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Return to study ST000093 main page
Analysis: GCMS positive ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
1,2-propanediol
1,2-Propanediol
ME657824
259994
C00717
1041
-
lactate
Lactic acid
ME657882
107689
C00186
1103
-
pyruvate
Pyruvic acid
ME657901
1060
C00022
1131
-
alanine
Alanine
ME657840
5950
C00041
1148
-
glycine
Glycine
ME657875
750
C00037
1166
-
2-hydroxybutyrate (AHB)
2-Hydroxybutyric acid
ME657830
11266
C05984
1169
-
3-hydroxyisobutyrate
3-Hydroxyisobutyric acid
ME657834
87
C06001
1205
-
alpha-hydroxyisovalerate
2-Hydroxy-3-methylbutyric acid
ME657841
99823
-
1208
-
2-aminobutyrate
2-Aminobutyric acid
ME657829
6657
C02261
1216
-
methylphosphate
Methanolphosphate
ME657891
13130
-
1221
-
urea
Urea
ME657917
1176
C00086
1224
-
3-aminoisobutyrate
3-Aminoisobutanoic acid
ME657833
64956
C05145
1252
-
beta-hydroxyisovalerate
3-Hydroxyisovaleric acid
ME657854
69362
-
1252
-
benzoate
Benzoic acid
ME657852
243
C00180
1292
-
ethanolamine
Ethanolamine
ME657865
700
C00189
1304
-
phosphate
Phosphoric acid
ME657898
1004
C00009
1308
-
glycerol
Glycerol
ME657872
753
C00116
1311
-
succinate
Succinic acid
ME657911
1110
C00042
1348
-
glycerate
Glyceric acid
ME657871
439194
C00258
1361
-
uracil
Uracil
ME657916
1174
C00106
1370
-
fumarate
Fumaric acid
ME657868
444972
C00122
1382
-
serine
Serine
ME657906
5951
C00065
1389
-
beta-hydroxypyruvate
Hydroxypyruvic acid
ME657855
964
C00168
1425
-
S-methylcysteine
Methylcysteine
ME657907
24417
-
1448
-
beta-alanine
beta-Alanine
ME657853
239
C00099
1452
-
malate
Malic acid
ME657885
222656
C00149
1502
-
methyl-4-hydroxybenzoate
Methylparaben
ME657890
7456
D01400
1515
-
erythritol
Erythritol
ME657863
222285
C00503
1518
-
salicylate
Salicylic acid
ME657904
338
C00805
1524
-
N-acetylserine
N-Acetylserine
ME657893
65249
-
1526
-
aspartate
Aspartic acid
ME657850
5960
C00049
1530
-
gamma-aminobutyrate (GABA)
gamma-Aminobutyric acid
ME657869
119
C00334
1540
-
erythronate*
Erythronic acid
ME657864
2781043
-
1547
-
cysteine
Cysteine
ME657860
594
C00097
1560
-
threonate
Threonic acid
ME657913
151152
C01620
1561
-
2-hydroxyglutarate
2-Hydroxyglutaric acid
ME657831
43
C02630
1576
-
hypotaurine
Hypotaurine
ME657878
107812
C00519
1599
-
taurine
Taurine
ME657912
1123
C00245
1616
-
asparagine
Asparagine
ME657849
6267
C00152
1618
-
triethanolamine
Triethanolamine
ME657915
7618
C06771
1620
-
4-hydroxybenzoate
4-Hydroxybenzoic acid
ME657838
135
C00156
1624
-
4-acetamidophenol
Acetaminophen
ME657837
1983
C06804
1626
-
arabinose
Arabinose
ME657843
66308
C00181
1632
-
pyrophosphate (PPi)
Pyrophosphate
ME657900
644102
C00013
1642
-
cysteine sulfinic acid
3-Sulfino-alanine
ME657861
439270
C00606
1662
-
xylitol
Xylitol
ME657919
6912
C00379
1678
-
1,6-anhydroglucose
Glucosan
ME657826
2724705
-
1680
-
arabitol
Arabitol
ME657844
827
C00474
1688
-
glycerol 2-phosphate
sn-Glycero-2-phosphate
ME657873
2526
C02979
1692
-
ribitol
Ribitol
ME657903
6912
C00474
1692
-
putrescine
Putrescine
ME657899
1045
C00134
1706
-
glycerol 3-phosphate (G3P)
sn-Glycero-3-phosphate
ME657874
439162
C00093
1720
-
xylonate
Xylonic acid
ME657920
6602431
C00502
1722
-
2-phosphoglycerate
2-Phosphoglyceric acid
ME657832
59
C00631
1734
-
arabonate
Arabinonic acid
ME657845
122045
C00878
1736
-
3-phosphoglycerate
3-Phosphoglyceric acid
ME657836
724
C00597
1754
-
mannose
Mannose
ME657889
18950
C00159
1754
-
fructose
Fructose
ME657866
5984
C00095
1758
-
glycylglycine
Gly-Gly
ME657876
83095
C02037
1758
-
citrate
Citric acid
ME657858
311
C00158
1763
-
ornithine
Ornithine
ME657895
6262
C00077
1764
-
1,5-anhydroglucitol (1,5-AG)
1,5-Anhydrosorbitol
ME657825
64960
C07326
1789
-
quinate
Quinic acid
ME657902
6508
C00296
1793
-
3-methylhistidine
3-Methylhistidine
ME657835
64969
C01152
1800
-
adenine
Adenine
ME657839
190
C00147
1804
-
13-methylmyristic acid
Isopentadecylic acid
ME657827
151014
-
1833
-
mannitol
Mannitol
ME657888
6251
C00392
1839
-
sorbitol
Sorbitol
ME657908
453
C00794
1843
-
ascorbate (Vitamin C)
Vitamin C
ME657848
54670067
C00072
1850
-
pentadecanoate (15:0)
Pentadecylic acid
ME657897
13849
C16537
1854
-
chiro-inositol
1D-chiro-Inositol
ME657856
-
-
1857
-
epinephrine
Epinephrine
ME657862
5816
D00095
1862
-
glucose
Glucose
ME657870
5793
C00031
1867
-
isopalmitic acid
Isopalmitic acid
ME657881
36247
-
1888
-
xanthine
Xanthine
ME657918
1188
C00385
1890
-
scyllo-inositol
Myo-inositol
ME657905
892
C06153
1894
-
myo-inositol
Myo-inositol
ME657892
892
C00137
1925
-
guanine
Guanine
ME657877
764
C00242
1942
-
indolelactate
Indolelactic acid
ME657879
92904
C02043
1965
-
cystathionine
Cystathionine
ME657859
439258
C02291
1980
-
fructose-6-phosphate
Fructose 6-phosphate
ME657867
69507
C05345
1995
-
n-Butyl Oleate
N-Butyl Oleate
ME657894
5354342
-
2045
-
inositol 1-phosphate (I1P)
Inositol 3-phosphate
ME657880
-
-
2058
-
arachidate (20:0)
Arachidic acid
ME657846
10467
C06425
2071
-
maltose
Maltose
ME657886
439186
C00208
2142
-
behenate (22:0)
Behenic acid
ME657851
8215
C08281
2143
-
argininosuccinate
Argininosuccinic acid
ME657847
16950
C03406
2157
-
trehalose
Trehalose
ME657914
7427
C01083
2175
-
1-oleoylglycerol (1-monoolein)
MG 18:1
ME657828
5319879
-
2181
-
squalene
Squalene
ME657909
5280370
C00751
2205
-
lignocerate (24:0)
Lignoceric acid
ME657884
11197
C08320
2211
-
alpha-tocopherol
alpha-Tocopherol
ME657842
14985
C02477
2305
-
cholesterol
Cholesterol
ME657857
5997
C00187
2317
-
lathosterol
Lathosterol
ME657883
65728
C01189
2337
-
maltotriose
Maltotriose
ME657887
439586
C01835
2419
-
palmitoyl sphingomyelin
SM 18:1;O2/16:0
ME657896
9939941
-
2524
-
stearoyl sphingomyelin
SM 18:1;O2/18:0
ME657910
6453725
C00550
2645
-
Analysis: LC/MS positive ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
imidazole propionate
Imidazole propanoate
ME657984
6984337
-
1012
-
3-dehydrocarnitine*
3-Dehydrocarnitine
ME657928
6991982
C02636
1020
-
valine
Valine
ME658035
6287
C00183
1040
-
glutamate, gamma-methyl ester
Glutamic acid, gamma-methyl ester
ME657967
73913
-
1062
-
cytidine
Cytidine
ME657953
6175
C00475
1065
-
4-guanidinobutanoate
4-Guanidinobutanoic acid
ME657930
500
C01035
1085
-
normetanephrine
Normetanephrine
ME658010
1237
C05589
1090
-
glycylproline
Gly-Pro
ME657975
3013625
-
1115
-
trans-urocanate
Urocanic acid
ME658030
736715
C00785
1119
-
pipecolate
Pipecolic acid
ME658016
849
C00408
1120
-
N6-acetyllysine
N6-Acetyllysine
ME657999
265949
C02727
1134
-
acetylcarnitine
CAR 2:0
ME657932
1
C02571
1203
-
adenosine 5'-monophosphate (AMP)
AMP
ME657935
6083
C00020
1210
-
N-acetylaspartate (NAA)
N-Acetylaspartic acid
ME658000
65065
C01042
1222
-
methionine
Methionine
ME657996
6137
C00073
1252
-
nicotinamide
Niacinamide
ME658005
936
C00153
1267
-
glutathione, reduced (GSH)
Glutathione
ME657971
124886
C00051
1274
-
guanosine 5'- monophosphate (5'-GMP)
GMP
ME657978
6804
C00144
1300
-
N1-methyladenosine
1-Methyladenosine
ME657998
27476
C02494
1356
-
nicotinamide adenine dinucleotide (NAD+)
NAD
ME658006
10897651
C00003
1370
-
cis-urocanate
Urocanic acid
ME657948
1549103
-
1399
-
ophthalmate
Ophthalmic acid
ME658012
7018721
-
1457
-
alanylvaline
Ala-Val
ME657939
96799
-
1513
-
tyrosine
Tyrosine
ME658033
6057
C00082
1516
-
glutathione, oxidized (GSSG)
Oxidized glutathione
ME657970
975
C00127
1535
-
N-acetyl-aspartyl-glutamate (NAAG)
N-Acetyl-Asp-Glu
ME658001
5255
C12270
1563
-
glutaroyl carnitine
CAR DC5:0
ME657969
53481622
-
1565
-
glycylvaline
Gly-Val
ME657977
97417
-
1572
-
propionylcarnitine
CAR 3:0
ME658019
188824
C03017
1589
-
isoleucine
Isoleucine
ME657987
6306
C00407
1614
-
adenosine
Adenosine
ME657934
60961
C00212
1650
-
leucine
Leucine
ME657991
6106
C00123
1674
-
hydroxyisovaleroyl carnitine
CAR 4:0;OH,Me
ME657982
57357187
-
1683
-
N1-Methyl-2-pyridone-5-carboxamide
N1-Methyl-2-pyridone-5-carboxamide
ME657997
69698
C05842
1707
-
4-acetamidobutanoate
4-Acetamidobutanoic acid
ME657929
18189
C02946
1724
-
glycyltyrosine
Gly-Tyr
ME657976
92829
-
1728
-
isoleucylglycine
Ile-Gly
ME657988
6992869
-
1732
-
leucylglycine
Leu-Gly
ME657992
79070
-
1800
-
kynurenine
Kynurenine
ME657990
161166
C00328
1902
-
C-glycosyltryptophan*
C-Glycosyltryptophan
ME657945
-
-
1912
-
isobutyrylcarnitine
CAR 3:0;2Me
ME657986
213144
C02862
1941
-
butyrylcarnitine
CAR 4:0
ME657942
213144
C02862
2007
-
gamma-glutamylvaline
gamma-Glutamylvaline
ME657965
7015683
-
2040
-
phenylalanine
Phenylalanine
ME658015
6140
C00079
2056
-
gamma-glutamyltyrosine
gamma-Glutamyltyrosine
ME657964
94340
-
2073
-
glycylisoleucine
Gly-Ile
ME657973
88079
-
2080
-
theobromine
Theobromine
ME658025
5429
C07480
2136
-
alanylleucine
Ala-Leu
ME657937
259583
-
2150
-
pantothenate
Pantothenic acid
ME658013
988
C00864
2218
-
glycylleucine
Gly-Leu
ME657974
44369321
C02155
2236
-
dexpanthenol
Pantothenol
ME657956
131204
C03726
2293
-
tiglyl carnitine
CAR 4:1;2Me
ME658027
22833596
-
2317
-
serylphenyalanine
Ser-Phe
ME658021
-
-
2348
-
alanylphenylalanine
Ala-Phe
ME657938
6992394
-
2422
-
5-methylthioadenosine (MTA)
5'-Methylthioadenosine
ME657931
439176
C00170
2427
-
2-methylbutyroylcarnitine
CAR 4:0;2Me
ME657926
6426901
-
2439
-
paraxanthine
Paraxanthine
ME658014
4687
C13747
2444
-
tryptophan
Tryptophan
ME658031
6305
C00078
2445
-
tryptophan betaine
Lenticin
ME658032
442106
C09213
2464
-
gabapentin
Gabapentin
ME657961
3446
D00332
2482
-
isovalerylcarnitine
CAR 4:0;3Me
ME657989
6426851
-
2533
-
N-ethylglycinexylidide*
Monoethylglycinexylidide
ME658004
24415
C16561
2584
-
valerylcarnitine
CAR 5:0
ME658034
53481619
-
2584
-
gamma-glutamylisoleucine*
gamma-Glutamylisoleucine
ME657962
14253342
-
2644
-
gamma-glutamylleucine
gamma-Glutamylleucine
ME657963
151023
-
2744
-
lidocaine
Lidocaine
ME657993
3676
D00358
2761
-
caffeine
Caffeine
ME657943
2519
C07481
2820
-
hexanoylcarnitine
CAR 6:0
ME657980
6426853
C01585
3174
-
ADSGEGDFXAEGGGVR*
-
ME657936
-
-
3239
-
indoleacetate
Indoleacetic acid
ME657985
802
C00954
3760
-
doxycycline
Doxycycline
ME657958
54671203
C06973
3900
-
topiramate
Topiramate
ME658028
5514
C07502
3920
-
octanoylcarnitine
CAR 8:0
ME658011
123701
-
4100
-
norfluoxetine*
-
ME658009
4541
-
4400
-
fluoxetine
Fluoxetine
ME657960
11824156
D00326
4514
-
heme*
Heme
ME657979
444097
-
4985
-
naproxen
Naproxen
ME658003
156391
C01517
5050
-
ibuprofen acyl glucuronide
-
ME657983
163959
C03033
5135
-
piperine
Piperine
ME658017
638024
C03882
5136
-
sphingosine
Sphingosine
ME658023
91486
C00319
5197
-
spermidine
Spermidine
ME658022
1102
C00315
533
-
1-linoleoylglycerophosphocholine
LPC 18:2
ME657921
5280646
C04100
5574
-
2-oleoylglycerophosphocholine*
LPC 18:1
ME657927
-
-
5640
-
1-palmitoylglycerophosphocholine
LPC 16:0/0:0
ME657923
460602
C04230
5671
-
histamine
Histamine
ME657981
774
C00388
570
-
1-oleoylglycerophosphocholine
LPC 18:1/0:0
ME657922
6449974
-
5700
-
1-stearoylglycerophosphocholine
LPC 18:0/0:0
ME657924
497299
-
5844
-
lysine
Lysine
ME657994
5962
C00047
603
-
arginine
Arginine
ME657940
6322
C00062
650
-
choline
Choline
ME657946
305
C00114
674
-
glutamine
Glutamine
ME657968
5961
C00064
684
-
glycerophosphorylcholine (GPC)
sn-Glycero-3-phosphocholine
ME657972
657272
C00670
694
-
choline phosphate
Choline phosphate
ME657947
135437
-
695
-
glutamate
Glutamic acid
ME657966
33032
C00025
700
-
carnitine
Carnitine
ME657944
288
-
702
-
trans-4-hydroxyproline
trans-4-Hydroxyproline
ME658029
11137200
C01157
705
-
threonine
Threonine
ME658026
6288
C00188
713
-
citrulline
Citrulline
ME657949
9750
C00327
715
-
betaine
Betaine
ME657941
247
C00719
721
-
creatinine
Creatinine
ME657951
588
C00791
730
-
creatine
Creatine
ME657950
586
C00300
758
-
deoxycarnitine
3-Dehydroxycarnitine
ME657955
725
C01181
759
-
pyroglutamine*
Pyroglutamine
ME658020
134508
-
764
-
2-aminoadipate
alpha-Aminoadipic acid
ME657925
469
C00956
794
-
proline
Proline
ME658018
145742
C00148
796
-
dimethylarginine (SDMA + ADMA)
Dimethylarginine
ME657957
123831
C03626
812
-
cysteine-glutathione disulfide
S-Glutathionyl-cysteine
ME657952
3080690
-
821
-
ergothioneine
Ergothioneine
ME657959
3032311
C05570
847
-
stachydrine
Stachydrine
ME658024
7016563
C10172
860
-
acetylcholine
Acetylcholine
ME657933
187
C01996
866
-
N-acetylornithine
N-Acetylornithine
ME658002
439232
C00437
875
-
nicotinamide ribonucleotide (NMN)
Nicotinamide ribotide
ME658007
14180
C00455
886
-
cytidine 5'-monophosphate (5'-CMP)
CMP
ME657954
6131
C00055
887
-
nicotinamide riboside*
Nicotinamide riboside
ME658008
439924
-
955
-
malonylcarnitine
CAR DC3:0
ME657995
71464475
-
980
-
Analysis: LC/MS negative ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
pseudouridine
Pseudouridine
ME658132
15047
C02067
1104
-
hypoxanthine
Hypoxanthine
ME658101
790
C00262
1313
-
p-acetamidophenylglucuronide
p-Acetamidophenylglucuronide
ME658121
4022661
-
1377
-
3-(4-hydroxyphenyl)lactate
Hydroxyphenyllactic acid
ME658060
9378
C03672
1395
-
uridine
Uridine
ME658141
6029
C00299
1467
-
3-methyl-2-oxobutyrate
Ketoisovaleric acid
ME658063
49
C00141
1489
-
adenosine 2'-monophosphate (2'-AMP)
Adenosine 2'-phosphate
ME658072
6083
C00946
1497
-
N-(2-furoyl)glycine
2-Furoylglycine
ME658113
21863
-
1513
-
nicotinamide adenine dinucleotide reduced (NADH)
NADH
ME658117
5886
C00004
1554
-
inosine
Inosine
ME658103
6021
C00294
1630
-
guanosine
Guanosine
ME658096
6802
C00387
1675
-
2-hydroxyacetaminophen sulfate*
2-Hydroxyacetaminophen sulfate
ME658052
-
-
1703
-
pyroglutamylvaline
PyroGlu-Val
ME658134
152416
-
1755
-
4-acetaminophen sulfate
Paracetamol sulfate
ME658065
83939
C06804
1779
-
N-acetylmethionine
N-Acetylmethionine
ME658115
448580
C02712
1805
-
S-adenosylhomocysteine (SAH)
S-Adenosylhomocysteine
ME658136
439155
C00021
1821
-
catechol sulfate
Catechol sulfate
ME658082
3083879
C00090
1928
-
2-methoxyacetaminophen sulfate*
2-Methoxyacetaminophen sulfate
ME658057
-
-
1977
-
adenosine 3',5'-cyclic monophosphate (cAMP)
3',5' cyclic AMP
ME658073
6076
C00575
1979
-
3-methyl-2-oxovalerate
3-Methyl-2-oxovaleric acid
ME658064
47
C00671
2106
-
hippurate
Hippuric acid
ME658098
464
C01586
2136
-
phenol sulfate
Phenyl hydrogen sulfate
ME658127
74426
C02180
2199
-
4-methyl-2-oxopentanoate
Ketoleucine
ME658067
70
C00233
2200
-
pyridoxate
4-Pyridoxic acid
ME658133
6723
C00847
2210
-
phenyllactate (PLA)
Phenyllactic acid
ME658129
3848
C05607
2237
-
2-hydroxyhippurate (salicylurate)
Salicyluric acid
ME658053
10253
C07588
2252
-
3-indoxyl sulfate
Indoxyl sulfate
ME658062
10258
-
2258
-
phenylacetylglutamine
alpha-N-Phenylacetylglutamine
ME658128
92258
C05597
2314
-
flavin adenine dinucleotide (FAD)
FAD
ME658094
643975
C00016
2413
-
VGAHAGEYGAEALER*
-
ME658143
-
-
2687
-
caproate (6:0)
Caproic acid
ME658080
8892
C01585
2766
-
3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMP...
3-Carboxy-4-methyl-5-propyl-2-furanpropanoic acid
ME658061
123979
-
2815
-
p-cresol sulfate
p-Cresol sulfate
ME658125
4615423
C01468
2896
-
heptanoate (7:0)
Heptylic acid
ME658097
8094
C17714
3695
-
4-androsten-3beta,17beta-diol disulfate 1*
4-Androsten-3beta,17beta-diol disulfate
ME658066
-
-
3735
-
pregnen-diol disulfate*
-
ME658131
219833
C05484
3886
-
2-ethylhexanoate (isobar with 2-propylpentanoate)
-
ME658051
-
-
3909
-
5alpha-pregnan-3beta,20alpha-diol disulfate
5alpha-Pregnan-3beta,20alpha-diol disulfate
ME658068
-
-
3962
-
hydroxypioglitazone*
-
ME658100
-
-
4093
-
bisphenol A monosulfate
-
ME658078
-
-
4214
-
caprylate (8:0)
Caprylic acid
ME658081
379
C06423
4367
-
dehydroisoandrosterone sulfate (DHEA-S)
Dehydroepiandrosterone sulfate
ME658083
12594
C04555
4771
-
pelargonate (9:0)
Pelargonic acid
ME658126
8158
C01601
4847
-
ibuprofen
Ibuprofen
ME658102
3672
C01588
4951
-
androsterone sulfate
5alpha-Androstane-3alpha-ol-17-one sulfate
ME658076
5879
C00523
5011
-
caprate (10:0)
Capric acid
ME658079
2969
C01571
5092
-
glycocholate
Glycocholic acid
ME658095
10140
C01921
5104
-
undecanoate (11:0)
Undecylic acid
ME658139
8180
C17715
5207
-
taurochenodeoxycholate
Taurochenodeoxycholic acid
ME658137
387316
C05465
5218
-
taurodeoxycholate
Taurodeoxycholic acid
ME658138
2733768
C05463
5243
-
7-alpha-hydroxy-3-oxo-4-cholestenoate (7-Hoca)
7alpha-Hydroxy-3-oxo-4-cholestenoic acid
ME658071
53481411
C17337
5268
-
deoxycholate
Deoxycholic acid
ME658084
222528
C04483
5268
-
ricinoleic acid
Ricinoleic acid
ME658135
5282942
C08365
5272
-
laurate (12:0)
Lauric acid
ME658105
3893
C02679
5288
-
myristoleate (14:1n5)
Myristoleic acid
ME658112
5281119
C08322
5338
-
myristate (14:0)
Myristic acid
ME658111
11005
C06424
5439
-
eicosapentaenoate (EPA; 20:5n3)
Eicosapentaenoic acid
ME658092
446284
C06428
5442
-
linolenate [alpha or gamma; (18:3n3 or 6)]
Octadecatrienoic acid
ME658108
5280934
C06427
5450
-
palmitoleate (16:1n7)
Palmitoleic acid
ME658123
445638
C08362
5477
-
1-arachidonoylglycerophosphoinositol*
LPI 20:4
ME658041
-
-
5479
-
2-hydroxypalmitate
2-Hydroxypalmitic acid
ME658054
92836
-
5508
-
docosahexaenoate (DHA; 22:6n3)
LPC 22:6
ME658088
445580
C06429
5518
-
arachidonate (20:4n6)
Arachidonic acid
ME658077
444899
C00219
5525
-
linoleate (18:2n6)
Linoleic acid
ME658107
5280450
C01595
5533
-
10-heptadecenoate (17:1n7)
10Z-Heptadecenoic acid
ME658036
5312435
-
5558
-
1-palmitoylglycerophosphoinositol*
LPI 16:0
ME658045
-
-
5573
-
linoelaidate (tr 18:2n6)
Linoleic acid
ME658106
5280450
C01595
5573
-
docosapentaenoate (n3 DPA; 22:5n3)
DPA
ME658089
5497182
C16513
5574
-
dihomo-linolenate (20:3n3 or n6)
Dihomo-gamma-linolenic acid
ME658086
5280581
C03242
5600
-
palmitate (16:0)
Palmitic acid
ME658122
985
C00249
5619
-
docosapentaenoate (n6 DPA; 22:5n6)
Docosapentaenoic acid (22n-6)
ME658090
5497182
C06429
5625
-
mead acid (20:3n9)
ETrE(5Z,8Z,11Z)
ME658110
5312531
-
5642
-
2-linoleoylglycerophosphoethanolamine*
LPE 18:2
ME658056
-
-
5650
-
oleate (18:1n9)
Oleic acid
ME658119
445639
C00712
5660
-
2-arachidonoylglycerophosphoethanolamine*
LPE 20:4
ME658050
-
-
5674
-
adrenate (22:4n6)
Adrenic acid
ME658075
5497181
C16527
5684
-
15-methylpalmitate (isobar with 2-methylpalmitate)
15-Methylpalmitic acid
ME658038
-
-
5698
-
2-hydroxystearate
2-Hydroxystearic acid
ME658055
439887
C03045
5705
-
Isobar: fructose 1,6-diphosphate, glucose 1,6-diph...
-
ME658104
-
-
572
-
dihomo-linoleate (20:2n6)
11Z,14Z-Eicosadienoic acid
ME658085
6439848
C16525
5722
-
1-linoleoylglycerophosphoethanolamine*
LPE 18:2
ME658042
-
-
5725
-
1-arachidonoylglycerophosphoethanolamine*
LPE 20:4
ME658040
-
-
5731
-
margarate (17:0)
Margaric acid
ME658109
10465
-
5733
-
10-nonadecenoate (19:1n9)
Nonadeca-10Z-enoic acid
ME658037
5312513
-
5775
-
2-palmitoylglycerophosphoethanolamine*
LPE 16:0
ME658059
-
-
5790
-
2,3-diphosphoglycerate
2,3-Diphosphoglyceric acid
ME658049
186004
C01159
580
-
1-stearoylglycerophosphoinositol
LPI 18:0/0:0
ME658048
-
-
5800
-
docosatrienoate (22:3n3)
13,16,19-Docosatrienoic acid
ME658091
5312556
C16534
5825
-
2-oleoylglycerophosphoethanolamine*
LPE 18:1
ME658058
-
-
5848
-
6-phosphogluconate
6-Phosphogluconic acid
ME658070
91493
C00345
588
-
1-oleoylglycerophosphoethanolamine
LPE 18:1
ME658043
9547071
-
5928
-
1-palmitoylglycerophosphoethanolamine
LPE 16:0
ME658044
9547069
-
5940
-
eicosenoate (20:1n9 or 11)
cis-Gondoic acid
ME658093
5282768
C16526
5955
-
17-methylstearate
Xi-17-Methyloctadecanoic acid
ME658039
3083779
-
5987
-
docosadienoate (22:2n6)
13Z,16Z-Docosadienoic acid
ME658087
5312554
C16533
6017
-
nonadecanoate (19:0)
Nonadecylic acid
ME658118
12591
C16535
6073
-
1-palmitoylplasmenylethanolamine*
LPE P-16:0 or LPE O-16:1
ME658046
42607469
-
6153
-
1-stearoylglycerophosphoethanolamine
LPE 18:0/0:0
ME658047
9547068
-
6200
-
uridine monophosphate (5' or 3')
UMP
ME658142
6030
C00105
635
-
palmitoyl ethanolamide
Palmitoyl-EA
ME658124
52922083
C16512
6416
-
phosphoethanolamine
Phosphoethanolamine
ME658130
1015
C00346
644
-
oleic ethanolamide
Oleoyl-EA
ME658120
5283454
-
6553
-
5-oxoproline
Pyroglutamic acid
ME658069
499
C01879
744
-
histidine
Histidine
ME658099
6274
C00135
757
-
urate
Uric acid
ME658140
1175
C00366
769
-
N-acetylthreonine
N-Acetylthreonine
ME658116
439406
C01118
846
-
N-acetylalanine
N-Acetylalanine
ME658114
88064
C02847
882
-
adenosine 5'diphosphoribose
ADP-ribose
ME658074
192
C00301
964
-
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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