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Return to study ST000953 main page
Analysis: Reversed phase POSITIVE ION MODE (
View original submitter results
)
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
1,3-DIAMINOPROPANE
1,3-Diaminopropane
ME236172
428
-
0.59
75.0920
1-AMINOCYCLOPROPANE-1-CARBOXYLATE
1-Aminocyclopropanecarboxylic acid
ME236173
535
-
0.77
102.0550
2-hydroxyglutarate
2-Hydroxyglutaric acid
ME236164
43
-
1.55
149.0434
2-hydroxyglutarate+Na
2-Hydroxyglutaric acid
ME236165
-
-
1.54
171.0257
2-hydroxyglutarate-water_R1
-
ME236166
-
-
1.54
131.0335
2-hydroxyglutarate-water_R2
-
ME236167
-
-
1.61
131.0336
2-Phenylglycine
2-Phenylglycine
ME236168
3866
-
7.83
152.0699
3,4-DIHYDROXY-L-PHENYLALANINE
DOPA
ME236169
6047
-
2.32
198.0749
3-HYDROXYKYNURENINE
Hydroxykynurenine
ME236162
89
-
3.19
225.0858
3-UREIDOPROPIONATE
Ureidopropionic acid
ME236163
111
-
1.24
133.0611
4-AMINOBUTANOATE (GABA)_R1
gamma-Aminobutyric acid
ME236155
119
-
0.92
104.0707
4-AMINOBUTANOATE (GABA)_R2
gamma-Aminobutyric acid
ME236156
119
-
0.80
104.0707
4-GUANIDINOBUTANOATE
4-Guanidinobutanoic acid
ME236157
500
-
1.59
146.0918
4-HYDROXY-L-PHENYLGLYCINE_R1
4-Hydroxyphenylglycine
ME236158
36143
-
0.96
168.0641
4-HYDROXY-L-PHENYLGLYCINE_R2
4-Hydroxyphenylglycine
ME236159
36143
-
0.77
168.0642
4-IMIDAZOLEACETIC ACID
Imidazoleacetic acid
ME236160
96215
-
0.97
127.0498
5,6-DIHYDROURACIL
Dihydrouracil
ME236161
649
-
1.33
115.0500
5-AMINOLEVULINIC ACID_R1
5-Amino-levulinic acid
ME236145
137
-
0.74
132.0650
5-AMINOLEVULINIC ACID_R2
5-Amino-levulinic acid
ME236146
137
-
0.84
132.0650
5-AMINOLEVULINIC ACID_R3
5-Amino-levulinic acid
ME236147
137
-
0.98
132.0650
5-hydroxyindoleacetic acid
5-Hydroxyindoleacetic acid
ME236148
1826
-
6.53
192.0646
5-HYDROXY-L-TRYPTOPHAN_R1
5-Hydroxy-tryptophan
ME236149
144
-
6.82
221.0908
5-HYDROXY-L-TRYPTOPHAN_R2
5-Hydroxy-tryptophan
ME236150
144
-
6.73
221.0907
5-HYDROXY-L-TRYPTOPHAN_R3
5-Hydroxy-tryptophan
ME236151
144
-
6.91
221.0911
5-Hydroxymethyl-2-furaldehyde
5-Hydroxymethyl-2-furancarboxaldehyde
ME236152
237332
-
0.76
127.0386
5-Hydroxy-N-formylkynurenine
5-Hydroxy-N-formylkynurenine
ME236153
440744
-
11.17
253.0810
5-OXO-L-PROLINE
Pyroglutamic acid
ME236154
7405
-
1.81
130.0495
6C-SUGAR ALCOHOL
-
ME236140
-
-
0.74
205.0672
6-DEOXY-HEXOSE_R1
-
ME236141
-
-
0.95
187.0568
6-DEOXY-HEXOSE_R2
-
ME236142
-
-
0.87
187.0569
6-Quinolincarboxylic Acid
1-Nitronaphthalene
ME236143
6849
-
7.96
174.0543
7-(b-Hydroxyethyl)theophylline
-
ME236144
1892
-
7.79
225.0980
Acetaminophen/Paracetamol_R1
Acetaminophen
ME235985
1983
-
7.06
152.0697
Acetaminophen/Paracetamol_R2
Acetaminophen
ME235986
1983
-
7.11
152.0699
ADENOSINE
Adenosine
ME235987
60961
-
5.67
268.1027
AGMATINE SULFATE
Agmatine
ME235988
199
-
0.67
131.1287
ALANINE/SARCOSINE
Alanine/Sarcosine
ME235989
-
-
0.74
90.0551
ALDO/KETO-HEXOSE
Hexose
ME235990
-
-
0.74
203.0516
ALDOPENTOSE
Aldopentose
ME235991
-
-
0.91
173.0418
ALLANTOIN
Allantoin
ME235992
204
-
0.82
159.0506
Allopurinol
Allopurinol
ME235993
2094
-
6.15
137.0453
ALPHA-AMINOADIPATE/N-METHYL-L-GLUTAMATE
-
ME235994
-
-
0.90
162.0756
Anthranilate
2-Aminobenzoic acid
ME235995
227
-
8.67
120.0441
ASPARTATE_R1
Aspartic acid
ME235996
5960
-
0.72
134.0444
ASPARTATE_R2
Aspartic acid
ME235997
5960
-
0.85
134.0444
BOC-D-Phenylalanine_R1
-
ME235998
-
-
11.46
166.0856
BOC-D-Phenylalanine_R2
-
ME235999
-
-
11.46
288.1192
BOC-L-Tyrosine
Tyrosine
ME236000
117439
-
-
182.0804
BUTYROBETAINE
3-Dehydroxycarnitine
ME236001
725
C01181
1.27
146.1170
Butyrylcarnitine
CAR 4:0
ME236002
213144
-
7.49
232.1530
C5-SUGAR ALCOHOL
Dihydroxyquinoline
ME236003
-
-
0.71
175.0574
Caffeine-D3
Caffeine
ME236004
13001298
-
7.92
198.1057
CARNOSINE_R1
Carnosine
ME236005
439224
-
0.71
227.1127
CARNOSINE_R2
Carnosine
ME236006
439224
-
0.84
227.1126
Choline
Choline
ME236007
305
-
0.84
104.107
Citrate+Na
Citric acid
ME236011
-
-
1.93
215.0152
Citrate+NH3
Citric acid
ME236012
-
-
1.93
210.0599
Citrate source fragment (+H and + NH3)
-
ME236008
-
-
1.94
129.0192
Citrate source fragment (+NH3)_R1
-
ME236009
-
-
1.93
175.0230
Citrate source fragment (+NH3)_R2
-
ME236010
-
-
1.93
157.0127
CITRULLINE
Citrulline
ME236013
9750
-
0.78
176.1024
CMP
CMP
ME236014
6131
-
1.04
324.0575
CREATINE
Creatine
ME236015
586
-
1.00
132.0764
Creatine-D3_R1
Creatine
ME236016
-
-
0.90
135.0951
Creatine-D3_R2
Creatine
ME236017
-
-
0.90
157.0772
CYTIDINE
Cytidine
ME236018
6175
-
1.58
244.0919
CYTIDINE 2',3'-CYCLIC MONO-PHOS-PHATE
2',3' cyclic CMP
ME236019
53481030
-
1.08
306.0471
CYTIDINE 5'-DIPHOSPHOCHOLINE
CDP-choline
ME236020
13804
-
0.90
489.1125
CYTOSINE_R1
Cytosine
ME236021
597
-
0.86
112.0504
CYTOSINE_R2
Cytosine
ME236022
597
-
1.04
112.0504
D-(+)-GALACTOSAMINE
Galactosamine
ME236023
24154
-
0.68
202.0677
D-GLUCOSAMINE 6-PHOSPHATE
Glucosamine 6-phosphate
ME236025
440997
-
0.73
260.0517
Dimer of Lactose
-
ME236026
-
-
0.79
707.2189
DL-5-HYDROXYLYSINE
5-Hydroxylysine
ME236027
1029
-
0.63
163.1070
DOPAMINE
Dopamine
ME236028
681
-
2.87
154.0851
D-(+)-RAFFINOSE
Raffinose
ME236024
439242
-
0.87
527.1557
D-Ribose
Ribose
ME236029
10975657
-
0.84
173.0414
Ergothioneine
Ergothioneine
ME236030
5351619
-
1.09
231.0993
ETHANOLAMINE PHOSPHATE
Phosphoethanolamine
ME236031
1015
-
0.70
142.0258
Formyl-5-hydroxykynurenamine
Formyl-5-hydroxykynurenamine
ME236032
440743
-
11.17
209.0910
Formylkynurenine_R1
N-Formyl-L-kynurenine
ME236033
910
-
10.71
237.0859
Formylkynurenine_R2
N-Formyl-L-kynurenine
ME236034
910
-
10.63
237.0860
GLUCONIC ACID/D-GULONIC ACID GAMA-LACTONE_R1
Gluconic acid/Gulonolactone
ME236035
-
-
0.76
219.0466
GLUCONIC ACID/D-GULONIC ACID GAMA-LACTONE_R2
Gluconic acid/Gulonolactone
ME236036
-
-
0.90
219.0469
GLUCOSAMINE/MANNOSAMINE
-
ME236037
-
-
0.74
180.0860
GLUCOSE/FRUCTOSE-PHOSPHATE
-
ME236038
-
-
0.75
283.0173
GLUTARATE
Glutaric acid
ME236039
743
-
4.67
155.0308
GLYCEROL
Glycerol
ME236040
753
-
0.77
115.0381
Glycerophosphocholine
sn-Glycero-3-phosphocholine
ME236041
71920
-
0.77
258.1089
GLYCINE
Glycine
ME236042
750
-
0.71
76.0397
Glycyl-L-leucine
Gly-Leu
ME236043
92843
-
6.51
189.1224
GUANIDINOACETATE
Guanidoacetic acid
ME236044
763
-
0.80
118.0605
HEXOSE-6-PHOSPHATE
Hexose 6-phosphate
ME236045
-
-
0.74
261.0356
HEXOSE-DISACCHARIDE_R1
Hexose disaccharide
ME236046
-
-
0.80
365.1035
HEXOSE-DISACCHARIDE_R2
Hexose disaccharide
ME236047
-
-
0.87
365.1036
HISTAMINE
Histamine
ME236048
774
-
0.62
112.0868
HYPOXANTHINE
Hypoxanthine
ME236049
790
-
2.01
137.0453
Isobutyrylcarnitine
CAR 3:0;2Me
ME236050
10177002
-
7.41
232.1530
ISOCITRIC ACID_R1
Isocitric acid
ME236051
1198
-
1.06
215.0151
ISOCITRIC ACID_R2
Isocitric acid
ME236052
1198
-
1.20
215.0151
Isocytosine
2-Amino-4-hydroxypyrimidine
ME236053
66950
-
1.58
112.0504
Kynurenic Acid
Kynurenic acid
ME236054
3845
-
7.76
190.0491
Lactose
Lactose
ME236057
84571
-
0.79
343.1216
Lactose+K
Lactose
ME236058
-
-
0.80
381.0774
L-ALLOTHREONINE
Allothreonine
ME236059
99289
-
0.73
142.0472
L-ARGININE
Arginine
ME236060
6322
-
0.70
175.1182
L-ASPARAGINE
Asparagine
ME236061
6267
-
0.71
133.0606
L-CARNITINE
Carnitine
ME236062
10917
-
0.96
162.1117
L-CYSTATHIONINE_R1
Cystathionine
ME236063
439258
-
0.69
223.0735
L-CYSTATHIONINE_R2
Cystathionine
ME236064
439258
-
0.85
223.0734
L-CYSTEINE
Cysteine
ME236065
5862
-
0.76
122.0268
L-Cystine
Cystine
ME236066
67678
-
0.69
241.0303
Leu Pro_R1
Leu-Pro
ME236067
-
-
7.30
229.1536
Leu Pro_R2
Leu-Pro
ME236068
-
-
7.17
229.1536
L-GLUTAMINE
Glutamine
ME236069
5961
-
0.73
147.0757
L-HISTIDINE
Histidine
ME236070
6274
-
0.69
156.0762
L-Isoleucine
Isoleucine
ME236071
6306
-
2.22
132.1015
L-KYNURENINE
Kynurenine
ME236072
161166
-
6.54
209.0911
LL-2,6-DIAMINOHEPTANEDIOATE_R1
2,6-Diaminopimelic acid
ME236073
439283
-
0.69
191.1015
LL-2,6-DIAMINOHEPTANEDIOATE_R2
2,6-Diaminopimelic acid
ME236074
439283
-
0.83
191.1017
L-(+)-Lactic Acid_R1
Lactic acid
ME236055
612
-
0.79
91.0391
L-(+)-Lactic Acid_R2
Lactic acid
ME236056
612
-
0.94
91.0392
L-LEUCINE
Leucine
ME236075
857
-
2.53
132.1015
L-Leucine 13C6
Leucine
ME236076
-
-
2.54
138.1215
L-LYSINE
Lysine
ME236077
5962
-
0.63
147.1122
L-METHIONINE
Methionine
ME236078
6137
-
1.40
150.0576
L-PROLINE
Proline
ME236079
145742
-
0.88
116.0704
L-SERINE
Serine
ME236080
5951
-
0.70
106.0498
Methionine Sulfoxide
Methionine sulfoxide
ME236081
847
-
0.78
166.0526
METHYL BETA-D-GALACTOSIDE
Methyl beta-D-galactoside
ME236082
94214
-
1.03
217.0665
N-Acetyl-Arginine
N-Acetylarginine
ME236084
67427
-
1.58
217.1286
N-ACETYL-DL-GLUTAMIC ACID
N-Acetylglutamic acid
ME236085
185
-
2.20
190.0701
N-ACETYL-DL-SERINE
N-Acetylserine
ME236086
352294
-
1.08
148.0600
N-ACETYLGLYCINE
N-Acetylglycine
ME236087
10972
-
1.19
140.0313
N-ACETYL-HEXOSAMINE
N-Acetylhexosamine
ME236088
-
-
0.85
244.0778
N-ACETYL-L-ASPARTIC ACID
N-Acetylaspartic acid
ME236089
65065
-
1.46
176.0545
N-ACETYLNEURAMINATE
N-Acetylneuraminic acid
ME236090
439197
-
0.82
310.1116
N-ACETYLPUTRESCINE
N-Acetylputrescine
ME236091
122356
-
1.11
131.1174
N-ALPHA-ACETYL-L-LYSINE
N(2)-Acetyllysine
ME236092
92907
-
1.06
189.1223
N-BOC-L-Aspartic Acid_R1
Aspartic acid
ME236093
-
-
-
134.0443
N-BOC-L-Aspartic Acid_R2
Aspartic acid
ME236094
-
-
-
256.0779
N-BOC-L-tert-Leucine
-
ME236095
2734668
-
10.91
132.1014
N-BOC-L-Tryptophan
Tryptophan
ME236096
83169
-
-
205.0963
NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE
N-6-Trimethyllysine
ME236097
440120
-
0.71
189.1588
NICOTINAMIDE
Niacinamide
ME236098
936
-
1.60
123.0551
NICOTINAMIDE MONONUCLEOTIDE
Nicotinamide ribotide
ME236099
14180
-
1.08
335.0622
N-METHYL-D-ASPARTIC ACID
N-Methyl-D-aspartic acid
ME236100
22880
-
0.76
148.0599
N(PAI)-METHYL-L-HISTIDINE
3-Methylhistidine
ME236083
64969
-
0.72
170.0916
ORNITHINE
Ornithine
ME236101
6262
-
0.63
133.0967
Orthophosphate
Phosphoric acid
ME236102
1061
-
0.77
98.9842
Pantothenic Acid
Pantothenic acid
ME236103
6613
-
6.67
220.1170
PEG n5
Pentaethylene glycol
ME236104
62551
-
7.09
261.1297
Phenylalanine
Phenylalanine
ME236105
6140
-
6.29
166.0854
Phenylalanine-HCOOH
-
ME236106
-
-
6.32
120.0805
PHOSPHOCHOLINE_R1
Choline phosphate
ME236108
1014
-
0.73
184.0726
PHOSPHOCHOLINE_R2
Choline phosphate
ME236109
1014
-
0.91
184.0719
PHOSPHO(ENOL)PYRUVIC ACID
Phosphoenolpyruvic acid
ME236107
1005
-
0.99
168.9890
PICOLINIC ACID
Picolinic acid
ME236110
1018
-
1.33
124.0388
PIPECOLATE/L-PIPECOLIC ACID_R1
Pipecolic acid
ME236111
439227
-
1.22
130.0859
PIPECOLATE/L-PIPECOLIC ACID_R2
Pipecolic acid
ME236112
439227
-
1.28
130.0859
Proprionylcarnitine
CAR DC3:0
ME236113
107738
-
6.75
218.1378
PUTRESCINE
Putrescine
ME236114
1045
-
0.60
89.1076
PYRIDOXAL
Pyridoxal
ME236115
1050
-
1.87
168.0643
RIBOFLAVIN
Riboflavin
ME236116
493570
-
8.02
377.1438
(R)-MALATE
D-Malic acid
ME236170
92824
-
1.12
157.0104
SEROTONIN-NH3
Serotonin
ME236119
5202
-
6.91
160.0751
SEROTONIN_R1
Serotonin
ME236117
5202
-
6.84
177.1015
SEROTONIN_R2
Serotonin
ME236118
5202
-
6.92
177.1015
SN-GLYCEROL 3-PHOSPHATE
sn-Glycero-3-phosphate
ME236120
439162
-
0.74
173.0204
(S)-NICOTINE
Nicotine
ME236171
89594
-
5.87
163.1223
Source Fragment TRP
-
ME236121
-
-
7.68
118.0650
Stachydrine
Stachydrine
ME236122
115244
-
1.04
144.1014
STACHYOSE
Stachyose
ME236123
439531
-
0.94
689.2084
SUCCINATE
Succinic acid
ME236124
1110
-
2.30
141.0151
TAURINE
Taurine
ME236125
1123
-
0.72
126.0217
THIAMINE
Thiamine
ME236126
1130
C00378
1.32
265.1105
THREONINE/HOMOSERINE
Threonine/Homoserine
ME236127
-
-
0.73
120.0652
THYMINE
Thymine
ME236128
1135
-
3.29
127.0492
Trigonelline
Trigonelline
ME236129
5570
-
0.94
138.0536
Tryptophan
Tryptophan
ME236130
6305
-
7.69
205.0964
Tryptophan-2,3,3-D3
Tryptophan
ME236131
-
-
7.69
208.1152
Tryptophan-2,3,3-D3-NH3
Tryptophan
ME236132
-
-
7.68
191.0889
Tryptophan-NH3
Tryptophan
ME236133
-
-
7.69
188.0698
TYRAMINE
Tyramine
ME236134
5610
-
4.48
138.0908
URACIL
Uracil
ME236135
1174
-
1.38
113.0345
URATE
Uric acid
ME236136
1175
-
1.81
169.0347
URIDINE
Uridine
ME236137
6029
-
2.81
267.0575
URIDINE-5-MONOPHOSPHATE
UMP
ME236138
6030
-
1.23
325.0415
Xanthurenic Acid
Xanthurenic acid
ME236139
5699
-
7.52
206.0440
Analysis: Reversed phase NEGATIVE ION MODE (
View original submitter results
)
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
2,3-dihydroxyisovalerate
2,3-Dihydroxyisovaleric acid
ME236174
21933884
-
1.39
133.0502
2-AMINOETHYL DIHYDROGEN PHOSPHATE_R1
Phosphoethanolamine
ME236175
1015
-
0.7
140.0112
2-AMINOETHYL DIHYDROGEN PHOSPHATE_R2
Phosphoethanolamine
ME236176
1015
-
0.82
140.0111
2-hydroxyglutarate
2-Hydroxyglutaric acid
ME236177
43
-
1.53
147.0294
2-Hydroxyhippuric acid
Salicyluric acid
ME236178
10253
-
7.3
194.0452
3,4-DIHYDROXY-L-PHENYLALANINE
DOPA
ME236179
6047
-
2.33
196.061
3-HYDROXY-3-METHYLGLUTARATE
3-Hydroxymethylglutaric acid
ME236180
1662
-
3.01
161.0449
3-METHOXY-L-TYROSINE
3-Methoxytyrosine
ME236181
9307
-
6.02
210.0769
3-methyladipic acid
3-Methyladipic acid
ME236182
12292
-
7.88
159.0662
3-SULFINO-L-ALANINE_R1
3-Sulfino-alanine
ME236183
1549098
-
0.75
152.0018
3-SULFINO-L-ALANINE_R2
3-Sulfino-alanine
ME236184
1549098
-
0.81
152.0017
3-UREIDOPROPIONATE
Ureidopropionic acid
ME236185
111
-
1.23
131.0457
4-ACETAMIDOBUTANOATE
4-Acetamidobutanoic acid
ME236186
18189
-
3.75
144.0659
4-GUANIDINOBUTANOATE
4-Guanidinobutanoic acid
ME236187
500
-
1.58
144.0773
5-AMINOLEVULINIC ACID
5-Amino-levulinic acid
ME236188
137
-
0.8
130.0504
5-HYDROXY-L-TRYPTOPHAN
5-Hydroxy-tryptophan
ME236189
144
-
6.85
219.0766
6-Hydroxycaproic acid_R1
6-Hydroxycaproic acid
ME236190
14490
-
7.94
131.071
6-Hydroxycaproic acid_R2
6-Hydroxycaproic acid
ME236191
14490
-
7.87
131.071
6-Hydroxycaproic acid_R3
6-Hydroxycaproic acid
ME236192
14490
-
7.8
131.0711
6-PHOSPHOGLUCONIC ACID
6-Phosphogluconic acid
ME236193
91493
-
0.88
275.0198
ALDOPENTOSE
Aldopentose
ME236194
-
-
0.79
149.0455
ALLANTOIN
Allantoin
ME236195
204
-
0.81
157.0361
Arachidonic Acid (20:4)
Arachidonic acid
ME236196
444899
-
15.92
303.2318
ASCORBIC ACID-2H
Vitamin C
ME236197
54670067
-
0.89
173.0091
ASPARAGINE
Asparagine
ME236198
6267
-
0.7
131.0457
ASPARTATE
Aspartic acid
ME236199
83887
-
0.74
132.0299
BOC-L-Tyrosine_R1
Tyrosine
ME236200
-
-
-
206.045
BOC-L-Tyrosine_R2
Tyrosine
ME236201
-
-
-
280.1179
C12H22O11-DISACCHARIDE-(6C/6C; GLC-GLC/GLC-FRC/GAL...
-
ME236202
-
-
0.82
341.1075
C5-SUGAR ALCOHOL
Dihydroxyquinoline
ME236203
-
-
0.76
151.0606
C6H12O6-HEXOSE/KETOSE/INOSITOL
Hexose
ME236204
-
-
0.73
179.0554
CARNOSINE
Carnosine
ME236205
439224
-
0.71
225.0985
CITRAMALATE
Citramalic acid
ME236206
1081
-
2.23
147.0294
CITRATE
Citric acid
ME236207
311
-
1.92
191.019
CITRULLINE
Citrulline
ME236208
9750
-
0.78
174.0866
CMP
CMP
ME236209
6131
-
1.04
322.0432
Creatine-D3
Creatine
ME236210
-
-
0.9
133.0805
CYTIDINE 2',3'-CYCLIC MONO-PHOS-PHATE
2',3' cyclic CMP
ME236211
53481030
-
1.07
304.0331
D-GLUCOSAMINE 6-PHOSPHATE
Glucosamine 6-phosphate
ME236212
440997
-
0.72
258.0375
D-GLUCURONIC ACID/D-GLUCURONOLACTONE/D-(+)-GALACTU...
-
ME236213
-
-
0.77
193.0346
DIHYDROXYACETONE PHOSPHATE
Dihydroxyacetone phosphate
ME236214
668
-
0.73
168.99
DISACCHARIDE (6C/6C)/2-alpha-D-glucosyl-D-glucose
-
ME236215
-
-
0.79
377.0841
D-MANNOSAMINE
2-Amino-2-deoxy-D-mannose
ME236216
440049
-
0.68
178.0714
DOPAMINE
Dopamine
ME236217
681
-
2.85
152.0709
D-RIBOSE 5-PHOSPHATE/RIBULOSE 5-PHOSPHATE
Ribose
ME236218
-
-
0.72
229.0108
D-SACCHARIC ACID
Glucaric acid
ME236219
33037
-
0.73
209.0295
Eicosapentaenoic Acid
Eicosapentaenoic acid
ME236220
446284
-
15.29
301.2161
Erythrose 4-Phosphate
Erythrose 4-phosphate
ME236221
122357
C00279
0.75
198.9994
FERULATE
trans-Ferulic acid
ME236222
445858
-
8.47
193.0491
Fumaric Acid_R1
Fumaric acid
ME236223
-
C00122
2
115.003
Fumaric Acid_R2
Fumaric acid
ME236224
-
C00122
1.95
115.003
GLUCONIC ACID/D-GULONIC ACID GAMA-LACTONE
Gluconic acid/Gulonolactone
ME236225
-
-
0.76
195.0503
GLUCOSE/FRUCTOSE_R1
Hexose
ME236226
-
C00293/C01496
0.74
215.032
GLUCOSE/FRUCTOSE_R2
Hexose
ME236227
5793
-
0.74
217.0292
GLUTARATE
Glutaric acid
ME236228
743
-
4.68
131.0348
GLUTATHIONE
Glutathione
ME236229
124886
-
1.58
306.0753
Glyceraldehyde
Glyceraldehyde
ME236230
751
C02154
0.72
89.0236
GLYCERIC ACID
Glyceric acid
ME236231
439194
-
0.81
105.018
GLYCEROL 2-PHOSPHATE/SN-GLYCEROL 3-PHOSPHATE
Phosphoglyceric acid
ME236232
-
-
0.73
171.0055
GLYCOLATE
Glycolic acid
ME236233
757
-
0.87
75.0079
Guanosine
Guanosine
ME236234
6802
-
6.26
282.083
HOMOCYSTEINE
Homocysteine
ME236235
778
-
0.9
134.0279
ISOCITRIC ACID
Isocitric acid
ME236236
1198
-
1.13
191.0189
Kynurenic Acid
Kynurenic acid
ME236237
3845
-
7.74
188.0345
L-2-PHOSPHOGLYCERIC ACID
2-Phosphoglyceric acid
ME236238
439278
-
0.88
184.984
LACTATE
Lactic acid
ME236239
612
-
1.22
89.0236
LACTATE-dimer
-
ME236240
-
-
1.23
201.0369
L-ANSERINE
Anserine
ME236241
112072
-
0.84
239.1139
L-ARGININE
Arginine
ME236242
6322
-
0.69
173.1037
L-CARNITINE_R1
Carnitine
ME236243
10917
-
1.14
196.0721
L-CARNITINE_R2
Carnitine
ME236244
10917
-
1.02
196.0725
L-CYSTATHIONINE
Cystathionine
ME236245
439258
-
0.7
221.0593
L-CYSTEIC ACID
Cysteic acid
ME236246
72886
-
0.73
167.9966
L-CYSTEINE
Cysteine
ME236247
5862
-
0.86
120.0121
LEUCINE_R1
Leucine
ME236248
857
-
2.5
130.0867
LEUCINE_R2
Leucine
ME236249
857
-
2.7
130.0867
L-GLUTAMIC ACID
Glutamic acid
ME236250
33032
-
0.76
146.0453
L-GLUTAMINE
Glutamine
ME236251
5961
-
0.73
145.0613
L-HISTIDINE
Histidine
ME236252
6274
-
0.69
154.0616
L-ISOLEUCINE
Isoleucine
ME236253
6306
-
2.24
130.0867
LL-2,6-DIAMINOHEPTANEDIOATE
2,6-Diaminopimelic acid
ME236254
439283
-
0.84
189.0874
L-LYSINE
Lysine
ME236255
5962
-
0.67
145.0977
L-METHIONINE
Methionine
ME236256
6137
-
1.39
148.0432
L-Phenylalanine-13C6
Phenylalanine
ME236257
71309396
-
6.27
170.0912
L-SERINE
Serine
ME236258
5951
-
0.68
104.0347
L-TYROSINE
Tyrosine
ME236259
6057
-
3.38
180.0659
L-Tyrosine-13C6
Tyrosine
ME236260
12144755
-
3.38
186.0859
L-VALINE
Valine
ME236261
6287
-
1.11
116.071
LysoPC (18:1)
LPC 18:1
ME236262
-
-
13.75
566.3438
LysoPE (16:0)
LPE 16:0
ME236263
-
-
13.48
452.2762
LysoPE (18:1)
LPE 18:1
ME236264
-
-
13.46
478.2919
MALATE
Malic acid
ME236265
92824
-
1.08
133.0139
Mannitol
Mannitol
ME236266
6251
-
0.72
181.0707
METHYL BETA-D-GALACTOSIDE
Methyl beta-D-galactoside
ME236267
94214
-
1.04
193.0705
N-ACETYL-DL-GLUTAMIC ACID
N-Acetylglutamic acid
ME236268
185
-
2.19
188.0557
N-ACETYL-DL-SERINE
N-Acetylserine
ME236269
352294
-
1.02
146.0451
N-ACETYL-D-MANNOSAMINE
N-Acetyl-mannosamine
ME236270
439281
-
0.8
256.0585
N-ACETYLGLYCINE
N-Acetylglycine
ME236271
10972
-
1.2
116.0347
N-ACETYL-HEXOSAMINE
N-Acetylhexosamine
ME236272
-
-
0.83
220.0817
N-ACETYL-L-ALANINE
N-Acetylalanine
ME236273
88064
-
2.22
130.0503
N-ACETYL-L-ASPARTIC ACID
N-Acetylaspartic acid
ME236274
65065
-
1.48
174.0408
N-ACETYLNEURAMINATE
N-Acetylneuraminic acid
ME236275
439197
-
0.81
308.0957
NALPHA-ACETYL-L-LYSINE
N(2)-Acetyllysine
ME236276
92907
-
1.27
187.108
N-BOC-L-Aspartic Acid_R1
Aspartic acid
ME236277
-
-
-
232.0816
N-BOC-L-Aspartic Acid_R2
Aspartic acid
ME236278
-
-
-
158.0088
N-BOC-L-tert-Leucine_R1
-
ME236279
-
-
10.88
156.066
N-BOC-L-tert-Leucine_R2
-
ME236280
-
-
10.88
230.1388
N-BOC-L-Tryptophan_R1
Tryptophan
ME236281
-
-
-
303.1337
N-BOC-L-Tryptophan_R2
Tryptophan
ME236282
-
-
-
229.0608
N-formyl-L-methionine
N-Formylmethionine
ME236283
439750
-
6.97
176.0381
Nicotinamide ribotide
Nicotinamide ribotide
ME236284
14180
-
1.09
379.0522
NICOTINATE
Nicotinic acid
ME236285
938
-
1.39
122.0241
N-METHYL-L-GLUTAMATE_R1
N-Methyl-glutamic acid
ME236286
439377
-
0.91
160.0608
N-METHYL-L-GLUTAMATE_R2
N-Methyl-glutamic acid
ME236287
439377
-
0.84
160.0616
NORADRENALINE
Xi-Norepinephrine
ME236288
439260
-
0.99
168.0659
Pantothenic Acid
Pantothenic acid
ME236289
6613
-
6.64
218.1024
PICOLINIC ACID
Picolinic acid
ME236290
1018
-
1.34
122.0242
Proline
Proline
ME236291
145742
C16435
0.86
114.0554
Pyruvate
Pyruvic acid
ME236292
107735
-
0.97
87.008
QUINATE
Quinic acid
ME236293
6508
-
0.84
191.0552
Salicylic Acid-D4
Salicylic acid
ME236294
46782907
-
10
141.049
SARCOSINE/BETA-ALANINE
-
ME236295
-
-
0.74
88.0396
SEROTONIN
Serotonin
ME236296
5202
-
6.92
175.0866
SHIKIMATE
Shikimic acid
ME236297
8742
-
1.07
173.0457
STACHYOSE
Stachyose
ME236298
439531
-
0.99
665.2121
SUBERIC ACID
Suberic acid
ME236299
10457
-
7.74
173.0812
SUCCINATE
Succinic acid
ME236300
1110
-
2.28
117.0187
Succinic-2,2,3,3-D4 Acid
-
ME236301
-
-
2.25
121.0439
Sulfoacetaldehyde_R1
Sulfoacetaldehyde
ME236302
160226
-
0.71
122.9754
Sulfoacetaldehyde_R2
Sulfoacetaldehyde
ME236303
160226
-
0.76
122.9754
TARTARIC ACID
Tartaric acid
ME236304
444305
-
0.82
149.0085
TAURINE
Taurine
ME236305
1123
-
0.68
124.0067
THREONINE/HOMOSERINE
Threonine/Homoserine
ME236306
-
-
0.72
118.0505
Tryptophan
Tryptophan
ME236307
6305
-
7.67
203.0819
Tryptophan-2,3,3-D3
Tryptophan
ME236308
-
-
7.67
206.1005
Uracil
Uracil
ME236309
1174
-
1.31
111.0197
URATE_R1
Uric acid
ME236310
1175
-
1.81
167.0203
URATE_R2
Uric acid
ME236311
1175
-
1.98
167.0201
URIDINE
Uridine
ME236312
6029
-
2.79
243.0611
Vanilloylglycine
Vanilloylglycine
ME236313
3083688
-
7.71
224.0552
Xanthurenic Acid
Xanthurenic acid
ME236314
5699
-
7.5
204.0294
Xylenesulfonate
-
ME236315
11868
-
8.24
185.0269
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