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Return to study ST002051 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
Benzoxazolone
2-Benzoxazolol
ME473776
-
-
2.3
-
2-Oxoglutaric acid
2-Oxoglutaric acid
ME473733
-
-
4.3
-
Cysteinesulfinic acid
3-Sulfino-alanine
ME473795
-
-
3.9
-
Phenolsulfonic acid
4-Hydroxybenzenesulfonic acid
ME473941
-
-
1.4
-
Androstanediol
5alpha-Androstane-3beta,17beta-diol
ME473761
-
-
1.6
-
Acetylcholine
Acetylcholine
ME473741
-
-
16.6
-
Acridine
Acridine
ME473747
-
-
2.2
-
Adenine
Adenine
ME473748
-
-
10.8
-
Adenosine
Adenosine
ME473749
-
-
6.8
-
ADP
ADP
ME473750
-
-
14.6
-
Alanine
Alanine
ME473751
-
-
14.8
-
Alanylproline
Ala-Pro
ME473752
-
-
11.4
-
Allopurinol
Allopurinol
ME473753
-
-
9.5
-
Aminoadipate
Aminoadipic acid
ME473754
-
-
11.8
-
Aminohydroxymethylpentanedioic acid
Aminohydroxymethylpentanedioic acid
ME473755
-
-
4.3
No results
Aminolevulinic acid
Aminolevulinic acid
ME473756
-
-
3.6
-
Aminopyridine
Aminopyridine
ME473757
-
-
2.6
No results
Aminoundecanoic acid
Aminoundecanoic acid
ME473758
-
-
6.6
-
AMP
AMP
ME473759
-
-
11.7
-
Arabitol
Arabitol
ME473763
-
-
10.0
-
Arachidic acid
Arachidic acid
ME473764
-
-
1.6
-
Arachidonic acid
Arachidonic acid
ME473765
-
-
1.7
-
ArgAla
Arg-Ala
ME473766
-
-
20.4
-
Arginine
Arginine
ME473767
-
-
26.0
-
Asparagine
Asparagine
ME473769
-
-
15.3
-
Aspartate
Aspartic acid
ME473770
-
-
11.2
-
Aspartylproline
Asp-Pro
ME473771
-
-
12.7
-
ATP
ATP
ME473772
-
-
15.1
-
Benzaldehyde
Benzaldehyde
ME473773
-
-
10.4
-
Benzisothiazolone
Benzisothiazolone
ME473774
-
-
2.3
No results
Betaine
Betaine
ME473777
-
-
12.1
-
Hexadecasphinganine
C16 Sphinganine
ME473844
-
-
4.2
-
Decanoic acid
Capric acid
ME473798
-
-
1.8
-
Hexanoic acid
Caproic acid
ME473845
-
-
2.2
-
Caprylic acid
Caprylic acid
ME473779
-
-
2.0
-
Palmitoylcarnitine
CAR 16:0
ME473936
-
-
2.8
-
Acetyl-Carnitine
CAR 2:0
ME473740
-
-
13.8
-
Propionylcarnitine
CAR 3:0
ME473954
-
-
12.6
-
Hydroxybutyrylcarnitine
CAR 4:0;OH
ME473851
-
-
14.2
-
Carnitine
Carnitine
ME473782
-
-
15.5
-
Cholestenone
Cholestenone
ME473785
-
-
2.0
-
Cholinesulfate
Choline sulfate
ME473786
-
-
6.0
-
Aconitic acid
cis-Aconitic acid
ME473746
-
-
6.6
-
Coumaric acid
cis-p-Coumaric acid
ME473788
-
-
12.5
-
Creatine
Creatine
ME473789
-
-
15.3
-
Creatinine
Creatinine
ME473790
-
-
6.7
-
Crotonate
Crotonic acid
ME473792
-
-
16.3
-
Cytidine
Cytidine
ME473796
-
-
10.5
-
Cytosine
Cytosine
ME473797
-
-
7.9
-
Desoxyadenosine
Deoxyadenosine
ME473801
-
-
5.0
-
Deoxycytidine
Deoxycytidine
ME473799
-
-
8.6
-
Deoxyinosine
Deoxyinosine
ME473800
-
-
6.9
-
Desthiobiotin
Dethiobiotin
ME473802
-
-
11.5
-
Diaminopimelic acid
Diaminopimelic acid
ME473803
-
-
15.5
-
Diethanolamine
Diethanolamine
ME473804
-
-
22.7
-
Diethylene glycol
Diethylene glycol
ME473805
-
-
2.4
-
Dihydrothymine
Dihydrothymine
ME473806
-
-
15.9
-
Dinotefuran
Dinotefuran
ME473810
-
-
16.5
-
Dodecylbenzenesulfonic acid
Dodecylbenzenesulfonic acid
ME473811
-
-
1.4
No results
Eicosapentaenoic acid
Eicosapentaenoic acid
ME473812
-
-
1.6
-
Erythritol
Erythritol
ME473814
-
-
7.2
-
Erythrose
Erythrose
ME473816
-
-
4.5
-
FAD
FAD
ME473818
-
-
9.6
-
Flumazenil
Flumazenil
ME473819
-
-
1.4
-
Fumaric acid
Fumaric acid
ME473820
-
-
3.9
-
Galactitol
Galactitol
ME473822
-
-
12.6
-
GABA
gamma-Aminobutyric acid
ME473821
-
-
16.0
-
Glutamate
Glutamic acid
ME473823
-
-
11.0
-
Glutamine
Glutamine
ME473824
-
-
15.6
-
Glutathione
Glutathione
ME473826
-
-
11.2
-
GlyArg
Gly-Arg
ME473827
-
-
21.4
-
Glycerate
Glyceric acid
ME473828
-
-
4.4
-
Glycerol
Glycerol
ME473830
-
-
4.7
-
Glycine
Glycine
ME473835
-
-
15.7
-
Glycylglycylglycine
Gly-Gly-Gly
ME473836
-
-
11.3
-
Guanine
Guanine
ME473838
-
-
10.1
-
Guanosine
Guanosine
ME473839
-
-
11.6
-
Heptanoic acid
Heptylic acid
ME473841
-
-
1.9
-
Hippurate
Hippuric acid
ME473847
-
-
2.6
-
Homocysteine
Homocysteine
ME473848
-
-
15.2
-
Hydroxybutyric acid
Hydroxybutyric acid
ME473850
-
-
4.5
-
Hydroxyglutaric acid
Hydroxyglutaric acid
ME473852
-
-
5.1
Full match
Hydroxyhippuric acid
Hydroxyhippuric acid
ME473853
-
-
6.7
-
Hydroxyindolinone
Hydroxyindolinone
ME473854
-
-
2.3
No results
Hydroxyoctadecadienoic acid
Hydroxyoctadecadienoic acid
ME473857
-
-
1.7
-
Hydroxytryptophan
Hydroxytryptophan
ME473863
-
-
11.7
Full match
Hypoxanthine
Hypoxanthine
ME473864
-
-
5.9
-
Imidazolelactic acid
Imidazolelactic acid
ME473865
-
-
11.3
-
Indole
Indole
ME473868
-
-
10.4
-
Indoleacetaldehyde
Indoleacetaldehyde
ME473869
-
-
2.5
-
Indoleacetate
Indoleacetic acid
ME473870
-
-
2.3
-
Inosine
Inosine
ME473871
-
-
9.1
-
Inositol
Inositol
ME473872
-
-
17.0
-
Isoleucine
Isoleucine
ME473873
-
-
11.6
-
Kynurenine
Kynurenine
ME473875
-
-
11.0
-
Lactic acid
Lactic acid
ME473877
-
-
4.5
-
Laurate
Lauric acid
ME473878
-
-
1.7
-
Leucine
Leucine
ME473880
-
-
10.9
-
LeuLeu
Leu-Leu
ME473882
-
-
2.6
-
LeuVal
Leu-Val
ME473883
-
-
6.3
-
Homocysteinethiolactone
L-Homocysteine thiolactone
ME473849
-
-
7.2
-
Linoleamide
Linoleamide
ME473886
-
-
2.4
-
Linoleic acid
Linoleic acid
ME473887
-
-
2.4
-
Linoleoylethanolamide
Linoleoyl-EA
ME473888
-
-
2.1
-
Malonic acid
Malonic acid
ME473891
-
-
6.7
-
Methionine
Methionine
ME473894
-
-
11.5
-
Methionine sulfoxide
Methionine sulfoxide
ME473895
-
-
14.3
-
Methocarbamol
Methocarbamol
ME473896
-
-
2.6
-
Methyladenine
Methyladenine
ME473899
-
-
5.7
-
Methylguanosine
Methylguanosine
ME473904
-
-
8.3
-
Methyllinoleate
Methyl linoleate
ME473906
-
-
1.5
-
Methylthiazolidine
Methylthiazolidine
ME473910
-
-
11.5
No results
Methylthioadenosine
Methylthioadenosine
ME473911
-
-
3.7
-
Metyrapone
Metyrapone
ME473913
-
-
2.3
-
myristic acid
Myristic acid
ME473914
-
-
1.7
-
Myristoleic acid
Myristoleic acid
ME473915
-
-
1.7
-
Trimethyl-lysine
N-6-Trimethyllysine
ME473983
-
-
27.0
-
Acetylarginine
N-Acetylarginine
ME473736
-
-
16.3
Full match
Acetylasparagine
N-Acetylasparagine
ME473737
-
-
4.1
Partial match
Acetylaspartic acid
N-Acetylaspartic acid
ME473738
-
-
4.8
-
Acetylglycine
N-Acetylglycine
ME473744
-
-
3.7
-
Acetylglutamic acid
N-Acetyl-mannosamine
ME473743
-
-
6.0
-
Carbobenzyloxyglycine
N-Benzyloxycarbonylglycine
ME473781
-
-
2.4
-
Nicotinamide
Niacinamide
ME473917
-
-
9.3
-
Nicotine
Nicotine
ME473918
-
-
4.1
-
Nicotinic acid
Nicotinic acid
ME473919
-
-
4.1
-
Oleoylglycine
N-Oleoyl glycine
ME473927
-
-
1.4
-
Octadecenal
Octadecenal
ME473923
-
-
2.1
No results
Oleamide
Oleamide
ME473924
-
-
2.1
-
Oleate
Oleic acid
ME473925
-
-
1.6
-
Oleoylethanolamide
Oleoyl-EA
ME473926
-
-
2.1
-
Orotic acid
Orotic acid
ME473928
-
-
4.2
-
O-Succinyl-L-homoserine
o-Succinylhomoserine
ME473929
-
-
4.2
-
Oxotremorine
Oxotremorine
ME473934
-
-
2.1
-
Hexadecanal
Palmitaldehyde
ME473843
-
-
2.1
-
Palmitate
Palmitic acid
ME473935
-
-
1.6
-
Pantothenate
Pantothenic acid
ME473937
-
-
7.1
-
Nonanoic acid
Pelargonic acid
ME473921
-
-
1.8
-
Pentadecanoic acid
Pentadecylic acid
ME473939
-
-
1.7
-
Phenylacetaldehyde
Phenylacetaldehyde
ME473942
-
-
2.1
-
Phenylalanine
Phenylalanine
ME473943
-
-
10.4
-
Phenylethylamine
Phenylethylamine
ME473944
-
-
2.4
-
Phenylpyruvic acid
Phenylpyruvic acid
ME473945
-
-
2.1
-
Phosphorylethanolamine
Phosphoethanolamine
ME473948
-
-
12.3
-
Phosphoglycolate
Phosphoglycolic acid
ME473946
-
-
13.0
No results
Phosphonoacetaldehyde
Phosphonoacetaldehyde
ME473947
-
-
16.7
-
Pregabalin
Pregabalin
ME473950
-
-
17.0
-
ProGln
Pro-Gln
ME473951
-
-
12.7
-
Prolylleucine
Pro-Leu
ME473953
-
-
13.6
-
Proline
Proline
ME473952
-
-
13.4
-
Pyridoxal
Pyridoxal
ME473955
-
-
4.0
-
Pyridoxine
Pyridoxine
ME473956
-
-
4.0
-
Pyruvic acid
Pyruvic acid
ME473957
-
-
1.7
-
Tretinoin
Retinoic acid
ME473980
-
-
1.8
-
Riboflavin
Riboflavin
ME473960
-
-
9.0
-
Serine
Serine
ME473962
-
-
15.7
-
SerSer
Ser-Ser
ME473963
-
-
8.8
-
Shikimate
Shikimic acid
ME473964
-
-
6.5
-
Glycerol3Phosphate
sn-Glycero-3-phosphate
ME473831
-
-
16.8
-
Glycerophosphoglycerol
sn-Glycero-3-phosphoglycerol
ME473832
-
-
5.3
-
Sphingosine
Sphingosine
ME473965
-
-
6.0
-
Octadecanal
Stearaldehyde
ME473922
-
-
2.1
-
Stearate
Stearic acid
ME473966
-
-
1.6
-
Succinic acid
Succinic acid
ME473967
-
-
4.5
-
Succinic semialdehyde
Succinic acid semialdehyde
ME473968
-
-
3.9
-
Succinimide
Succinimide
ME473969
-
-
3.8
-
Sulfinoalanine
Sulfino-alanine
ME473970
-
-
9.2
Partial match
Taurine
Taurine
ME473972
-
-
10.2
-
L-Threonic acid
Threonic acid
ME473889
-
-
8.1
-
Threonine
Threonine
ME473975
-
-
14.3
-
Thymine
Thymine
ME473977
-
-
3.7
-
Cinnamic acid
trans-Cinnamic acid
ME473787
-
-
10.1
-
Traumatin
Traumatin
ME473978
-
-
2.0
-
Trehalose
Trehalose
ME473979
-
-
17.3
-
Tridecylic acid
Tridecylic acid
ME473981
-
-
1.7
-
Trigonelline
Trigonelline
ME473982
-
-
12.6
-
Tryptophan
Tryptophan
ME473984
-
-
10.8
-
Tyrosine
Tyrosine
ME473985
-
-
12.4
-
Tyrosyltyrosine
Tyr-Tyr
ME473986
-
-
2.3
-
UDP
UDP
ME473987
-
-
14.2
-
UMP
UMP
ME473989
-
-
11.6
-
Undecylic acid
Undecylic acid
ME473991
-
-
1.7
-
Uracil
Uracil
ME473992
-
-
3.9
-
Uric acid
Uric acid
ME473993
-
-
4.2
-
Uridine
Uridine
ME473994
-
-
6.3
-
Valeric acid
Valeric acid
ME473996
-
-
2.4
-
Valine
Valine
ME473997
-
-
13.0
-
Xanthosine
Xanthosine
ME473999
-
-
5.5
-
Acetamidobutanoate
-
ME473734
-
-
3.6
Full match
Acetylaminoadipic acid
-
ME473735
-
-
9.4
No results
Acetylaspartylglutamic acid
-
ME473739
-
-
9.4
Full match
Acetylglucosamine
-
ME473742
-
-
11.1
Partial match
Acetylmethoxykynurenamine
-
ME473745
-
-
3.7
No results
Ampalex
-
ME473760
-
-
2.4
No results
APM
-
ME473762
-
-
4.1
No results
Arginylhydroxyproline
-
ME473768
-
-
16.4
No results
Benzofluorenylacetic acid
-
ME473775
-
-
2.1
No results
cADPR
-
ME473778
-
-
14.1
Partial match
Capuride
-
ME473780
-
-
2.3
No results
Ceramide1
-
ME473783
-
-
2.1
No results
Ceramide2
-
ME473784
-
-
2.0
No results
Cresylsulfate
-
ME473791
-
-
1.4
No results
Cyclohexanediol
-
ME473793
-
-
2.0
No results
Cycloserine
-
ME473794
-
-
15.1
No results
Dihydroxyoctadecadienhexadecanamide
-
ME473807
-
-
2.0
No results
Dimethyldihydroimidazole
-
ME473808
-
-
24.9
No results
Dimethylpyrrole
-
ME473809
-
-
12.6
No results
Epoxyicosatrienoic acid
-
ME473813
-
-
2.1
Full match
Erythritol4phosphate
-
ME473815
-
-
2.2
No results
Ethoxyethoxyethanol
-
ME473817
-
-
2.2
No results
Glutamylaminobutanal
-
ME473825
-
-
10.5
No results
Glycero3phosphomyoinositol
-
ME473829
-
-
12.7
No results
Glycerophosphopalmitoylethanolamine
-
ME473833
-
-
6.1
Full match
Glycerophosphorylethanolamine
-
ME473834
-
-
16.4
No results
Guanidinobutyric acid
-
ME473837
-
-
18.8
Full match
Henicosanedione
-
ME473840
-
-
1.6
No results
Heptatriene
-
ME473842
-
-
2.2
No results
Hexylbenzene
-
ME473846
-
-
2.1
No results
Hydroxymethylbutanoyloxytrimethylammoniobutanoate
-
ME473855
-
-
13.5
No results
Hydroxymethyldihydrothiazoloindolecarbaldehyde
-
ME473856
-
-
2.1
No results
Hydroxyphenylindolethylacrylamide
-
ME473858
-
-
2.2
No results
Hydroxypicolinic acid
-
ME473859
-
-
2.1
Full match
Hydroxypropylstearate
-
ME473860
-
-
2.1
No results
Hydroxytetramethylhexadecyltrimethylbenzoquinone
-
ME473861
-
-
2.0
No results
Hydroxytrihydroxyoctadecanylpentadecanimidic acid
-
ME473862
-
-
2.0
No results
Imidazolemethanol
-
ME473866
-
-
6.0
No results
iminoquinoline
-
ME473867
-
-
2.7
No results
Kainic Acid
-
ME473874
-
-
11.2
No results
Lacosamide
-
ME473876
-
-
13.3
No results
Laurilsulfate
-
ME473879
-
-
1.3
No results
Leucineamide
-
ME473881
-
-
27.1
Full match
Linalylbutyrate
-
ME473885
-
-
1.6
No results
Linalyl propanoate
-
ME473884
-
-
2.2
No results
Lysophosphatidylinositol
-
ME473890
-
-
4.2
No results
Menthylisovalerate
-
ME473892
-
-
1.7
No results
Mercaptobenzothiazole
-
ME473893
-
-
1.7
No results
Methoxybipyrrolecarbaldehyde
-
ME473897
-
-
2.5
No results
methoxyvinylcarboline
-
ME473898
-
-
2.3
No results
Methylazabicyclooctylmethylbutenoate
-
ME473900
-
-
2.2
No results
Methylbutyrylcarnitine
-
ME473901
-
-
11.2
No results
Methylcyanopentadecanoate
-
ME473902
-
-
2.1
No results
Methyldimethyldihydroindenylimidazolecarboxylate
-
ME473903
-
-
2.1
No results
Methylhydroxypalmitate
-
ME473905
-
-
1.4
No results
Methyloxobutanoate
-
ME473907
-
-
1.4
No results
Methylsulfolene
-
ME473908
-
-
11.5
No results
Methyltetraoxahexadecane
-
ME473909
-
-
2.1
No results
Metominostrobin
-
ME473912
-
-
2.2
No results
Myristylsulfate
-
ME473916
-
-
1.3
No results
Nitrosomorpholine
-
ME473920
-
-
16.0
No results
Oxodecanoylcysteamine
-
ME473930
-
-
1.6
No results
Oxononanoate
-
ME473931
-
-
2.1
No results
Oxophosphonobutanoate
-
ME473932
-
-
12.8
No results
Oxopyridinebutanal
-
ME473933
-
-
2.2
No results
PEG4
-
ME473938
-
-
2.9
No results
Phenolphthalein
-
ME473940
-
-
2.2
No results
Piperazinecarboxylic acid
-
ME473949
-
-
16.0
No results
Quindoxin
-
ME473958
-
-
2.7
No results
Retinyl acetate
-
ME473959
-
-
1.6
No results
Ribosylnicotinate
-
ME473961
-
-
14.3
No results
Tacrine
-
ME473971
-
-
2.2
No results
Thienylalanine
-
ME473973
-
-
2.2
No results
Thiomorpholinecarboxylic acid
-
ME473974
-
-
16.0
No results
Threonine3phosphate
-
ME473976
-
-
12.5
No results
UDPacetylglucosamine
-
ME473988
-
-
9.5
Full match
Undecylbenzenesulfonic acid
-
ME473990
-
-
1.3
No results
Uridinediphosphogalactose
-
ME473995
-
-
10.3
Full match
Vinylpyridine
-
ME473998
-
-
2.2
No results
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