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Return to study ST002708 main page
Analysis: HILIC UNSPECIFIED ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
2-hydroxyglutarate
2-Hydroxyglutaric acid
ME639294
43
C02630
10.2
147.0299
alpha-keto-isovalerate
Ketoisovaleric acid
ME639320
49
C00141
2.85
115.0401
Alpha-Ketoglutarate
2-Oxoglutaric acid
ME639321
51
C00026
13.17
145.0143
2-oxobutyric_acid_unc
3-Methyl pyruvic acid
ME639296
58
C00109
3.73
101.0244
2-oxoadipate_unc
Oxoadipic acid
ME639295
71
C00322
9.8
159.0299
acetoacetate
Acetoacetic acid
ME639304
96
C00164
4.23
101.0244
3-ureidopropionate
Ureidopropionic acid
ME639302
111
C02642
7.85
133.0608
adenine
Adenine
ME639312
190
C00147
4.51
136.0618
allantoin
Allantoin
ME639319
204
C01551
8.27
157.0367
anthranilic_acid
2-Aminobenzoic acid
ME639326
227
C00108
4
136.0404
beta-alanine
beta-Alanine
ME639336
239
C00099
9.45
90.055
betaine
Betaine
ME639337
247
C00719
5.94
118.0863
choline
Choline
ME639346
305
C00114
9.04
104.107
citrate
Citric acid
ME639348
311
C00158
12.2
191.0197
1-methylnicotinamide
1-Methyl nicotinamide
ME639291
457
C02918
12.02
137.0709
malate
Malic acid
ME639435
525
C03668
10.81
133.0143
creatine
Creatine
ME639353
586
C00300
8.78
132.0768
phosphocreatine
Phosphocreatine
ME639466
587
C02305
9.85
212.0431
creatinine
Creatinine
ME639354
588
C00791
4.56
114.0662
cytosine_unc
Cytosine
ME639366
597
C00380
5.88
112.0505
dihydroorotate_unc
-
ME639370
648
C00337
7.33
159.04
dihydroxyacetone_phosphate
Dihydroxyacetone phosphate
ME639371
668
C00111
10.44
168.9908
dimethylglicine
Dimethylglycine
ME639372
673
C01026
6.9
104.071
3-phosphoglycerate
3-Phosphoglyceric acid
ME639301
724
C00597
11.26
184.9857
glyceraldehyde_3-phosphate
Glyceraldehyde 3-phosphate
ME639393
729
C00118
11.35
168.9908
glycine
Glycine
ME639397
750
C00037
9.74
76.0393
guanidinoacetate
Guanidoacetic acid
ME639407
763
C00581
9.6
118.0611
guanine
Guanine
ME639408
764
C00242
6.9
152.0567
hypoxanthine
Hypoxanthine
ME639420
790
C00262
5.19
137.0458
Itaconic Acid
Itaconic acid
ME639427
811
C00490
10.1
129.0193
Pipecolate
Pipecolic acid
ME639471
849
C00408
6.8
130.0863
Alpha-Lipoic Acid_unc
Lipoic acid
ME639322
863
C00248
2.8
205.0362
niacinamide
Niacinamide
ME639454
936
C00153
3.03
123.0553
Nicotinic Acid
Nicotinic acid
ME639455
938
C00253
4.2
124.0393
orotate
Orotic acid
ME639458
967
C00295
6.1
155.0098
p-aminobenzoate
p-Aminobenzoic acid
ME639459
978
C00568
6.29
136.04
palmitate
Palmitic acid
ME639460
985
C00249
2.05
255.233
phosphoenolpyruvate
Phosphoenolpyruvic acid
ME639467
1005
C00074
11.8
166.9751
phosphocholine
Choline phosphate
ME639465
1014
C00588
10.17
184.0733
O-phosphoethanolamine_unc
Phosphoethanolamine
ME639456
1015
C00346
10.67
140.012
phosphoethanolamine
Phosphoethanolamine
ME639468
1015
C00346
10.67
140.012
Picolinate
Picolinic acid
ME639470
1018
C10164
4.36
124.039
Pyridoxal
Pyridoxal
ME639477
1050
C00250
3.76
168.065
Pyridoxine
Pyridoxine
ME639478
1054
C00314
3.64
170.081
pyruvate
Pyruvic acid
ME639479
1060
C00022
4.3
87.0088
quinolinic_acid
Quinolinic acid
ME639480
1066
C03722
10.38
166.01458
sarcosine_unc
-
ME639488
1088
C00213
8.48
90.055
succinate
Succinic acid
ME639494
1110
C00042
10.19
117.0193
taurine
Taurine
ME639496
1123
C00245
9.26
124.0074
thiamine
Thiamine
ME639497
1130
C00378
6.64
263.0972
tryptamine
Tryptamine
ME639502
1150
C00398
11.4
161.10732
uracil
Uracil
ME639510
1174
C00106
4.15
111.02
uric acid
Uric acid
ME639512
1175
C00366
7.97
167.0211
trans-urocanate
Urocanic acid
ME639501
1178
NA
6.53
139.05
xanthine
Xanthine
ME639517
1188
C00385
7.15
151.0262
isocitrate_unc
Isocitric acid
ME639424
1198
C00311
14.13
191.01973
HIAA
Hydroxyindoleacetic acid
ME639410
1826
C05635
8.44
192.06552
Kynurenic Acid
Kynurenic acid
ME639428
3845
C01717
3.2
190.0499
serotonin
Serotonin
ME639492
5202
C00780
14.04
177.10224
sorbitol
Sorbitol
ME639493
5780
C00794
8.2
181.0718
thymidine
Thymidine
ME639500
5789
C00214
3.06
241.08299
glucose
Glucose
ME639388
5793
C00221
9.04
179.0561
hydroxyproline_gammaALA
-
ME639418
5810
C01157
8.9
130.05097
cysteine_13C3_15N1
Cysteine
ME639360
5862
C00097
3.8
122.02703
NADP
NADP
ME639452
5886
C00006
11.14
744.0827
NAD+
NAD
ME639450
5893
C00003
9.34
664.1164
alanine
Alanine
ME639317
5950
C00041
9.02
90.055
serine
Serine
ME639490
5951
C00065
9.59
106.0499
ATP
ATP
ME639335
5957
C00002
10.85
505.9885
Glucose 6-phosphate
Glucose 6-phosphate
ME639389
5958
C00092
11.28
259.0224
aspartate
Aspartic acid
ME639332
5960
C00049
9.93
132.0302
glutamine
Glutamine
ME639392
5961
C00064
9.15
147.0764
lysine
Lysine
ME639433
5962
C00047
13.89
147.1128
inosine
Inosine
ME639423
6021
C00294
6.05
269.0881
ADP
ADP
ME639314
6022
C00008
10
426.0221
uridine
Uridine
ME639513
6029
C00299
4.81
243.0623
UMP
UMP
ME639509
6030
C00105
10.15
323.0286
UDP
UDP
ME639506
6031
C00015
11.09
402.99492
folic_acid
Folic acid
ME639379
6037
C00504
11.4
442.147
tyrosine
Tyrosine
ME639504
6057
C00082
7.58
182.0812
cAMP_unc
3',5' cyclic AMP
ME639341
6076
C00575
5.24
330.0598
AMP
AMP
ME639324
6083
C00020
9.3
346.0558
leucine
Leucine
ME639431
6106
C00123
5.48
132.1019
CMP
CMP
ME639350
6131
C00055
10.6
322.0446
CDP
CDP
ME639344
6132
C00112
11.84
402.0109
UTP
UTP
ME639514
6133
C00075
12.13
482.9613
methionine
Methionine
ME639438
6137
C00073
6.12
150.0583
phenylalanine
Phenylalanine
ME639463
6140
C00079
4.7
164.0717
CTP
CTP
ME639355
6176
C00063
13
481.9772
N-acetylmethionine
N-Acetylmethionine
ME639447
6180
C02712
3
192.0689
cytidine
Cytidine
ME639365
6253
C00475
6.4
244.0928
ornithine
Ornithine
ME639457
6262
C00077
12.58
133.0972
asparagine
Asparagine
ME639331
6267
C00152
9.32
133.0608
histidine
Histidine
ME639411
6274
C00135
8.94
156.0768
valine
Valine
ME639515
6287
C00183
7
118.0863
threonine
Threonine
ME639498
6288
C00188
8.61
120.0655
tryptophan
Tryptophan
ME639503
6305
C00078
6.16
205.0972
isoleucine
Isoleucine
ME639425
6306
C00407
5.88
132.1019
arginine
Arginine
ME639327
6322
C00062
14.23
175.119
Pantothenate
Pantothenic acid
ME639461
6613
C00864
5.3
220.118
guanosine
Guanosine
ME639409
6802
C00387
7.23
284.0989
GMP
GMP
ME639399
6804
C00144
11.21
362.0507
GTP
GTP
ME639406
6830
C00044
12.93
521.9834
PRPP_unc
Phosphoribosyl pyrophosphate
ME639475
7339
C00119
13.21
388.9445
IMP
IMP
ME639421
8582
C00130
10.43
349.054
GDP
GDP
ME639387
8977
C00035
12.4
442.017
dTMP
dTMP
ME639373
9700
C00364
8.54
321.0493
citrulline
Citrulline
ME639349
9750
C00327
9.73
176.103
Fructose 1,6-bisphosphate
Fructose 1,6-bisphosphate
ME639382
10267
C05378
12.12
341.0033
malonyl-CoA
Malonyl-CoA
ME639436
10663
C03188
10.77
854.12288
carnitine
Carnitine
ME639342
10917
C00318
7.68
162.1125
acetylglycine
N-Acetylglycine
ME639310
10972
NA
5.75
116.0348
2-hydroxybutyric_acid
2-Hydroxybutyric acid
ME639293
11266
C05984
4.1
103.0401
N-acetylcysteine
N-Acetylcysteine
ME639443
12035
C06809
4.3
162.0231
dCytidine
Deoxycytidine
ME639369
13711
C00881
5.15
228.098
CDP-choline
CDP-choline
ME639345
13804
C00307
10.01
490.1173
pseudouridine_unc
-
ME639476
15047
C02067
6.91
243.0623
dATP
dATP
ME639367
15993
C00131
10.25
492.0081
argininosuccinate_unc
-
ME639329
16950
C03406
11.47
291.1299
mannose
Mannose
ME639437
18950
C00936
8.4
179.056
S-methylcysteine_unc
Methylcysteine
ME639486
24417
C22040
6.69
136.0427
cysteic_acid
Cysteic acid
ME639359
25701
C00506
10.48
167.99722
glutamate
Glutamic acid
ME639390
33032
C00025
9.78
146.0459
ADP-ribose_unc
ADP-ribose
ME639315
33576
C00301
10.47
558.0644
S-Adenosyl-L-methionine
S-Adenosylmethionine
ME639485
34756
C00019
9.94
399.1445
adenosine_unc
Adenosine
ME639313
60961
C00212
4.1
268.104
xanthosine_unc
Xanthosine
ME639518
64959
C01762
7.8
283.0684
dTTP
dTTP
ME639374
64968
C00459
11.4
480.982
dUMP
dUMP
ME639375
65063
C00365
9.64
307.0337
acetylaspartate
N-Acetylaspartic acid
ME639307
65065
C01042
9.9
176.055
homocitrulline
Homocitrulline
ME639414
65072
C02427
9.4
190.119
dCTP
dCTP
ME639368
65091
C00458
11.47
465.98232
AICAR
AICAR
ME639316
65110
C04677
10.35
337.0555
acetylserine
O-Acetylserine
ME639311
65249
NA
6.56
146.0459
GSSG
Oxidized glutathione
ME639404
65359
C00127
11.95
613.1592
F6P_G1P_unc
-
ME639377
65533
C00103
10.6
259.0224
cystine
Cystine
ME639363
67678
C00491
10.4
241.0311
phosphoserine
Phosphoserine
ME639469
68841
C01005
11.28
184.0017
Glycerophosphocholine
sn-Glycero-3-phosphocholine
ME639396
71920
C00670
8.75
258.1101
N-acetylphenylalanine
N-Acetylphenylalanine
ME639449
74839
C03519
2.34
208.0968
2-aminobutyric_acid
2-Aminobutyric acid
ME639292
80283
C02356
7.96
104.071
Coenzyme A
Coenzyme A
ME639352
87642
C00010
8.9
768.1225
acetylalanine
N-Acetylalanine
ME639306
88064
NA
4.7
132.066
6-phosphogluconate
6-Phosphogluconic acid
ME639303
91493
C00345
12.58
275.0174
homocysteine
Homocysteine
ME639416
91552
C00155
7.45
136.0427
Phenylacetyl glutamine
alpha-N-Phenylacetylglutamine
ME639462
92258
C04148
3
265.1183
N-acetyllysine
N(2)-Acetyllysine
ME639446
92832
C02727
7.58
189.12337
Ureidosuccinic_acid
N-Carbamoylaspartic acid
ME639511
93072
C00438
11.24
175.036
lactic_acid
Lactic acid
ME639430
107689
C00186
5.46
89.0244
propionylcarnitine
CAR 3:0
ME639474
107738
C03017
4.74
218.1387
hypotaurine
Hypotaurine
ME639419
107812
C00519
9.12
110.027
anserine_unc
Anserine
ME639325
112072
C01262
8.61
241.1295
erythrose_4-phosphate_unc
-
ME639376
122357
C00279
11.35
199.0013
asymmetric dimethylarginine (ADMA)
Dimethylarginine
ME639334
123831
C03626
11.75
203.151
proline
Proline
ME639472
145742
C00148
7.23
116.0706
Methionine sulfoxide
Methionine sulfoxide
ME639439
158980
C02989
7.98
166.0531
saccharopine_unc
Saccharopine
ME639487
160556
C00449
10.54
277.1394
kynurenine
Kynurenine
ME639429
161166
C00328
5.26
209.0921
Homocysteine sulfinic acid
Homocysteinesulfinic acid
ME639417
161712
NA
9.86
166.01795
biotin
Biotin
ME639338
171548
C00120
4.49
245.095
homocysteic_acid
Homocysteic acid
ME639415
177491
C16511
12.72
182.01287
N-acetylglutamine
N-Acetylglutamine
ME639445
182230
NA
6.29
189.087
2,3-BPG_unc
-
ME639297
186004
C01159
12.7
264.952
gamma-aminobutyric_acid
gamma-Aminobutyric acid
ME639384
223130
C00334
9.43
104.071
S-Adenosyl-L-Homocysteine
S-Adenosylhomocysteine
ME639484
439155
C00021
7.8
385.1289
succinyl-CoA
Succinyl-CoA
ME639495
439161
C00091
10.34
868.1385
Glycerol 3-Phosphate
sn-Glycero-3-phosphate
ME639395
439162
C00093
9.86
173.021
methylthioadenosine
Methylthioadenosine
ME639441
439176
C00170
2.72
298.0968
glycerate
Glyceric acid
ME639394
439194
C00258
7.46
105.0193
carnosine
Carnosine
ME639343
439224
C00386
9.44
227.1139
N-acetylornithine
N-Acetylornithine
ME639448
439232
C00437
9.65
175.1077
Ribose 1-phosphate_unc
Ribose 1-phosphate
ME639482
439236
C00620
10.37
229.0119
cystathionine
Cystathionine
ME639358
439258
C02291
10.91
223.0747
cysteine-glycine
Cys-Gly
ME639362
439498
C01419
6.6
179.048
fructose
Fructose
ME639381
439709
C02336
7.86
179.05611
formyl_methionine
N-Formylmethionine
ME639380
439750
C03145
3.3
176.0387
Butyrylcarnitine
CAR 4:0
ME639339
439829
C02862
3.54
232.1543
Ribose_Ribulose 5-phosphate_3Me-Lys
-
ME639483
440101
C00117
10.54
229.0119
3-hydroxyisobutyric_acid
3-Hydroxyisobutyric acid
ME639299
440873
C06001
5.5
103.0401
Acetyl CoA
Acetyl-CoA
ME639305
444493
C00024
8.17
810.133
fumarate
Fumaric acid
ME639383
444972
C00122
10.64
115.0037
UDP-GlcNAc
UDP-N-acetylglucosamine
ME639507
445675
C00043
10.1
608.0888
Riboflavin
Riboflavin
ME639481
493570
C00255
3.49
377.116
cis-aconitate
cis-Aconitic acid
ME639347
643757
C00417
12.15
173.0092
FAD
FAD
ME639378
643975
C00016
7.14
784.1499
indolelactate
Indolelactic acid
ME639422
676157
C02043
3.85
206.081
GAR
GAR
ME639386
5459918
C03838
11.21
285.0493
acetylcarnitine
CAR 2:0
ME639308
7045767
C02571
5.56
204.123
ascorbate_unc
Vitamin C
ME639330
54670067
C01041
9.56
175.0248
Sedoheptulose-7-phosphate
Sedoheptulose 7-phosphate
ME639489
92042786
C05382
11.04
289.033
3-hydroxybutyric_acid
3-Hydroxybutyric acid
ME639298
-
-
4.9
103.0401
3-methyl-2-oxopentanoic_acid
3-Methyl-2-oxovaleric acid
ME639300
-
-
2.49
129.0557
acetylglutamate
N-Acetylglutamic acid
ME639309
-
-
9.93
190.071
alanine-13C3-15N
Alanine
ME639318
-
-
9.02
94.0621
amidoadipate
-
ME639323
-
-
10.06
162.076
arginine-13C6-15N4
Arginine
ME639328
-
-
14.23
185.1273
aspartate-13C6-15N4
Aspartic acid
ME639333
-
-
9.93
137.0407
C5 Carnitines
-
ME639340
-
-
3.26
246.17
CoA-Ellmans_unc
-
ME639351
-
-
10
963.0866
Cys_Ell
-
ME639356
-
-
8.2
316.9912
Cys_Gly_Ell
-
ME639357
-
-
9
374.0126
cysteine_unc
-
ME639361
-
-
3.8
126.03413
cystine-13C6-15N2
Cystine
ME639364
-
-
10.4
249.04532
gamma-glutamyl-alanine
gamma-Glutamylalanine
ME639385
-
-
9.53
219.098
glutamate-13C5,15N
Glutamic acid
ME639391
-
-
9.78
152.0597
glycine_13C2-15N
Glycine
ME639398
-
-
9.7
79.043
GSH
Glutathione
ME639400
-
-
9.59
308.0911
GSH-13C2_15N
Glutathione
ME639403
-
-
9.6
509.08093
GSH_13C2-15N-Ellmans
Glutathione
ME639401
-
-
10
506.058
GSH_Ellmans
Glutathione
ME639402
-
-
10
503.0552
GSSG-13C4_15N2
Oxidized glutathione
ME639405
-
-
11.9
619.16673
histidine-13C6-15N3
Histidine
ME639412
-
-
8.94
165.088
HoCy_Ell
-
ME639413
-
-
-
-
Isoleucine-13C6-15N
Isoleucine
ME639426
-
-
5.88
139.1191
leucine-13C6-15N
Leucine
ME639432
-
-
5.48
139.1191
lysine-13C6-15N2
Lysine
ME639434
-
-
13.89
155.127
methionine-13C5-15N
Methionine
ME639440
-
-
6.1
156.0721
myo-inositol
Myo-inositol
ME639442
-
C00137
10.8
179.056
N-acetylglutamate
N-Acetylglutamic acid
ME639444
-
-
9.93
190.071
NADH
NADH
ME639451
-
-
8.85
666.13205
NADPH
NADPH
ME639453
-
-
11.44
746.0984
phenylalanine-13C9-15N
Phenylalanine
ME639464
-
-
4.7
176.1135
proline-13C5-15N
Proline
ME639473
-
-
7.28
122.0844
serine-13C3-15N
Serine
ME639491
-
-
9.59
110.057
threonine-13C4-15N
Threonine
ME639499
-
-
8.61
125.076
tyrosine-13C9-15N
Tyrosine
ME639505
-
-
7.58
192.1084
UDP-hexose
UDP-hexose
ME639508
-
-
11.08
565.0478
valine-13C5-15N
Valine
ME639516
-
-
7.01
124.1001
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