosine
N6-Methyladenosine
ME829710
102175
NA
1.4
-
3-Hydroxyanthranilate
3-Hydroxyanthranilic acid
ME829679
86
C00632
1.46
-
Ethyl 4-aminobutyrate
-
ME829660
-
NA
1.51
-
4-Acetamidobutanoate
4-Acetamidobutanoic acid
ME829672
18189
C02946
1.55
-
Glycerol
Glycerol
ME829732
753
C00116
1.58
-
Adenosine
Adenosine
ME829708
60961
C00212
1.64
-
Tyramine
Tyramine
ME829671
5610
C00483
1.65
-
Uridine
Uridine
ME829707
6029
C00299
1.67
-
Creatinine
Creatinine
ME829646
588
C00791
1.68
-
Cytosine
Cytosine
ME829645
597
C00380
1.92
-
Inosine
Inosine
ME829709
6021
C00294
2.09
-
Trimethylamine
Trimethylamine
ME829634
1146
C00565
2.11
-
L-Normetanephrine
Normetanephrine
ME829733
1237
C05589
2.18
-
Choline
Choline
ME829642
305
C00114
2.22
-
8-Hydroxy-deoxyguanosine
8-Hydroxy-deoxyguanosine
ME829711
73318
NA
2.37
-
L-Tryptophan
Tryptophan
ME829697
6305
C00078
2.38
-
Cytidine
Cytidine
ME829705
6175
C00475
2.41
-
L-Phenylalanine
Phenylalanine
ME829683
6140
C00079
2.43
-
L-Leucine
Leucine
ME829665
6106
C00123
2.5
-
L-Kynurenine
Kynurenine
ME829699
161166
C00328
2.51
-
1-Methylnicotinamide
1-Methyl nicotinamide
ME829670
457
C02918
2.62
-
L-Isoleucine
Isoleucine
ME829664
6306
C00407
2.68
-
Guanosine
Guanosine
ME829734
6802
C00387
2.71
-
Betaine
Betaine
ME829649
247
C00719
2.86
-
N-Acetylputrescine
N-Acetylputrescine
ME829659
122356
C02714
3.04
-
3-Hydroxy-L-kynurenine
Hydroxykynurenine
ME829701
161166
C00328
3.05
-
L-Methionine
Methionine
ME829677
6137
C00073
3.06
-
O-Acetylcarnitine
CAR 2:0
ME829696
7045767
C02571
3.27
-
5-Hydroxy-L-tryptophan
5-Hydroxy-tryptophan
ME829700
439280
C00643
3.39
-
L-Valine
Valine
ME829650
6287
C00183
3.39
-
L-Homocysteine
Homocysteine
ME829669
91552
C00155
3.4
-
5-Oxoproline
Pyroglutamic acid
ME829657
7405
C01879
3.41
-
L-Tyrosine
Tyrosine
ME829690
6057
C00082
3.42
-
L-Proline
Proline
ME829647
145742
C00148
3.45
-
Dimethylglycine
Dimethylglycine
ME829643
673
C01026
3.46
-
D-Sorbitol
Sorbitol
ME829691
5780
C00794
3.48
-
L-Pipecolate
Pipecolic acid
ME829658
439227
C00408
3.5
-
1-Methyladenosine
1-Methyladenosine
ME829720
27476
C02494
3.54
-
Taurine
Taurine
ME829656
1123
C00245
3.54
-
Trimethylamine-N-oxide
Trimethylamine N-oxide
ME829636
1145
C01104
3.58
-
L-Cysteine
Cysteine
ME829654
5862
C00097
3.71
-
Sarcosine
Sarcosine
ME829638
1088
C00213
3.88
-
3-Aminoisobutyric acid
3-Aminoisobutanoic acid
ME829641
64956
C05145
3.9
-
Cys-Gly
Cys-Gly
ME829719
439498
C01419
4.05
-
Hydroxyproline
Hydroxyproline
ME829662
5810
C01157
4.06
-
L-Alanine
Alanine
ME829639
5950
C00041
4.08
-
Creatine
Creatine
ME829661
586
C00300
4.1
-
Carnitine
Carnitine
ME829682
10917
C00487
4.12
-
5-Aminopentanoic acid
5-Aminopentanoic acid
ME829648
138
C00431
4.24
-
L-Threonine
Threonine
ME829653
6288
C00188
4.24
-
L-Homoserine
Homoserine
ME829652
12647
C00263
4.28
-
L-Glycine
Glycine
ME829635
-
NA
4.34
-
5-Aminolevulinate
5-Amino-levulinic acid
ME829663
137
C00430
4.41
-
L-Glutamine
Glutamine
ME829674
5961
C00064
4.44
-
L-Serine
Serine
ME829644
5951
C00065
4.53
-
L-Histidine
Histidine
ME829680
6274
C00135
4.57
-
L-Asparagine
Asparagine
ME829667
6267
C00152
4.59
-
Carnosine
Carnosine
ME829735
439224
C00386
4.61
-
Cysteamine
Cysteamine
ME829678
6058
C01678
4.81
-
N8-Acetylspermidine
N8-Acetylspermidine
ME829692
123689
C01029
4.81
-
N(pi)-Methyl-L-histidine
3-Methylhistidine
ME829684
64969
C01152
4.83
-
Cadaverine
Cadaverine
ME829640
273
C01672
4.89
-
L-Glutamate
Glutamic acid
ME829676
33032
C00025
4.92
-
Nicotinamide mononucleotide
Nicotinamide ribotide
ME829713
14181
C00455
5.01
-
Putrescine
Putrescine
ME829637
1045
C00134
5.06
-
L-Aspartate
Aspartic acid
ME829668
5960
C00049
5.08
-
L-Arginine
Arginine
ME829686
6322
C00062
5.09
-
Guanosine 5'-monophosphate
GMP
ME829714
6804
C00144
5.12
-
L-Lysine
Lysine
ME829675
5962
C00047
5.2
-
L-Ornithine
Ornithine
ME829666
6262
C00077
5.28
-
L-Cystine
Cystine
ME829704
67678
C00491
5.45
-
N1-Acetylspermine
N1-Acetylspermine
ME829706
916
C02567
5.61
-
Spermidine
Spermidine
ME829673
1102
C00315
5.86
-
Spermine
Spermine
ME829695
1103
C00750
6.28
-
1-Methylguanosine
1-Methylguanosine
ME829730
96373
C04545
-
-
4-Trimethylammoniobutanoate
3-Dehydroxycarnitine
ME829726
725
C01181
-
-
8-hydroxyguanosine
8-Hydroxyguanosine
ME829731
65131
NA
-
-
Acetylcholine
Acetylcholine
ME829725
187
C01996
-
-
Anthranilate
2-Aminobenzoic acid
ME829724
227
C00108
-
-
D-Glucosamine
Glucosamine
ME829688
439213
C00329
-
-
D-Mannose
Mannose
ME829689
185698
C00159
-
-
IndolePyruvate
Indolepyruvate
ME829728
803
C00331
-
-
L-Adrenaline
Epinephrine
ME829727
5816
C00788
-
-
N-Methylhistamine
1-Methylhistamine
ME829721
912
C05127
-
-
O-Phosphotyrosine
O-Phosphotyrosine
ME829729
30819
C06501
-
-
S-Adenosylmethionine
S-Adenosylmethionine
ME829715
34756
C00019
-
-
Serotonin
Serotonin
ME829722
5202
C00780
-
-
Xanthurenate
Xanthurenic acid
ME829723
5699
C02470
-
-
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Linolenate
Octadecatrienoic acid
ME829788
5280934
C06427
0.76
-
Arachidonate
Arachidonic acid
ME829792
444899
C00219
0.77
-
Heptadecanoic acid
Margaric acid
ME829786
10465
NA
0.77
-
Linoleate
Linoleic acid
ME829787
5280450
C01595
0.77
-
12(S)-HETE
12S-HETE
ME829796
17395775
C14777
0.78
-
13(S)-HODE
13S-HODE
ME829791
6443013
C14762
0.78
-
Tetradecanoic acid
Myristic acid
ME829781
11005
C06424
0.84
-
3-Indoxyl Sulfate
Indoxyl sulfate
ME829777
10258
NA
0.87
-
Prostaglandin E2
PGE2
ME829807
5280360
C00584
0.88
-
3-Methylbutanoic acid
Isovaleric acid
ME829852
10430
C08262
0.92
-
Homovanillate
Homovanillic acid
ME829855
1738
C05582
0.95
-
Phenylpyruvate
Phenylpyruvic acid
ME829760
997
C00166
0.95
-
3-Methyl-2-oxopentanoate
3-Methyl-2-oxovaleric acid
ME829853
-
NA
1.07
-
4-Pyridoxate
4-Pyridoxic acid
ME829772
6723
C00847
1.07
-
2-Methylmaleate
Citraconic acid
ME829827
643798
C02226
1.15
-
4-Methyl-2-oxopentanoate
Ketoleucine
ME829748
70
C00233
1.16
-
Azelaic acid
Azelaic acid
ME829774
2266
C08261
1.17
-
Maleic Acid
Maleic acid
ME829741
444266
C01384
1.18
-
Benzoic acid
Benzoic acid
ME829747
243
C00180
1.2
-
Uracil
Uracil
ME829740
1174
C00106
1.25
-
4-Hydroxyphenylpyruvate
4-Hydroxyphenylpyruvic acid
ME829771
979
C01179
1.34
-
Homogentisate
Homogentisic acid
ME829762
780
C00544
1.34
-
Taurocholate
Taurocholic acid
ME829818
6675
C05122
1.35
-
(R)-2-Hydroxyisocaproate
-
ME829749
439960
C03264
1.37
-
Gibberellin A3
Gibberellin A3
ME829804
6466
C01699
1.38
-
Adenine
Adenine
ME829752
190
C00147
1.53
-
Biotin
Biotin
ME829783
171548
C00120
1.53
-
2-Hydroxyisovaleric Acid
2-Hydroxy-3-methylbutyric acid
ME829744
99823
NA
1.56
-
Hippurate
Hippuric acid
ME829768
464
C01586
1.56
-
Methylmalonate
Methylmalonic acid
ME829746
487
C02170
1.61
-
Pyruvate
Pyruvic acid
ME829850
1060
C00022
1.68
-
4-Hydroxy-2-quinolinecarboxylic acid
Kynurenic acid
ME829775
3845
C01717
1.72
-
Xanthine
Xanthine
ME829756
1188
C00385
1.77
-
(R)-3-Hydroxybutyric acid
3R-Hydroxybutyric acid
ME829739
441
C01089
1.79
-
Hypoxanthine
Hypoxanthine
ME829753
790
C00262
1.8
-
Malonate
Malonic acid
ME829738
867
C00383
1.84
-
Acetoacetate
Acetoacetic acid
ME829736
96
C00164
1.87
-
Glycocholate
Glycocholic acid
ME829816
10140
C01921
1.97
-
Allantoin
Allantoin
ME829828
204
C02350
2
-
3-Nitrotyrosine
Nitrotyrosine
ME829780
65124
NA
2.02
-
(R)-Mevalonate
Mevalonic acid
ME829755
439230
C00418
2.1
-
Pantothenate
Pantothenic acid
ME829778
6613
C00864
2.17
-
Adipate
Adipic acid
ME829754
196
C06104
2.19
-
Dopamine
Dopamine
ME829757
681
C03758
2.4
-
L-Lactate
Lactic acid
ME829825
107689
C00186
2.44
-
Succinate
Succinic acid
ME829745
1110
C00042
2.48
-
Orotate
Orotic acid
ME829758
967
C00295
2.64
-
Glyceraldehyde
Glyceraldehyde
ME829849
751
C02154
2.65
-
Glutarate
Glutaric acid
ME829750
743
C00489
2.91
-
Xanthosine
Xanthosine
ME829789
64959
C01762
3.13
-
cis-Aconitate
cis-Aconitic acid
ME829829
643757
C00417
3.21
-
N-AcetylGlycine
N-Acetylglycine
ME829742
10972
NA
3.25
-
Monodehydroascorbate
-
ME829830
-
C01041
3.26
-
beta-D-Glucose/L-Galactose
-
ME829770
-
NA
3.6
-
Urate
Uric acid
ME829763
1175
C00366
3.98
-
3',5'-Cyclic GMP
3',5' cyclic GMP
ME829803
24316
C00942
4.15
-
4-Aminobutanoate
gamma-Aminobutyric acid
ME829737
119
C00334
4.2
-
Guanidinoacetate
Guanidoacetic acid
ME829743
763
C00581
4.2
-
Shikimate
Shikimic acid
ME829766
8742
C00493
4.31
-
Sucrose
Sucrose
ME829802
5988
C00089
4.34
-
Lactose
Lactose
ME829801
84571
C00243
4.39
-
dTMP
dTMP
ME829797
9700
C00364
4.4
-
sn-Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME829848
439162
C00093
4.52
-
S-Adenosylhomocysteine
S-Adenosylhomocysteine
ME829809
439155
C00021
4.54
-
(S)-Malate
Malic acid
ME829751
222656
C00149
4.57
-
Fumarate
Fumaric acid
ME829826
444972
C00122
4.58
-
Oxalate
Oxalic acid
ME829851
971
C00209
4.61
-
myo-Inositol
Myo-inositol
ME829769
-
C00137
4.63
-
L-Citrulline
Citrulline
ME829767
9750
C00327
4.64
-
Citrate
Citric acid
ME829831
311
C00158
4.67
-
N-Acetyl-beta-neuraminate
-
ME829795
445063
C19910
4.69
-
5-Methyltetrahydrofolate
5-Methyl-THF
ME829815
439234
C00440
4.7
-
AMP
AMP
ME829805
6083
C00020
4.7
-
D-Glyceraldehyde 3-phosphate
Glyceraldehyde 3-phosphate
ME829765
439168
C00118
4.7
-
Glycerone phosphate (Dihydroxyacetone phosphate)
-
ME829764
-
NA
4.7
-
Tetrahydrofolate
THF
ME829814
6140
C00079
4.76
-
Folate
Folic acid
ME829812
6037
C00504
4.77
-
D-Glucuronate
Glucuronic acid
ME829776
444791
C00191
4.86
-
CMP
CMP
ME829798
6131
C00055
4.87
-
dCMP
dCMP
ME829793
13945
C00239
4.9
-
IMP
IMP
ME829806
8582
C00130
4.9
-
L-2-Aminoadipate
alpha-Aminoadipic acid
ME829759
92136
C00956
4.9
-
Glutathione
Glutathione
ME829794
124886
C00051
4.92
-
NADH
NADH
ME829822
439153
C00004
5
-
Phosphoenolpyruvic Acid
Phosphoenolpyruvic acid
ME829761
1005
C00074
5.1
-
G6P
Glucose 6-phosphate
ME829785
71668263
NA
5.12
-
NAD+
NAD
ME829821
5892
C00003
5.17
-
ADP
ADP
ME829811
6022
C00008
5.27
-
UDP
UDP
ME829810
6031
C00015
5.39
-
L-Argininosuccinate
Argininosuccinic acid
ME829790
16950
C03406
5.41
-
L-Cystathionine
Cystathionine
ME829779
439258
C02291
5.43
-
Orotidine 5'-phosphate
Orotidylic acid
ME829808
160617
C01103
5.44
-
NADPH
NADPH
ME829824
5884
C00005
5.45
-
GDP
GDP
ME829813
8977
C00035
5.53
-
NADP+
NADP
ME829823
5885
C00006
5.53
-
ATP
ATP
ME829817
5957
C00002
5.62
-
Glutathione disulfide
Oxidized glutathione
ME829820
65359
C00127
5.82
-
GTP
GTP
ME829819
6830
C00044
5.88
-
Isocitrate
Isocitric acid
ME829854
1198
C00311
6.32
-
2/3-Phosphoglyceric acid
-
ME829773
-
NA
-
-
2-Hydroxyglutarate
2-Hydroxyglutaric acid
ME829842
43
C02630
-
-
2-Methylpropanoate
Isobutyric acid
ME829834
6590
C02632
-
-
2-Oxoglutarate
2-Oxoglutaric acid
ME829841
51
C00026
-
-
2-Oxoisovalerate
-
ME829836
49
C00141
-
-
3-Ureidopropionate
Ureidopropionic acid
ME829840
111
C02642
-
-
beta-D-Fructose
-
ME829843
-
C02336
-
-
D-Erythrose
Erythrose
ME829837
-
NA
-
-
D-Ribose 5-phosphate
Ribose 5-phosphate
ME829782
440101
C00117
-
-
dUTP
dUTP
ME829847
65070
C00460
-
-
F16BP/F26BP
-
ME829800
-
NA
-
-
F6P/F1P
-
ME829784
-
NA
-
-
G16BP
-
ME829799
-
NA
-
-
G1P
Glucose 1-phosphate
ME829844
-
NA
-
-
Glyceric acid
Glyceric acid
ME829835
439194
C00258
-
-
Glycochenodeoxycholate
Glycochenodeoxycholic acid
ME829832
12544
C05466
-
-
Malondialdehyde
Malondialdehyde
ME829833
10964
C19440
-
-
MethylSuccinate
Methylsuccinic acid
ME829838
6950476
C08645
-
-
N6-(1,2-Dicarboxyethyl)-AMP
Adenylsuccinic acid
ME829846
447145
C03794
-
-
Oxalacetate
Oxaloacetic acid
ME829839
970
C00036
-
-
Polyprenyl diphosphate
-
ME829845
445995
C00341
-
-
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