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Return to study ST001250 main page
Analysis: Other POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
SAM+
S-Adenosylmethionine
ME292834
-
C00019
-
-
SAH
S-Adenosylhomocysteine
ME292833
-
C00021
-
-
Glu
Glutamic acid
ME292768
-
C00025
-
-
Gly
Glycine
ME292770
-
C00037
-
-
Ala
Alanine
ME292732
-
C00041
-
-
Lys
Lysine
ME292795
-
C00047
-
-
Asp
Aspartic acid
ME292740
-
C00049
-
-
Arg
Arginine
ME292738
-
C00062
-
-
Gln
Glutamine
ME292767
-
C00064
-
-
Ser
Serine
ME292837
-
C00065
-
-
Met
Methionine
ME292797
-
C00073
-
-
Ornithine
Ornithine
ME292818
-
C00077
-
-
Trp
Tryptophan
ME292849
-
C00078
-
-
Phe
Phenylalanine
ME292820
-
C00079
-
-
Tyr
Tyrosine
ME292850
-
C00082
-
-
Urea
Urea
ME292853
-
C00086
-
-
Cys
Cysteine
ME292754
-
C00097
-
-
beta-Ala
beta-Alanine
ME292741
-
C00099
-
-
Uracil
Uracil
ME292852
-
C00106
-
-
Choline
Choline
ME292749
-
C00114
-
-
Leu
Leucine
ME292794
-
C00123
-
-
Putrescine(1,4-Butanediamine)
Putrescine
ME292826
-
C00134
-
-
His
Histidine
ME292778
-
C00135
-
-
N-Acetylglucosamine
N-Acetylglucosamine
ME292800
-
C00140
-
-
Adenine
Adenine
ME292728
-
C00147
-
-
Pro
Proline
ME292824
-
C00148
-
-
Asn
Asparagine
ME292739
-
C00152
-
-
Nicotinamide
Niacinamide
ME292815
-
C00153
-
-
Homocysteine
Homocysteine
ME292780
-
C00155
-
-
5-Methylthioadenosine
5'-Methylthioadenosine
ME292723
-
C00170
-
-
Thymine
Thymine
ME292845
-
C00178
-
-
Agmatine
Agmatine
ME292731
-
C00179
-
-
Val
Valine
ME292856
-
C00183
-
-
Thr
Threonine
ME292843
-
C00188
-
-
Adenosine
Adenosine
ME292729
-
C00212
-
-
Sarcosine
Sarcosine
ME292835
-
C00213
-
-
Thymidine
Thymidine
ME292844
-
C00214
-
-
Guanine
Guanine
ME292776
-
C00242
-
-
Taurine
Taurine
ME292840
-
C00245
-
-
Pyridoxal
Pyridoxal
ME292827
-
C00250
-
-
Riboflavin
Riboflavin
ME292830
-
C00255
-
-
Hypoxanthine
Hypoxanthine
ME292785
-
C00262
-
-
Homoserine
Homoserine
ME292782
-
C00263
-
-
Inosine
Inosine
ME292790
-
C00294
-
-
Uridine
Uridine
ME292854
-
C00299
-
-
Creatine
Creatine
ME292751
-
C00300
-
-
Spermidine
Spermidine
ME292839
-
C00315
-
-
Carnitine
Carnitine
ME292747
-
C00318
-
-
Citrulline
Citrulline
ME292750
-
C00327
-
-
Kynurenine
Kynurenine
ME292793
-
C00328
-
-
Glucosamine
Glucosamine
ME292769
-
C00329
-
-
2'-Deoxyguanosine
Deoxyguanosine
ME292709
-
C00330
-
-
GABA
gamma-Aminobutyric acid
ME292764
-
C00334
-
-
Thiamine
Thiamine
ME292841
-
C00378
-
-
Cytosine
Cytosine
ME292759
-
C00380
-
-
Xanthine
Xanthine
ME292857
-
C00385
-
-
Carnosine
Carnosine
ME292748
-
C00386
-
-
Guanosine
Guanosine
ME292777
-
C00387
-
-
Histamine
Histamine
ME292779
-
C00388
-
-
Ile
Isoleucine
ME292786
-
C00407
-
-
Pipecolate
Pipecolic acid
ME292823
-
C00408
-
-
Dihydrouracil
Dihydrouracil
ME292761
-
C00429
-
-
5-Aminolevulinate
5-Amino-levulinic acid
ME292718
-
C00430
-
-
5-Aminovalerate
5-Aminopentanoic acid
ME292719
-
C00431
-
-
N-Acetylornithine
N-Acetylornithine
ME292803
-
C00437
-
-
Saccharopine
Saccharopine
ME292832
-
C00449
-
-
Cytidine
Cytidine
ME292758
-
C00475
-
-
Tyramine
Tyramine
ME292851
-
C00483
-
-
Cystine
Cystine
ME292757
-
C00491
-
-
Hypotaurine
Hypotaurine
ME292784
-
C00519
-
-
Pyridoxamine
Pyridoxamine
ME292828
-
C00534
-
-
p-Aminobenzoate
p-Aminobenzoic acid
ME292819
-
C00568
-
-
Cyclohexylamine
Cyclohexylamine
ME292753
-
C00571
-
-
Betaine aldehyde
Betaine aldehyde
ME292744
-
C00576
-
-
Guanidinoacetate
Guanidoacetic acid
ME292774
-
C00581
-
-
Phosphorylcholine
Choline phosphate
ME292822
-
C00588
-
-
N1-Acetylspermidine
N1-Acetylspermidine
ME292810
-
C00612
-
-
3-Hydroxyanthranilate
3-Hydroxyanthranilic acid
ME292713
-
C00632
-
-
Indole-3-acetaldehyde
Indoleacetaldehyde
ME292788
-
C00637
-
-
Pyridoxamine 5'-phosphate
Pyridoxamine 5'-phosphate
ME292829
-
C00647
-
-
Glycerophosphorylcholine
sn-Glycero-3-phosphocholine
ME292773
-
C00670
-
-
Pterin
Pterin
ME292825
-
C00715
-
-
Betaine
Betaine
ME292743
-
C00719
-
-
Serotonin
Serotonin
ME292838
-
C00780
-
-
Urocanate
Urocanic acid
ME292855
-
C00785
-
-
Creatinine
Creatinine
ME292752
-
C00791
-
-
2'-Deoxycytidine
Deoxycytidine
ME292708
-
C00881
-
-
alpha-Aminoadipate
Aminoadipic acid
ME292735
-
C00956
-
-
O-Acetylserine
O-Acetylserine
ME292817
-
C00979
-
-
1,3-Diaminopropane
1,3-Diaminopropane
ME292705
-
C00986
-
-
Ala-Ala
Ala-Ala
ME292733
-
C00993
-
-
Trigonelline
Trigonelline
ME292846
-
C01004
-
-
Trimethylsulfonium
Trimethyl sulfonium
ME292848
-
C01008
-
-
Hydroxyproline
Hydroxyproline
ME292783
-
C01015
-
-
N,N-Dimethylglycine
Dimethylglycine
ME292809
-
C01026
-
-
N8-Acetylspermidine
N8-Acetylspermidine
ME292814
-
C01029
-
-
gamma-Guanidinobutyrate
4-Guanidinobutanoic acid
ME292766
-
C01035
-
-
N-Methylglutamate
N-Methyl-glutamic acid
ME292808
-
C01046
-
-
Thiamine monophosphate
Thiamine monophosphate
ME292842
-
C01081
-
-
Trimethylamine N-oxide
Trimethylamine N-oxide
ME292847
-
C01104
-
-
3-Methylhistidine
3-Methylhistidine
ME292715
-
C01152
-
-
gamma-Butyrobetaine
3-Dehydroxycarnitine
ME292765
-
C01181
-
-
1-Aminocyclopropane-1-carboxylate
1-Aminocyclopropanecarboxylic acid
ME292701
-
C01234
-
-
N-Acetylglucosylamine
N-Acetyl-beta-glucosaminylamine
ME292801
-
C01239
-
-
Anserine
Anserine
ME292737
-
C01262
-
-
Allantoin
Allantoin
ME292734
-
C01551
-
-
Cadaverine
Cadaverine
ME292746
-
C01672
-
-
Homocystine
Homocystine
ME292781
-
C01817
-
-
Acetylcholine
Acetylcholine
ME292727
-
C01996
-
-
Gly-Gly
Gly-Gly
ME292771
-
C02037
-
-
Alpha-Methylserine
Alpha-Methylserine
ME292736
-
C02115
-
-
Gly-Leu
Gly-Leu
ME292772
-
C02155
-
-
7-Methylguanine
7-Methylguanine
ME292725
-
C02242
-
-
Cystathionine
Cystathionine
ME292755
-
C02291
-
-
Methylguanidine
Methylguanidine
ME292799
-
C02294
-
-
2AB
2S-Aminobutyric acid
ME292710
-
C02356
-
-
5-Methylcytosine
5-Methylcytosine
ME292722
-
C02376
-
-
6-Aminohexanoate
Aminocaproic acid
ME292724
-
C02378
-
-
Xanthurenate
Xanthurenic acid
ME292858
-
C02470
-
-
1-Methyladenosine
1-Methyladenosine
ME292702
-
C02494
-
-
o-Acetylcarnitine
CAR 2:0
ME292816
-
C02571
-
-
Isoamylamine
3-Methyl-1-butylamine
ME292791
-
C02640
-
-
Indole-3-acetamide
1H-Indole-3-acetamide
ME292789
-
C02693
-
-
N-Acetylputrescine
N-Acetylputrescine
ME292804
-
C02714
-
-
N-Methylalanine
N-Methylalanine
ME292807
-
C02721
-
-
N-epsilon-Acetyllysine
N6-Acetyllysine
ME292806
-
C02727
-
-
Imidazole-4-acetate
Imidazoleacetic acid
ME292787
-
C02835
-
-
1-Methylnicotinamide
1-Methyl nicotinamide
ME292704
-
C02918
-
-
7,8-Dihydrobiopterin
7,8-Dihydrobiopterin
ME292726
-
C02953
-
-
Methionine sulfoxide
Methionine sulfoxide
ME292798
-
C02989
-
-
N-Acetylhistidine
N-Acetylhistidine
ME292802
-
C02997
-
-
Guanidinosuccinate
Guanidinosuccinic acid
ME292775
-
C03139
-
-
S-Methylmethionine
S-Methylmethionine
ME292831
-
C03172
-
-
2,4-Diaminobutyrate
2,4-Diaminobutyric acid
ME292707
-
C03283
-
-
N1,N12-Diacetylspermine
N1,N12-Diacetylspermine
ME292811
-
C03413
-
-
Mannosamine
2-Amino-2-deoxy-D-mannose
ME292796
-
C03570
-
-
ADMA
Dimethylarginine
ME292730
-
C03626
-
-
Dopamine
Dopamine
ME292762
-
C03758
-
-
N6,N6,N6-Trimethyllysine
N-6-Trimethyllysine
ME292813
-
C03793
-
-
1-Methylhistamine
1-Methylhistamine
ME292703
-
C05127
-
-
4-(beta-Acetylaminoethyl)imidazole
N-Acetylhistamine
ME292716
-
C05135
-
-
3-Aminoisobutyrate
3-Aminoisobutanoic acid
ME292711
-
C05145
-
-
Phenethylamine
Phenylethylamine
ME292821
-
C05332
-
-
4-Hydroxymethylimidazole
Imidazole-4-methanol
ME292717
-
C05562
-
-
beta-Imidazolelactate
Imidazolelactic acid
ME292742
-
C05568
-
-
5-Hydroxyindoleacetate
5-Hydroxyindoleacetic acid
ME292720
-
C05635
-
-
Isopropanolamine
Isopropanolamine
ME292792
-
C05771
-
-
3-Aminopropane-1,2-diol
(S)-3-Amino-1,2-propanediol
ME292712
-
C06057
-
-
Ectoine
Ectoine
ME292763
-
C06231
-
-
Diethanolamine
Diethanolamine
ME292760
-
C06772
-
-
Betonicine
Betonicine
ME292745
-
C08269
-
-
5-Hydroxylysine
5-Hydroxylysine
ME292721
-
C16741
-
-
2-Hydroxypentanoate
2-Hydroxyvaleric acid
ME292706
-
-
-
-
3-Indoxyl sulfate
Indoxyl sulfate
ME292714
-
-
-
-
Cysteine-glutathione disulphide -Divalent
-
ME292756
-
-
-
-
N1,N8-Diacetylspermidine
N1,N8-Diacetylspermidine
ME292812
-
-
-
-
N-Acetylvaline
N-Acetylvaline
ME292805
-
-
-
-
SDMA
Symmetric dimethylarginine
ME292836
-
-
-
-
Analysis: Other NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
NAD+
NAD
ME292913
-
C00003
-
-
ADP
ADP
ME292875
-
C00008
-
-
AMP
AMP
ME292877
-
C00020
-
-
Acetyl CoA
Acetyl-CoA
ME292874
-
C00024
-
-
2-Oxoglutarate
2-Oxoglutaric acid
ME292863
-
C00026
-
-
UDP-glucose
UDP-glucose
ME292928
-
C00029
-
-
Succinate
Succinic acid
ME292923
-
C00042
-
-
UDP-N-acetylglucosamine
UDP-N-acetylglucosamine
ME292929
-
C00043
-
-
CMP
CMP
ME292886
-
C00055
-
-
G6P
Glucose 6-phosphate
ME292892
-
C00092
-
-
Glycerophosphate
sn-Glycero-3-phosphate
ME292895
-
C00093
-
-
UMP
UMP
ME292930
-
C00105
-
-
Citrate
Citric acid
ME292885
-
C00158
-
-
Glycolate
Glycolic acid
ME292896
-
C00160
-
-
Propionate
Propionic acid
ME292922
-
C00163
-
-
Lactate
Lactic acid
ME292901
-
C00186
-
-
Glucuronate
Glucuronic acid
ME292893
-
C00191
-
-
4-Methyl-2-oxopentanoate
Ketoleucine
ME292871
-
C00233
-
-
Butyrate
Butyric acid
ME292880
-
C00246
-
-
Nicotinate
Nicotinic acid
ME292914
-
C00253
-
-
N-Acetylneuraminate
N-Acetylneuraminic acid
ME292911
-
C00270
-
-
Orotate
Orotic acid
ME292915
-
C00295
-
-
Isocitrate
Isocitric acid
ME292900
-
C00311
-
-
N-Acetylglucosamine 6-phosphate
N-Acetyl-glucosamine 6-phosphate
ME292908
-
C00357
-
-
dTMP
dTMP
ME292891
-
C00364
-
-
Urate
Uric acid
ME292931
-
C00366
-
-
Malonate
Malonic acid
ME292903
-
C00383
-
-
cis-Aconitate
cis-Aconitic acid
ME292883
-
C00417
-
-
Carbamoylaspartate
Carbamoylaspartate
ME292881
-
C00438
-
-
Glutarate
Glutaric acid
ME292894
-
C00489
-
-
Allantoate
Allantoic acid
ME292876
-
C00499
-
-
Cysteate
Cysteic acid
ME292887
-
C00506
-
-
N-Acetylglutamate
N-Acetylglutamic acid
ME292909
-
C00624
-
-
2,5-Dihydroxybenzoate
Gentisic acid
ME292864
-
C00628
-
-
Isobutyryl CoA
Isobutyryl-CoA
ME292899
-
C00630
-
-
p-Hydroxyphenylacetate
4-Hydroxyphenylacetic acid
ME292916
-
C00642
-
-
Cholate
Cholic acid
ME292882
-
C00695
-
-
Malate
Malic acid
ME292902
-
C00711
-
-
Pentanoate
Valeric acid
ME292918
-
C00803
-
-
Pantothenate
Pantothenic acid
ME292917
-
C00864
-
-
Mucate
Galactaric acid
ME292904
-
C00879
-
-
N-Acetylaspartate
N-Acetylaspartic acid
ME292906
-
C01042
-
-
N-Formylaspartate
N-Formyl-aspartic acid
ME292912
-
C01044
-
-
N-Acetyl-beta-alanine
N-Acetyl-beta-alanine
ME292905
-
C01073
-
-
3-Hydroxybutyrate
3-Hydroxybutyric acid
ME292867
-
C01089
-
-
4-Methylthio-2-oxobutyrate
2-Oxo-4-methylthiobutanoic acid
ME292872
-
C01180
-
-
Hippurate
Hippuric acid
ME292897
-
C01586
-
-
Threonate
Threonic acid
ME292926
-
C01620
-
-
3-(4-Hydroxyphenyl)propionate
Desaminotyrosine
ME292865
-
C01744
-
-
5-Oxoproline
Pyroglutamic acid
ME292873
-
C01879
-
-
trans-Aconitate
trans-Aconitic acid
ME292927
-
C02341
-
-
2-Isopropylmalate
2-Isopropylmalic acid
ME292862
-
C02504
-
-
Citramalate
Citramalic acid
ME292884
-
C02614
-
-
2-Hydroxyglutarate
2-Hydroxyglutaric acid
ME292861
-
C02630
-
-
3-Ureidopropionate
Ureidopropionic acid
ME292870
-
C02642
-
-
Pimelate
Pimelic acid
ME292920
-
C02656
-
-
Dodecanedioate
Dodecanedioic acid
ME292890
-
C02678
-
-
N-Acetylmethionine
N-Acetylmethionine
ME292910
-
C02712
-
-
Argininosuccinate
Argininosuccinic acid
ME292878
-
C03406
-
-
threo-beta-methylaspartate + Glu
-
ME292925
-
C03618
-
-
3-Hydroxy-3-methylglutarate
3-Hydroxymethylglutaric acid
ME292866
-
C03761
-
-
Deoxycholic acid
Deoxycholic acid
ME292889
-
C04483
-
-
N-Acetylglucosamine 1-phosphate
N-Acetylglucosamine 1-phosphate
ME292907
-
C04501
-
-
Taurocholate
Taurocholic acid
ME292924
-
C05122
-
-
Isethionate
2-Hydroxyethanesulfonate
ME292898
-
C05123
-
-
Phenaceturate
Phenylacetylglycine
ME292919
-
C05598
-
-
3-Phenyllactate
Phenyllactic acid
ME292869
-
C05607
-
-
Cysteine S-sulfate
Cysteine-S-sulfate
ME292888
-
C05824
-
-
2-Hydroxybutyrate
2-Hydroxybutyric acid
ME292860
-
C05984
-
-
2-Deoxyglucose 6-phosphate
2-Deoxy-D-glucose 6-phosphate
ME292859
-
C06369
-
-
Azelate
Azelaic acid
ME292879
-
C08261
-
-
3-Methylbutanoate
Isovaleric acid
ME292868
-
C08262
-
-
Proline betaine
Proline betaine
ME292921
-
C10172
-
-
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