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Return to study ST003434 main page
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
2-Hydroxybutyric 17
2-Hydroxybutyric acid
ME898755
11266
C05984
2.5
-
2-Hydroxybutyric 57
2-Hydroxybutyric acid
ME898757
11266
C05984
2.53
-
3-Hydroxybutyric 17
3-Hydroxybutyric acid
ME898756
441
C01089
2.88
-
3-Hydroxybutyric 59
3-Hydroxybutyric acid
ME898758
441
C01089
2.88
-
3-Hydroxyisobutyric 73
3-Hydroxyisobutyric acid
ME898759
87
C01188
3.18
-
3PGA 97
3-Phosphoglyceric acid
ME898834
439183
C00197
8.21
-
Acetic PAR
Acetic acid
ME898743
176
C00033
3.37
-
Acetic PAR ATTN
Acetic acid
ME898744
176
C00033
3.37
-
Acetyl-CoA 408
Acetyl-CoA
ME898908
444493
C00024
5.54
-
Acetyl-CoA 461
Acetyl-CoA
ME898909
444493
C00024
5.55
-
Acetyl-CoA 79
Acetyl-CoA
ME898907
444493
C00024
5.54
-
alpha-Cyclodextrin 101
-
ME898922
444913
D08846
7.18
-
alpha-Cyclodextrin 161
-
ME898921
444913
D08846
7.44
-
AMP 193
AMP
ME898871
6083
C00020
5.86
-
AMP 79
AMP
ME898870
6083
C00020
5.86
-
Ascorbic 157
-
ME898816
54670067
C00072
7.04
-
Ascorbic 79
-
ME898817
54670067
C00072
6.98
-
Asparagine 113
Asparagine
ME898777
6267
C00152
6.66
-
Aspartic 115
Aspartic acid
ME898781
5960
C0004
6.56
-
Aspartic 88
Aspartic acid
ME898780
5960
C0004
6.55
-
Benzoic 77
2-Pyrocatechuic acid
ME898768
243
C00180
1.74
-
Butyric PAR
Butyric acid
ME898749
264
C00246
2.63
-
Butyryl-CoA 408
Butyryl-CoA
ME898912
122283
C00136
4.71
-
Butyryl-CoA 79
Butyryl-CoA
ME898911
122283
C00136
4.79
-
C75 209
-
ME898852
4248455
-
1.4
-
CDP
CDP
ME898878
6132
C00112
8.08
-
Cellobiose 161
Cellobiose
ME898867
10712
C00185
6.99
-
Cholic 343
Cholic acid
ME898881
221493
C00695
1.58
-
cis-Aconitic 111
cis-Aconitic acid
ME898812
643757
C00417
8.17
-
cis-Aconitic 85
cis-Aconitic acid
ME898811
643757
C00417
8.18
-
Citraconic 85
Citraconic acid
ME898773
643798
C02226
2.86
-
Citric 87
Citric acid
ME898835
311
C00158
8.79
-
Citric/Isocitric 111
Citric acid/Isocitric acid
ME898838
311
C00158
8.85
-
Citric/Isocitric 173
Citric acid/Isocitric acid
ME898839
311
C00158
8.98
-
Citrulline 131
Citrulline
ME898815
9750
C00327
7.02
-
Coenzyme A 408
Coenzyme A
ME898902
87642
C00010
6.32
-
Coenzyme A 79
Coenzyme A
ME898901
87642
C00010
6.3
-
Cystine 120
Cystine
ME898849
67678
C00491
7.19
-
Cystine 74
Cystine
ME898850
67678
C00491
7.18
-
[D3] Acetic PAR
Acetic acid
ME898745
176
C00033
3.36
-
Deoxyuridine 111
Deoxyuridine
ME898844
13712
C00526
2.82
-
dGDP 79
dGDP
ME898882
135398595
C00361
7.04
-
DHAP 79
Dihydroxyacetone phosphate
ME898805
668
C00111
6.84
-
DHAP 97
Dihydroxyacetone phosphate
ME898806
668
C00111
6.84
-
EDTA 273
Edetic acid
ME898861
6049
C00284
6.32
-
Ethanolamine phosphate 63
Phosphoethanolamine
ME898785
1015
C00346
7.46
-
Ethanolamine phosphate 79
Phosphoethanolamine
ME898784
1015
C00346
7.47
-
Ethyl sulfate 80
-
ME898771
6004
-
2.69
-
Ethyl sulfate 97
-
ME898770
6004
-
2.49
-
FAD 517
FAD
ME898904
643975
C00016
4.62
-
FAD 79
FAD
ME898903
643975
C00016
4.63
-
FAICAR 79
FAICAR
ME898876
166760
C04734
7.67
-
Fasnall 178
-
ME898864
16230362
-
1.92
-
fMet 128
N-Formylmethionine
ME898818
439750
C03145
1.75
-
Folic 311
Folic acid
ME898885
135398658
C00504
7.55
-
Formic PAR
Formic acid
ME898742
284
C00058
3.57
-
Formyl-CoA 408
-
ME898905
3082032
C00798
6.28
-
Formyl-CoA 79
-
ME898906
3082032
C00798
5.86
-
Fructose-1,6-bisphosphate 177
Fructose 1,6-bisphosphate
ME898866
10267
C05378
-
-
Fructose-1,6-bisphosphate 97
Fructose 1,6-bisphosphate
ME898865
10267
C05378
7.02
-
Fructose 89
Fructose
ME898824
439163
C00095
5.51
-
Fumaric 71
Fumaric acid
ME898760
444972
C00122
7.32
-
Glucono-1,5-lactone 129
Gluconolactone
ME898819
7027
C00198
5.5
-
Glucose 1-phosphate 151
Glucose 1-phosphate
ME898856
65533
C00103
7.39
-
Glucose 1-phosphate 79
Glucose 1-phosphate
ME898855
65533
C00103
7.33
-
Glucose 59
Glucose
ME898821
5793
C00031
6.15
-
Glucose 6-phosphate 139
Glucose 6-phosphate
ME898858
5958
C00092
7.84
-
Glucose 6-phosphate 97
Glucose 6-phosphate
ME898857
5958
C00092
7.84
-
Glucose 71
Glucose
ME898822
5793
C00031
6.16
-
Glucose 89
Glucose
ME898825
5793
C00031
6.15
-
Glutamic 102
Glutamic acid
ME898790
33032
C00025
6.28
-
Glutamic 128
Glutamic acid
ME898791
33032
C00025
6.29
-
Glycerol 1-phosphate 79
sn-Glycero-3-phosphate
ME898807
-
-
6.08
-
Glycerol 2-phosphate 79
sn-Glycero-2-phosphate
ME898808
2526
C02979
6.31
-
Glycerol 3-phosphate 79
sn-Glycero-3-phosphate
ME898809
439162
C00093
6.65
-
Glyoxylic 45
Glyoxylic acid
ME898746
760
C00048
3.07
-
GMP 79
GMP
ME898875
135398631
C00144
7.65
-
GSSG 179
Oxidized glutathione
ME898891
65359
C00127
8.08
-
GSSG 306
Oxidized glutathione
ME898890
65359
C00127
8.08
-
HEPES 107
HEPES
ME898848
23831
-
3.96
-
HEPES 80
HEPES
ME898847
23831
-
4.1
-
Hippuric 134
Hippuric acid
ME898820
464
C01586
1.7
-
HMG-CoA 408
3-Hydroxy-3-methylglutaryl-CoA
ME898918
445127
C00356
7.34
-
HMG-CoA 426
3-Hydroxy-3-methylglutaryl-CoA
ME898919
445127
C00356
7.22
-
Homocysteic 80
Homocysteic acid
ME898831
177491
C16511
7.28
-
IMP 79
IMP
ME898872
135398640
C00130
5.86
-
Indole-3-carboxylic 116
Indole-3-carboxylic acid
ME898796
69867
C19837
2.96
-
Isocitric 117
Isocitric acid
ME898837
1198
C00311
8.99
-
Isocitric 73
Isocitric acid
ME898836
1198
C00311
8.99
-
Itaconic 41
Itaconic acid
ME898775
811
C00490
6.87
-
Itaconic 85
Itaconic acid
ME898774
811
C00490
6.81
-
Ketoglutaric 101
2-Oxoglutaric acid
ME898787
51
C00026
6.97
-
Ketoglutaric 57
2-Oxoglutaric acid
ME898788
51
C00026
6.96
-
Lactic 71
Lactic acid
ME898752
612
C01432
3.1
-
Lactic 87
Lactic acid
ME898751
612
C01432
3.1
-
Lauroyl-CoA 408
Lauroyl-CoA
ME898920
165436
C01832
2.62
-
Lipoic 137
Lipoic acid
ME898842
6112
C16241
1.7
-
Lipoic 171
Lipoic acid
ME898841
6112
C16241
1.69
-
Maleic 27
Maleic acid
ME898762
444266
C01384
-
-
Maleic 71
Maleic acid
ME898761
444266
C01384
3.26
-
Malic 115
Malic acid
ME898782
222656
C00149
7.32
-
Malic 71
Malic acid
ME898783
222656
C00149
7.32
-
Malonic 59
Malonic acid
ME898754
867
C00383
6.8
-
Malonyl-CoA 408
Malonyl-CoA
ME898915
644066
C00083
7.83
-
Malonyl-CoA 426
Malonyl-CoA
ME898916
644066
C00083
7.83
-
Mannitol 89
Mannitol
ME898828
6251
C00392
5.79
-
Mannose 59
Mannose
ME898826
18950
C00159
6.07
-
Mannose 95
Mannose
ME898827
18950
C00159
6.07
-
Methylcrotonyl-CoA 408
2-Methylcrotonoyl-CoA
ME898914
6443760
C03345
6.2
-
Methylcrotonyl-CoA 79
2-Methylcrotonoyl-CoA
ME898913
6443760
C03345
6.27
-
Methylmalonic 55
Methylmalonic acid
ME898766
487
C02170
6.09
-
Methylmalonic 73
Methylmalonic acid
ME898767
487
C02170
6.09
-
Mevalonate pyrophosphate 79
-
ME898862
439418
C01143
7.58
-
myo-Inositol 161
Myo-inositol
ME898823
892
C00137
7.57
-
Myristic PAR
Myristic acid
ME898845
11005
C06424
1.36
-
Myristoyl-CoA 408
Myristoyl-CoA
ME898923
11966124
C02593
2.64
-
N-Acetylcysteine 120
N-Acetylcysteine
ME898798
12035
C06809
2.71
-
N-Acetylcysteine 84
N-Acetylcysteine
ME898797
12035
C06809
2.55
-
N-Acetylglycine 74
N-Acetylglycine
ME898763
10972
-
3.41
-
N-Acetyl-L-aspartic 156
-
ME898814
65065
C01042
6.48
-
N-Acetyl-L-aspartic 88
-
ME898813
65065
C01042
6.44
-
N-Acetylleucine 130
N-Acetylleucine
ME898810
70912
C02710
1.66
-
NAD+ 273
NAD
ME898893
5892
C00006
6.04
-
NAD+ 540
NAD
ME898892
5892
C00006
6.02
-
NADH 335
NADH
ME898895
439153
C00004
5.84
-
NADH 408
NADH
ME898894
439153
C00004
5.84
-
NADP+ 134
NADP
ME898897
5886
C00006
7.93
-
NADP+ 408
NADP
ME898898
5886
C00006
7.9
-
NADP+ 620
NADP
ME898896
5886
C00006
7.87
-
NADPH 328
NADPH
ME898900
5884
C00005
8.25
-
NADPH 408
NADPH
ME898899
5884
C00005
8.2
-
N-Formylleucine 114
-
ME898795
9880216
-
1.69
-
O-Acetylserine 116
O-Acetylserine
ME898789
99478
C00979
3.8
-
Octanoic PAR
-
ME898786
379
C06423
1.48
-
Oleoyl-CoA (18:1) 79
-
ME898926
5497111
C00510
2.65
-
O-Phospho-L-serine 79
Phosphoserine
ME898833
68841
C01005
7.59
-
O-Phospho-L-serine 97
Phosphoserine
ME898832
68841
C01005
7.72
-
Orotic 111
Orotic acid
ME898793
967
C00295
3.59
-
Orotic 67
Orotic acid
ME898794
967
C00295
3.58
-
Oxalic 61
Oxalic acid
ME898750
971
C00209
8.37
-
Oxaloacetic 87
Oxaloacetic acid
ME898776
970
C00036
7.82
-
Palmitic PAR
Palmitic acid
ME898854
985
C00249
1.38
-
Palmitoleic PAR
Palmitoleic acid
ME898853
445638
C08362
1.36
-
Palmitoleyl-CoA (16:1) 79
-
ME898924
25244394
C21072
2.67
-
Palmitoyl-CoA (16:0) 79
-
ME898925
644109
C00154
2.52
-
Pemetrexed 297
-
ME898883
135410875
D07472
5.84
-
Pemetrexed 321
-
ME898884
135410875
D07472
-
-
Penicillin G 289
Penicillin G
ME898863
5904
C05551
2.65
-
PEP 79
Phosphoenolpyruvic acid
ME898802
1005
C00074
8.43
-
Phenol Red 195
Phenolsulfonphthalein
ME898874
4766
C12600
1.69
-
Phenol Red 93
Phenolsulfonphthalein
ME898873
4766
C12600
1.71
-
Phenylalanine 147
Phenylalanine
ME898799
6140
C00079
3.74
-
Phenylalanine 72
Phenylalanine
ME898800
6140
C00079
3.74
-
Phenyllactic 147
Phenyllactic acid
ME898801
643327
C05607
1.69
-
Phosphocreatine 79
Phosphocreatine
ME898843
9548602
C02305
6.84
-
Propionic PAR
Propionic acid
ME898747
1032
C00163
3.1
-
Propionyl-CoA 408
Propionyl-CoA
ME898910
92753
C00100
5.24
-
Pyroglutamic 82
Pyroglutamic acid
ME898772
7405
C01879
3.57
-
Pyruvic 32
Pyruvic acid
ME898748
1060
C00022
2.87
-
Riboflavin 243
Riboflavin
ME898877
493570
C00255
2.96
-
S-2-hydroxyisocaproic 113
-
ME898779
83697
C03264
1.73
-
S-2-hydroxyisocaproic 85
-
ME898778
83697
C03264
1.67
-
Saccharin 42
Saccharin
ME898830
5143
C12283
1.55
-
Sorbitol 71
Sorbitol
ME898829
5780
C00794
5.79
-
Stearic PAR
Stearic acid
ME898859
5281
C01530
1.44
-
Succinic 73
Succinic acid
ME898764
1110
C00042
6.74
-
Succinic 99
Succinic acid
ME898765
1110
C00042
6.74
-
Succinyl-CoA 408
Succinyl-CoA
ME898917
92133
C00091
7.54
-
Sucrose 89
Sucrose
ME898868
5988
C00089
6.69
-
Sunset Yellow 2- 171
-
ME898840
17730
-
2.91
-
Tartrazine 2- 211
-
ME898846
164825
C07574
9.76
-
Taurine 80
Taurine
ME898769
1123
C00245
6.39
-
Trehalose 59
Trehalose
ME898869
7427
C01083
7.02
-
UDP 111
UDP
ME898879
6031
C00015
7.76
-
UDP 79
UDP
ME898880
6031
C00015
7.77
-
UDP-glucose 273
UDP-glucose
ME898888
8629
C00029
7.49
-
UDP-glucose 323
UDP-glucose
ME898887
8629
C00029
7.49
-
UDP-N-acetyl-D-glucosamine 79
UDP-N-acetylglucosamine
ME898889
445675
C00043
6.77
-
Uric 124
Uric acid
ME898803
1175
C00366
5.1
-
Uric 96
Uric acid
ME898804
1175
C00366
5.09
-
Uridine 111
Uridine
ME898851
6029
C00299
3.66
-
UTP 79
UTP
ME898886
6133
C00075
8.61
-
Valeric PAR
Valeric acid
ME898753
7991
C00803
1.72
-
Xanthine 108
Xanthine
ME898792
1188
C00385
4.32
-
Xanthosine 151
Xanthosine
ME898860
64959
C01762
4.93
-
Analysis: HILIC POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
3-Ureidopropionic 61
-
ME898976
111
C02642
4.57
-
3-Ureidopropionic 90 POS
-
ME898975
111
C02642
4.7
-
4-Imidazoleacetic 54
-
ME898961
96215
C02835
4.4
-
4-Imidazoleacetic 81 POS
-
ME898960
96215
C02835
4.4
-
5-Aminovaleric 83
-
ME898949
138
C00431
6.74
-
6-Aminocaproic 69
6-Aminocaproic acid
ME898969
564
C02378
6.25
-
Acetylcholine 87
Acetylcholine
ME898983
187
C01996
7.62
-
Acetyl-CoA 303
Acetyl-CoA
ME899099
444493
C00024
5.52
-
Acetyl-CoA 428
Acetyl-CoA
ME899100
444493
C00024
5.54
-
Adenine 119
Adenine
ME898979
190
C00147
3.35
-
Adenosylcobalamin 147
Adenosylcobalamin
ME899096
70678541
C00194
5.01
-
Adenosylcobalamin 341
Adenosylcobalamin
ME899097
70678541
C00194
5.11
-
ADP 136
ADP
ME899066
6022
C00008
7.04
-
ADP 97
ADP
ME899067
6022
C00008
7.04
-
Alanine 42
Alanine
ME898936
5950
C00041
6.3
-
Alanine 44
Alanine
ME898935
5950
C00041
6.32
-
AMP 136
AMP
ME899053
6083
C00020
5.85
-
Arginine 157
Arginine
ME898999
6322
C00062
13.01
-
Arginine 70
Arginine
ME898998
6322
C00062
13.01
-
Asparagine 87
Asparagine
ME898977
6267
C00152
6.67
-
Asymmetric dimethylarginine 70
Dimethylarginine
ME899016
123831
C03626
10.7
-
ATP 136
ATP
ME899083
5957
C00002
7.95
-
ATP 232
ATP
ME899084
5957
C00002
7.96
-
AZD3965 413
-
ME899085
-
-
1.62
-
beta-Alanine 30
beta-Alanine
ME898939
239
C00099
6.69
-
Betaine 58
Betaine
ME898950
247
C00719
4.26
-
Biotin 209 POS
Biotin
ME899034
171548
C00120
1.97
-
Biotin 227
Biotin
ME899033
171548
C00120
2.21
-
Caffeine 135
Caffeine
ME899015
2519
C07481
1.8
-
Caffeine 138
Caffeine
ME899014
2519
C07481
1.54
-
Carnitine 102
Carnitine
ME898994
10917
C00318
5.37
-
Carnitine 85
Carnitine
ME898993
10917
C00318
5.37
-
Carnosine 110
Carnosine
ME899027
439224
C00386
6.94
-
Carnosine 210
Carnosine
ME899028
439224
C00386
6.95
-
Cerulenin 207
Cerulenin
ME899025
5282054
C12058
1.53
-
Cerulenin 89
Cerulenin
ME899026
5282054
C12058
1.54
-
Choline 60
Choline
ME898942
305
C00114
10.2
-
Citraconic 113
Citraconic acid
ME898965
643798
C02226
3
-
Citrulline 113
Citrulline
ME899002
9750
C00327
7.02
-
Citrulline 70
Citrulline
ME899001
9750
C00327
7.02
-
Creatine 114
Creatine
ME898968
586
C00300
6.25
-
Creatine 90
Creatine
ME898967
586
C00300
6.25
-
Creatinine 86
Creatinine
ME898945
588
C00791
4.29
-
Cyanocobalamin 147
Cyanocobalamin
ME899094
5311498
C02823
4.31
-
Cyanocobalamin 457
Cyanocobalamin
ME899095
5311498
C02823
4.35
-
Cysteine 76
Cysteine
ME898954
5862
C00097
6.08
-
Cysteine PAR POS
Cysteine
ME898953
5862
C00097
6.02
-
Cytidine 112
Cytidine
ME899032
6175
C00475
4.75
-
Deoxycytidine 112
Deoxycytidine
ME899029
13711
C00881
3.97
-
Deoxyguanosine 152
Deoxyguanosine
ME899039
135398592
C00330
4.41
-
Diethylsuccinate 101
-
ME898997
31249
-
1.47
-
Dimethylmalonate 101
Dimethylmalonic acid
ME898974
7943
-
1.61
-
DMSO 64
Dimethyl sulfoxide
ME898934
679
C11143
2.29
-
Doxycycline 321
Doxycycline
ME899077
54671203
C06973
2.55
-
Ethanolamine 29
Ethanolamine
ME898929
700
C00189
11.86
-
Ethanolamine 44
Ethanolamine
ME898928
700
C00189
11.86
-
Fasnall 218
-
ME899050
16230362
-
1.72
-
Folic 295
Folic acid
ME899076
135398658
C00504
7.63
-
Formyl-CoA 428
-
ME899098
3082032
C00798
5.95
-
GABA 87
gamma-Aminobutyric acid
ME898940
119
C00334
6.7
-
Glucosamine 84
Glucosamine
ME899003
439213
C00329
6.16
-
Glutamine 101
Glutamine
ME898985
5961
C00064
6.56
-
Glutamine 84
Glutamine
ME898984
5961
C00064
6.56
-
Glycine 30
Glycine
ME898931
750
C00037
6.9
-
Glycine 48
Glycine
ME898932
750
C00037
6.9
-
GSH 290
Glutathione
ME899046
124886
C00051
6.05
-
GSH 76
Glutathione
ME899045
124886
C00051
6.05
-
GSK2194069 344
-
ME899069
67376285
-
1.44
-
Guanine 135
Guanine
ME898989
135398634
C00242
5.23
-
Guanosine 152
Guanosine
ME899042
135398635
C00387
5.26
-
Histidine 110 POS
Histidine
ME898990
6274
C00135
6.28
-
Histidine 83
Histidine
ME898991
6274
C00135
6.27
-
Hypoxanthine 110
Hypoxanthine
ME898980
135398638
C00262
3.81
-
Hypoxanthine 67
Hypoxanthine
ME898981
135398638
C00262
3.81
-
Imidazole 42
Imidazole
ME898930
795
C01589
2.62
-
Inosine 137
Inosine
ME899040
135398641
C00294
4.26
-
Isoleucine 58
Isoleucine
ME898971
6306
C00407
4.34
-
Isoleucine 69
Isoleucine
ME898970
6306
C00407
4.34
-
Kynurenic 144 POS
Kynurenic acid
ME899009
3845
C01717
1.75
-
Kynurenic 162
Kynurenic acid
ME899010
3845
C01717
1.74
-
Kynurenine 164
Kynurenine
ME899022
846
C01718
4.23
-
Kynurenine 94
Kynurenine
ME899021
846
C01718
4.19
-
Leucine 27
Leucine
ME898973
6106
C00123
4.1
-
Leucine 43
Leucine
ME898972
6106
C00123
4.11
-
LW6 135
-
ME899072
16124726
-
1.84
-
LW6 180
-
ME899073
16124726
-
1.53
-
Lysine 84
Lysine
ME898986
5962
C00047
12.41
-
Malonyl-CoA 303
Malonyl-CoA
ME899101
644066
C00083
7.96
-
Malonyl-CoA 428
Malonyl-CoA
ME899102
644066
C00083
7.86
-
Methionine 104
Methionine
ME898987
6137
C00073
4.52
-
Methionine 61
Methionine
ME898988
6137
C00073
4.52
-
Methotrexate 134
Methotrexate
ME899080
126941
C01937
-
-
Methotrexate 308
Methotrexate
ME899079
126941
C01937
4.87
-
Methylcobalamin 147
Methylcobalamin
ME899092
123134034
C06410
9.03
-
Methylcobalamin 636
Methylcobalamin
ME899093
123134034
C06410
-
-
Myristoyl-CoA 428
Myristoyl-CoA
ME899104
11966124
C02593
1.52
-
N-Acetyl-L-methionine 133
N-Acetylmethionine
ME899013
448580
C02712
1.8
-
N-Acetyl-L-methionine 144
N-Acetylmethionine
ME899012
448580
C02712
1.74
-
NAD+ 428
NAD
ME899089
5892
C00006
6.02
-
NAD+ 524
NAD
ME899088
5892
C00006
6.02
-
NADH 348
NADH
ME899091
439153
C00004
5.85
-
NADH 649
NADH
ME899090
439153
C00004
6.02
-
N-alpha-Acetyllysine 84
N(2)-Acetyllysine
ME899006
192590
C12989
6.41
-
Ne_Ne-Dimethyllysine 84
-
ME899000
193344
-
10.53
-
N-epsilon-Acetyllysine 126
N6-Acetyllysine
ME899007
92832
C02727
5.24
-
N-epsilon-Methyllysine 144
N(6)-Methyllysine
ME898992
164795
C02728
11.75
-
Niaciamide 106
-
ME898957
936
C00153
2.54
-
Niaciamide 80
-
ME898956
936
C00153
2.54
-
N,N-Dimethylglycine 58
Dimethylglycine
ME898941
673
C01026
4.81
-
N,N,N-Trimethyllysine 84
N-6-Trimethyllysine
ME899008
440120
C03793
10.88
-
O-Acetylcarnitine 145
CAR 2:0
ME899018
7045767
C02571
4.08
-
O-Acetylcarnitine 85
CAR 2:0
ME899017
7045767
C02571
4.09
-
O-Acyl(17:1)carnitine 85
CAR 17:1
ME899063
-
-
1.61
-
O-Butyrylcarnitine 85
CAR 4:0
ME899030
213144
C02862
2.87
-
O-Caproylcarnitine 85
CAR 6:0
ME899037
3246938
-
1.77
-
O-Caprylcarnitine 85
CAR 10:0
ME899047
11953821
C03299
1.69
-
O-Caprylylcarnitine 85
CAR 8:0
ME899043
11953814
C02838
1.73
-
Octanoyl-CoA 428
Octanoyl-CoA
ME899103
445344
C01944
1.46
-
O-Enanthylcarnitine 85
CAR 7:0
ME899041
42265
-
2.09
-
O-Erucioyl-L-carnitine 85
-
ME899082
6441570
-
1.53
-
O-Formyl-L-carnitine 145
-
ME899011
-
-
4.64
-
O-Lauroleoylcarnitine 85
CAR 12:1
ME899051
156961751
-
1.65
-
O-Lauroylcarnitine 85
CAR 12:0
ME899052
168381
-
1.63
-
O-Malonylcarnitine 85
CAR DC3:0
ME899036
91825606
-
5.29
-
O-Margaroylcarnitine 85
CAR 17:0
ME899064
145720489
-
1.6
-
O-Myristoleoylcarnitine 85
CAR 14:1
ME899055
53477791
-
1.61
-
O-Myristoylcarnitine 85
CAR 14:0
ME899056
53477791
-
1.59
-
O-Oleoylcarnitine 85
CAR 18:1
ME899065
46907933
-
1.52
-
O-Palmitoleoylcarnitine 85
CAR 16:1
ME899061
156908005
-
1.56
-
O-Palmitoylcarnitine 85
CAR 16:0
ME899062
11953816
C02990
1.55
-
O-Paullinoyl-L-carnitine 85
-
ME899078
71464507
-
1.53
-
O-Pelargonylcarnitine 85
CAR 9:0
ME899044
42281
-
1.72
-
O-Pentadecyloylcarnitine 85
CAR 15:0
ME899059
93684
-
1.65
-
O-Propionylcarnitine 85
CAR 3:0
ME899023
4485
C03017
2.54
-
Ornithine 70
Ornithine
ME898978
6262
C00077
11.82
-
O-Stearoylcarnitine 85
CAR 18:0
ME899068
3006797
-
1.51
-
O-Tridecyloylcarnitine 85
CAR 13:0
ME899054
3072472
-
1.69
-
O-Undecyloylcarnitine 85
CAR 11:0
ME899048
42294
-
1.69
-
O-Valerylcarnitine 85
CAR 5:0
ME899035
6426903
-
1.91
-
pABA 120
p-Aminobenzoic acid
ME898982
978
C00568
3.81
-
Pantothenic 202
Pantothenic acid
ME899024
6613
C00864
2.65
-
Penicillin G 289 POS
Penicillin G
ME899049
5904
C05551
2.66
-
Picolinic 96
Picolinic acid
ME898959
1018
C10164
2.67
-
Picolinic/Nicotinic 78 POS
-
ME898958
1018
C10164
2.68
-
Pipecolinic 84
-
ME898964
849
C00408
4.93
-
Proline 70
Proline
ME898946
145742
C00148
5.15
-
Puro Heavy 121
-
ME899081
439530
C01610
1.56
-
Pyridoxine 134
Pyridoxine
ME898996
1054
C00314
2.74
-
Pyridoxine 152
Pyridoxine
ME898995
1054
C00314
2.73
-
Pyroglutamic 84
Pyroglutamic acid
ME898963
7405
C01879
3.62
-
Rotenone 213
Rotenone
ME899060
6758
C07593
1.37
-
Sarcosine 30
Sarcosine
ME898938
1088
C00213
5.89
-
Sarcosine 44
Sarcosine
ME898937
1088
C00213
5.88
-
Serine 60
Serine
ME898943
5951
C00065
6.95
-
Thiamine 122
Thiamine
ME899038
1130
C00378
10.37
-
Threonine 102
Threonine
ME898952
6288
C00188
6.1
-
Threonine 74 POS
Threonine
ME898951
6288
C00188
6.1
-
Thymidine 127
Thymidine
ME899031
5789
C00214
2.54
-
Thymine 84
Thymine
ME898962
1135
C00178
2.55
-
trans-4-Hydroxyproline 68
trans-4-Hydroxyproline
ME898966
5810
C01157
6.15
-
Trimethylamine N-oxide 59
Trimethylamine N-oxide
ME898933
1145
C01104
3.99
-
Tris 56
-
ME898955
6503
C07182
1.68
-
Tryptophan 118
Tryptophan
ME899020
6305
C00078
4.64
-
Tryptophan 146
Tryptophan
ME899019
6305
C00078
4.64
-
TVB-2640 386
-
ME899075
66548316
-
-
-
TVB-2640 412
-
ME899074
66548316
-
1.48
-
TVB-3166 116
-
ME899057
72947731
-
1.4
-
TVB-3166 342
-
ME899058
72947731
-
1.39
-
Tyrosine 123
Tyrosine
ME899005
6057
C00082
5.42
-
Tyrosine 136
Tyrosine
ME899004
6057
C00082
5.41
-
Uracil 70
Uracil
ME898944
1174
C00106
2.51
-
Urea 44
Urea
ME898927
1176
C00086
4.05
-
Valine 55
Valine
ME898948
6287
C00183
4.98
-
Valine 72
Valine
ME898947
6287
C00183
4.98
-
VY-3-135 355
-
ME899071
-
-
1.49
-
VY-3-135 412
-
ME899070
-
-
1.49
-
VY-7-137 233
-
ME899087
-
-
1.47
-
VY-7-137 508
-
ME899086
-
-
1.5
-
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