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Return to study ST002473 main page
Analysis: HILIC POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
cyclohexylamine
Cyclohexylamine
ME584860
-
-
6.43
100.112
cadaverine
Cadaverine
ME584852
-
-
9.31
103.123
dimethylglycine
Dimethylglycine
ME584864
-
-
8.47
104.0706
GABA
gamma-Aminobutyric acid
ME584866
-
-
7.54
104.0706
choline
Choline
ME584856
-
-
8.26
104.1069
serine
Serine
ME584936
-
-
7.62
106.0499
cytosine
Cytosine
ME584862
-
-
6.14
112.0506
histamine
Histamine
ME584873
-
-
9.23
112.087
creatinine
Creatinine
ME584859
-
-
6.44
114.0664
proline
Proline
ME584927
-
-
8.05
116.0707
guanidinoacetic acid
Guanidoacetic acid
ME584870
-
-
7.83
118.0613
betaine
Betaine
ME584850
-
-
8.9
118.0863
valine
Valine
ME584950
-
-
7.37
118.0863
threonine
Threonine
ME584942
-
-
7.56
120.0658
niacinamide
Niacinamide
ME584914
-
-
3.69
123.0556
nicotinate
Nicotinic acid
ME584915
-
-
3.69
124.0373
taurine
Taurine
ME584940
-
-
6.06
126.0221
5-methylcytosine
5-Methylcytosine
ME584834
-
-
6.25
126.0663
valine-d8
Valine
ME584815
-
-
7.39
126.1366
imidazoleacetic acid
Imidazoleacetic acid
ME584879
-
-
8.03
127.0503
pyroglutamic acid
Pyroglutamic acid
ME584933
-
-
6.56
130.0499
pipecolic acid
Pipecolic acid
ME584924
-
-
7.94
130.0863
N-acetylputrescine
N-Acetylputrescine
ME584909
-
-
7.9
131.1179
agmatine
Agmatine
ME584840
-
-
9.16
131.1291
N-acetylalanine
N-Acetylalanine
ME584901
-
-
3.88
132.0655
hydroxyproline
Hydroxyproline
ME584878
-
-
7.84
132.0656
creatine
Creatine
ME584858
-
-
8.27
132.0767
isoleucine
Isoleucine
ME584881
-
-
7.06
132.1018
leucine
Leucine
ME584884
-
-
6.93
132.1018
asparagine
Asparagine
ME584847
-
-
7.86
133.0607
N-carbamoyl-beta-alanine
Ureidopropionic acid
ME584913
-
-
4.1
133.0608
ornithine
Ornithine
ME584918
-
-
9.24
133.0971
aspartate
Aspartic acid
ME584848
-
-
7.82
134.0448
allopurinol
Allopurinol
ME584842
-
-
3.69
137.0456
anthranilic acid
2-Aminobenzoic acid
ME584845
-
-
1.86
138.0548
trigonelline
Trigonelline
ME584944
-
-
8.8
138.0548
tyramine
Tyramine
ME584947
-
-
6.3
138.0912
urocanic acid
Urocanic acid
ME584949
-
-
4.52
139.0501
histidinol
L-Histidinol
ME584875
-
-
9.08
142.0974
ectoine
Ectoine
ME584865
-
-
8.84
143.0814
proline-betaine
Proline betaine
ME584928
-
-
9.17
144.1018
4-acetamidobutanoate
4-Acetamidobutanoic acid
ME584827
-
-
3.34
146.081
4-guanidinobutanoic acid
4-Guanidinobutanoic acid
ME584828
-
-
7.26
146.0923
acetylcholine
Acetylcholine
ME584836
-
-
7.74
146.1174
butyrobetaine
3-Dehydroxycarnitine
ME584851
-
-
8.74
146.1174
spermidine
Spermidine
ME584939
-
-
11.35
146.1652
glutamine
Glutamine
ME584868
-
-
8.04
147.0763
lysine
Lysine
ME584887
-
-
9.32
147.1126
glutamate
Glutamic acid
ME584867
-
-
7.58
148.0603
N-acetylserine
N-Acetylserine
ME584910
-
-
5.59
148.0603
methionine
Methionine
ME584888
-
-
7.01
150.0582
S-methyl-L-cysteine-S-oxide
S-Methylcysteine S-oxide
ME584938
-
-
8.63
152.0385
6-mercaptopurine
-
ME584816
-
-
2.91
153.0228
xanthine
Xanthine
ME584951
-
-
3.65
153.0406
N1-methyl-2-pyridone-5-carboxamide
N1-Methyl-2-pyridone-5-carboxamide
ME584895
-
-
4.2
153.0657
histidine
Histidine
ME584874
-
-
9.23
156.0767
tryptamine
Tryptamine
ME584945
-
-
6.13
161.1072
N6-methyllysine
N(6)-Methyllysine
ME584897
-
-
9.67
161.1284
carnitine
Carnitine
ME584853
-
-
8.78
162.1124
pterin
Pterin
ME584930
-
-
4.71
164.0566
methionine sulfoxide
Methionine sulfoxide
ME584889
-
-
8.57
166.0532
7-methylguanine
7-Methylguanine
ME584835
-
-
5.73
166.0723
phenylalanine
Phenylalanine
ME584922
-
-
6.69
166.0861
3-methoxyanthranilate
3-Methoxyanthranilic acid
ME584824
-
-
1.76
168.0655
3-methoxytyramine
3-Methoxytyramine
ME584825
-
-
6.36
168.1019
pyridoxine
Pyridoxine
ME584932
-
-
6.03
170.0811
1-methylhistidine
1-Methylhistidine
ME584820
-
-
10.06
170.0924
3-methylhistidine
3-Methylhistidine
ME584826
-
-
9.84
170.0924
progesterone
Progesterone
ME584925
-
-
8.68
173.0921
pro-gly
Pro-Gly
ME584926
-
-
8.24
173.0921
N-acetylleucine
N-Acetylleucine
ME584905
-
-
2.91
174.1125
phenylalanine-d8
Phenylalanine
ME584814
-
-
6.72
174.1364
1H-indole-3cetamide
-
ME584818
-
-
2.39
175.0866
N-acetylornithine
N-Acetylornithine
ME584907
-
-
8.45
175.1077
arginine
Arginine
ME584846
-
-
9.12
175.1188
N6,N6-dimethyllysine
N(6),N(6)-Dimethyl-lysine
ME584898
-
-
10.25
175.1441
N-acetylaspartic acid
N-Acetylaspartic acid
ME584902
-
-
4.21
176.0554
citrulline
Citrulline
ME584857
-
-
8.3
176.103
serotonin
Serotonin
ME584937
-
-
6.44
177.1022
5-hydroxytryptophol
5-Hydroxytryptophol
ME584831
-
-
1.99
178.0863
hippurate
Hippuric acid
ME584872
-
-
2.55
180.0655
nicotinuric acid
Nicotinuric acid
ME584916
-
-
5.95
181.0608
tyrosine
Tyrosine
ME584948
-
-
6.79
182.0812
4-pyridoxate
4-Pyridoxic acid
ME584829
-
-
4.2
184.0604
phosphocholine
Choline phosphate
ME584923
-
-
12.02
184.0734
N1-acetylspermidine
N1-Acetylspermidine
ME584893
-
-
9.87
188.1758
N-acetylglutamine
N-Acetylglutamine
ME584903
-
-
6.92
189.087
leu-gly
Leu-Gly
ME584885
-
-
7.47
189.1234
N6-acetyllysine
N6-Acetyllysine
ME584900
-
-
8.32
189.1234
homoarginine
Homoarginine
ME584876
-
-
9.18
189.1346
NMMA
Targinine
ME584917
-
-
9.33
189.1346
N6,N6,N6-trimethyllysine
N-6-Trimethyllysine
ME584899
-
-
11.23
189.1598
kynurenic acid
Kynurenic acid
ME584882
-
-
5.24
190.0499
homocitrulline
Homocitrulline
ME584877
-
-
8.29
190.1186
N-acetylmethionine
N-Acetylmethionine
ME584906
-
-
3.48
192.0689
5-methoxytryptophol
5-Methoxytryptophol
ME584832
-
-
1.98
192.1019
N-acetylhistidine
N-Acetylhistidine
ME584904
-
-
8.3
198.085
ADMA
Dimethylarginine
ME584839
-
-
9.74
203.1503
SDMA
Symmetric dimethylarginine
ME584935
-
-
9.62
203.1504
C2 carnitine
CAR 2:0
ME584854
-
-
8.64
204.1231
tryptophan
Tryptophan
ME584946
-
-
6.5
205.0971
N-acetylphenylalanine
N-Acetylphenylalanine
ME584908
-
-
3.18
208.0969
dethiobiotin
Dethiobiotin
ME584863
-
-
3.57
215.139
N-alpha-acetylarginine
Pelargonidin
ME584912
-
-
8.14
217.1294
C3 carnitine
CAR 3:0
ME584855
-
-
8.3
218.1387
O-succinyl homoserine
o-Succinylhomoserine
ME584919
-
-
8.18
220.0815
pantothenate
Pantothenic acid
ME584920
-
-
3.11
220.1179
5-hydroxytryptophan
5-Hydroxy-tryptophan
ME584830
-
-
6.69
221.092
acetyl-galactosamine
N-Acetylgalactosamine
ME584837
-
-
5.32
222.0972
myristoleate
Myristoleic acid
ME584892
-
-
1.75
227.2005
2-deoxycytidine
Deoxycytidine
ME584822
-
-
5.96
228.0979
thymidine
Thymidine
ME584943
-
-
2.79
243.0975
cytidine
Cytidine
ME584861
-
-
5.83
244.0927
pseudouridine
Pseudouridine
ME584929
-
-
4.12
245.0767
N1-acetylspermine
N1-Acetylspermine
ME584894
-
-
11.28
245.2335
N-acetyltryptophan
N-Acetyl-tryptophan
ME584911
-
-
2.96
247.1077
2-deoxyadenosine
Deoxyadenosine
ME584821
-
-
5.17
252.109
5-methylcytidine
5-Methylcytidine
ME584833
-
-
5.97
258.1083
alpha-glycerophosphocholine
sn-Glycero-3-phosphocholine
ME584844
-
-
10.39
258.1097
thiamine
Thiamine
ME584941
-
-
9.7
265.1115
phenylacetylglutamine
alpha-N-Phenylacetylglutamine
ME584921
-
-
4.67
265.1182
atenolol
Atenolol
ME584849
-
-
6.79
267.1702
adenosine
Adenosine
ME584838
-
-
4.98
268.1036
inosine
Inosine
ME584880
-
-
4.84
269.0878
allopurinol riboside
Allopurinol riboside
ME584843
-
-
4.11
269.0879
L-alpha-glutamyl-L-lysine
Glu-Lys
ME584883
-
-
9.29
276.1551
azathioprine
Azathioprine
ME584817
-
-
2.74
278.0452
guanosine
Guanosine
ME584871
-
-
5.26
284.0986
xanthosine
Xanthosine
ME584952
-
-
4.32
285.0827
methylthioadenosine
Methylthioadenosine
ME584891
-
-
4.21
298.0965
1-methylguanosine
1-Methylguanosine
ME584819
-
-
5.07
298.1143
2-methylguanosine
2-Methylguanosine
ME584823
-
-
5.24
298.1143
N2,N2-dimethylguanosine
N2,N2-Dimethylguanosine
ME584896
-
-
5.32
312.1299
linoleoyl ethanolamide
Linoleoyl-EA
ME584886
-
-
1.96
324.2894
S-adenosylhomocysteine
S-Adenosylhomocysteine
ME584934
-
-
8.08
385.1285
methylguanidine
Methylguanidine
ME584890
-
-
6.78
74.0713
glycine
Glycine
ME584869
-
-
7.88
76.0393
putrescine
Putrescine
ME584931
-
-
9.33
89.1073
alanine
Alanine
ME584841
-
-
7.76
90.055
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
isovalerate/valerate/methylbutyrate
-
ME585010
-
-
3.64
101.0608
2-aminobutyrate
2-Aminobutyric acid
ME584959
-
-
3
102.056
malonate
Malonic acid
ME585014
-
-
7.05
103.0037
alpha-hydroxybutyrate/beta-hydroxybutyrate/hydroxy...
-
ME584975
-
-
3.77
103.0401
glycerate
Glyceric acid
ME584999
-
-
4.19
105.0195
uracil
Uracil
ME585044
-
-
1.55
111.02
fumarate/maleate
Fumaric acid
ME584993
-
-
6.72
115.0037
methylmalonate
Methylmalonic acid
ME585017
-
-
7.02
117.0193
succinate
Succinic acid
ME585036
-
-
6.82
117.0193
2-hydroxy-3-methylbutyrate
2-Hydroxy-3-methylbutyric acid
ME584961
-
-
3.58
117.0557
4-hydroxybenzaldehyde
4-Hydroxybenzaldehyde
ME584967
-
-
2.51
121.0295
threitol
Threitol
ME585040
-
-
1.57
121.0506
nicotinate
Nicotinic acid
ME585020
-
-
4.06
122.0247
thymine
Thymine
ME585041
-
-
1.34
125.0359
itaconate
Itaconic acid
ME585011
-
-
6.95
129.0193
mesaconate
Mesaconic acid
ME585016
-
-
6.79
129.0193
alpha-keto-beta-methylvalerate/alpha-ketoisocaproa...
-
ME584976
-
-
3.34
129.0557
thymine-d4
Thymine
ME584953
-
-
1.35
129.0611
2-hydroxy-3-methylpentanoate/hydroxyisocaproate
-
ME584962
-
-
3.51
131.0716
aspartate
Aspartic acid
ME584979
-
-
5.1
132.0305
malate
Malic acid
ME585013
-
-
6.9
133.0145
adenine
Adenine
ME584970
-
-
2.25
134.0472
erythronate/threonate
-
ME584989
-
-
4.21
135.0302
hypoxanthine
Hypoxanthine
ME585007
-
-
3.21
135.0316
3-methylglutaconate
3E-Methylglutaconic acid
ME584965
-
-
7.26
143.035
2-aminoheptanoate
2-Aminoheptanoic acid
ME584960
-
-
2.49
144.103
adipate/methylglutarate
-
ME584971
-
-
6.63
145.051
glutamate
Glutamic acid
ME584997
-
-
5.06
146.0462
2-hydroxyglutarate
2-Hydroxyglutaric acid
ME584963
-
-
6.85
147.0299
guanine
Guanine
ME585002
-
-
2.77
150.0421
6-mercaptopurine
-
ME584956
-
-
4.67
151.0084
xanthine
Xanthine
ME585047
-
-
4.83
151.0262
adonitol/arabitol
-
ME584972
-
-
1.68
151.0615
gentisate
Gentisic acid
ME584995
-
-
4.64
153.0193
orotate
Orotic acid
ME585022
-
-
4.51
155.0098
3-methyladipate/pimelate
-
ME584964
-
-
6.66
159.0663
2-aminoadipate
alpha-Aminoadipic acid
ME584958
-
-
5.18
160.0615
anhydroDglucose/3-hydroxymethylglutarate
-
ME584978
-
-
6.69
161.0459
quinolinate
Quinolinic acid
ME585030
-
-
7.31
166.0146
PEP
Phosphoenolpyruvic acid
ME585026
-
-
9.45
166.9751
urate
Uric acid
ME585045
-
-
5.13
167.0214
norepinephrine
Norepinephrine
ME585021
-
-
2.22
168.067
alpha-glycerophosphate
sn-Glycero-3-phosphate
ME584974
-
-
7.14
171.0064
aconitate
trans-Aconitic acid
ME584969
-
-
8.66
173.0092
suberate
Suberic acid
ME585035
-
-
6.71
173.0819
hippurate
Hippuric acid
ME585005
-
-
3.87
178.051
fructose/glucose/galactose_a
Hexose
ME584991
-
-
2.61
179.0565
fructose/glucose/galactose_b
Hexose
ME584992
-
-
2.09
179.0566
homovanillate
Homovanillic acid
ME585006
-
-
4.37
181.0506
sorbitol
Sorbitol
ME585034
-
-
1.99
181.0723
4-pyridoxate
4-Pyridoxic acid
ME584968
-
-
3.75
182.0459
3-phosphoglycerate
3-Phosphoglyceric acid
ME584966
-
-
8.99
184.9857
N-acetylglutamate
N-Acetylglutamic acid
ME585019
-
-
6.59
188.057
citrate/isocitrate
Citric acid/Isocitric acid
ME584983
-
-
8.74
191.0197
quinate
Quinic acid
ME585029
-
-
4.25
191.0567
glucuronate
Glucuronic acid
ME584996
-
-
4.62
193.0354
salicylurate
Salicyluric acid
ME585032
-
-
6.09
194.0459
erythrose-4-phosphate
Erythrose 4-phosphate
ME584990
-
-
6.72
199.0013
sebacate
Sebacic acid
ME585033
-
-
6.7
201.1132
indolelactate
Indolelactic acid
ME585008
-
-
4.4
204.0666
pantothenate
Pantothenic acid
ME585024
-
-
3.89
218.1037
cystathionine
Cystathionine
ME584985
-
-
5.33
221.0606
pentose monophosphate
Ribose 5-phosphate
ME585025
-
-
7.17
229.0123
tetrahydro-1-methyl-beta-carboline-3-carboxylate
-
ME585039
-
-
3.73
229.0983
cytidine
Cytidine
ME584986
-
-
2.12
242.0787
pseudouridine
Pseudouridine
ME585028
-
-
2.31
243.0623
uridine
Uridine
ME585046
-
-
1.77
243.0625
hexose monophosphate
Fructose 6-phosphate
ME585004
-
-
7.15
259.0228
inosine
Inosine
ME585009
-
-
3.37
267.0738
N-acetylcarnosine
N-Acetylcarnosine
ME585018
-
-
3.98
267.1102
inosine-15N4
Inosine
ME584954
-
-
3.35
271.062
azathioprine
Azathioprine
ME584957
-
-
3.74
276.0309
guanosine
Guanosine
ME585003
-
-
3.02
282.0849
dCMP
dCMP
ME584987
-
-
7.42
306.0497
ranitidine
Ranitidine
ME585031
-
-
1.34
313.134
dTMP
dTMP
ME584988
-
-
7.28
321.0493
CMP
CMP
ME584984
-
-
7.45
322.0455
UMP
UMP
ME585043
-
-
7.6
323.0286
cAMP
3',5' cyclic AMP
ME584981
-
-
4.27
328.0461
sucrose/lactose/trehalose
-
ME585038
-
-
2.59
341.1098
AMP
AMP
ME584977
-
-
7.45
346.0558
GMP
GMP
ME585001
-
-
8.26
362.0516
succinyladenosine
Succinyladenosine
ME585037
-
-
7.27
382.1014
CDP
CDP
ME584982
-
-
9.49
402.0109
UDP
UDP
ME585042
-
-
9.7
402.9949
ADP
ADP
ME584973
-
-
9.64
426.0221
GDP
GDP
ME584994
-
-
10.36
442.017
glycocholate
Glycocholic acid
ME585000
-
-
3.89
464.3018
glycocholate-d4
Glycocholic acid
ME584955
-
-
3.89
468.3278
glutathione oxidized
Glutathione
ME584998
-
-
7.91
611.1447
MDA
Malondialdehyde
ME585015
-
-
5.06
71.0139
propionate
Propionic acid
ME585027
-
-
3.86
73.0295
butyrate
Butyric acid
ME584980
-
-
3.73
87.0452
oxalate
Oxalic acid
ME585023
-
-
7.28
88.9882
lactate
Lactic acid
ME585012
-
-
3.85
89.0244
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