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Return to study ST001794 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
Cyclohexanamine
Cyclohexylamine
ME415681
-
-
5.229
100.11232
Cadaverine
Cadaverine
ME415670
-
-
9.203
103.12321
gamma-aminobutyric acid
gamma-Aminobutyric acid
ME415695
-
-
7.839
104.0708
Serine
Serine
ME415874
-
-
8.79
106.05014
3-Aminophenol
3-Aminophenol
ME415598
-
-
1.501
110.06026
4-Aminophenol
4-Aminophenol
ME415608
-
-
1.382
110.06029
Cytosine
Cytosine
ME415684
-
-
6.128
112.05074
Histamine
Histamine
ME415750
-
-
8.393
112.08719
Creatinine
Creatinine
ME415679
-
-
5.102
114.06641
5,6-Dihydrouracil
Dihydrouracil
ME415613
-
-
1.796
115.05047
Proline
Proline
ME415852
-
-
7.834
116.07085
Betaine or valine
-
ME415669
-
-
7.296
118.08643
6-Aminopyridine-3-carboxamide
-
ME415618
-
-
1.881
121.03988
Phenylacetaldehyde
Phenylacetaldehyde
ME415842
-
-
5.758
121.06509
Nicotinamide
Niacinamide
ME415822
-
-
1.788
123.05547
Nicotinic acid
Nicotinic acid
ME415823
-
-
4.181
124.0396
5-Methylcytosine
5-Methylcytosine
ME415616
-
-
5.863
126.06645
Thymine
Thymine
ME415894
-
-
2.833
127.05045
cis-4-Hydroxycyclohexanecarboxylic acid
-
ME415674
-
-
1.424
127.0756
Pyroglutamic acid
Pyroglutamic acid
ME415861
-
-
8.888
130.05023
N-Methylproline
N-Methyl-proline
ME415828
-
-
7.277
130.08658
(4-Aminobutyl)guanidine
Agmatine
ME415582
-
-
9.076
131.1295
Creatine
Creatine
ME415678
-
-
8.202
132.07704
Norleucine
Norleucine
ME415830
-
-
7.128
132.1022
Isoleucine
Isoleucine
ME415769
-
-
7.309
132.10222
Ornithine
Ornithine
ME415834
-
-
9.721
133.09741
1-Methylnicotinamide
1-Methyl nicotinamide
ME415589
-
-
6.367
137.0714
Trigonelline
Trigonelline
ME415896
-
-
7.544
138.05524
Phenylethanolamine
2-Hydroxyphenethylamine
ME415846
-
-
5.594
138.09167
Urocanic acid
Urocanic acid
ME415911
-
-
3.824
139.05049
L-Histidinol
L-Histidinol
ME415784
-
-
8.544
142.09795
4-Methyl-5-thiazoleethanol
5-(2-Hydroxyethyl)-4-methylthiazole
ME415611
-
-
1.345
144.04807
4-Acetamidobutyric acid
4-Acetamidobutanoic acid
ME415607
-
-
2.336
146.08151
4-Guanidinobutyric acid
4-Guanidinobutanoic acid
ME415609
-
-
7.732
146.0928
Acetylcholine
Acetylcholine
ME415623
-
-
7.846
146.11792
N-Methylisoleucine
N-Methylisoleucine
ME415826
-
-
6.669
146.11792
N-Methylleucine
-
ME415827
-
-
6.528
146.11794
Glutamine
Glutamine
ME415717
-
-
8.72
147.07672
Lysine
Lysine
ME415792
-
-
9.675
147.11311
Glutamic acid
Glutamic acid
ME415716
-
-
8.891
148.06073
Methionine
Methionine
ME415803
-
-
7.537
150.05878
Guanine
Guanine
ME415737
-
-
6.647
152.05701
Acetaminophen
Acetaminophen
ME415621
-
-
1.387
152.07089
N-Methylanthranilic acid
2-(Methylamino)benzoic acid
ME415824
-
-
1.053
152.07091
4-Hydroxynonenal
4-Hydroxynonenal
ME415610
-
-
1.067
153.09137
4,6-Diamino-5-formamidopyrimidine
FAPy-adenine
ME415606
-
-
5.475
154.07271
N-Acetylhistamine
N-Acetylhistamine
ME415815
-
-
6.161
154.0979
Histidine
Histidine
ME415752
-
-
9.56
156.07716
Indole-3-carboxylic acid
Indole-3-carboxylic acid
ME415767
-
-
1.414
162.05524
N-Methylglutamic acid
N-Methyl-glutamic acid
ME415825
-
-
8.532
162.07648
Carnitine
Carnitine
ME415672
-
-
7.844
162.11285
Methioninesulfoxide
Methionine sulfoxide
ME415804
-
-
8.674
166.05374
Phenylalanine
Phenylalanine
ME415845
-
-
6.999
166.08662
Salicylic acid ethyl ester
-
ME415866
-
-
3.348
167.07069
2-Amino-3-methoxybenzoic acid
3-Methoxyanthranilic acid
ME415593
-
-
1.245
168.06584
3-Cyclohexyl-1,1-dimethylurea
-
ME415599
-
-
1.152
171.14952
1,4-Cyclohexanedicarboxylic acid
-
ME415585
-
-
1.499
173.08124
Gly-val
Gly-Val
ME415736
-
-
8.073
175.10822
Arginine
Arginine
ME415645
-
-
9.603
175.11937
3-Indoleacetic acid
Indoleacetic acid
ME415602
-
-
1.233
176.07097
N-Carboxyethyl-.gamma.-aminobutyric acid
N-Carboxyethyl-gamma-aminobutyric acid
ME415819
-
-
8.25
176.09218
Citrulline
Citrulline
ME415675
-
-
8.952
176.10344
4-Methylumbelliferone
4-Methylumbelliferone
ME415612
-
-
1.148
177.05498
Gly-Thr
Gly-Thr
ME415735
-
-
9.093
177.08745
Coniferylaldehyde
Coniferyl aldehyde
ME415676
-
-
0.915
179.07051
3-Amino-3-(4-hydroxyphenyl)propionic acid
-
ME415597
-
-
7.541
182.07936
Tyrosine
Tyrosine
ME415908
-
-
7.78
182.08171
Syringaldehyde
SYRINGALDEHYDE
ME415883
-
-
2.402
183.06564
n-Dodecylamine
-
ME415820
-
-
3.08
186.22209
Ala-Pro
Ala-Pro
ME415632
-
-
8.233
187.10826
N8-Acetylspermidine
N8-Acetylspermidine
ME415812
-
-
8.973
188.17632
N-epsilon-Acetyllysine
N6-Acetyllysine
ME415821
-
-
8.198
189.12392
Gly-Asn
Gly-Asn
ME415722
-
-
9.54
190.0827
Asn-Gly
Asn-Gly
ME415656
-
-
9.346
190.08287
Ala-Thr
Ala-Thr
ME415634
-
-
8.807
191.10313
Thr-Ala
Thr-Ala
ME415885
-
-
8.609
191.10313
Ser-Ser
Ser-Ser
ME415878
-
-
9.525
193.0825
Phenylacetylglycine
Phenylacetylglycine
ME415843
-
-
2.895
194.0817
Caffeine
Caffeine
ME415671
-
-
1.278
195.08795
N-Methyltyrosine
-
ME415829
-
-
7.18
196.09749
1,7-Dimethyluric acid
1,7-Dimethyluric acid
ME415586
-
-
4.489
197.06747
3,4-Dihydroxyphenylalanine (DOPA)
-
ME415596
-
-
8.394
198.07425
Ala-Ile
Ala-Ile
ME415627
-
-
7.814
203.13968
N,N-Dimethylarginine
Dimethylarginine
ME415809
-
-
9.045
203.15091
Ala-Asn
Ala-Asn
ME415625
-
-
9.325
204.0985
Asn-Ala
Asn-Ala
ME415652
-
-
8.993
204.09859
Acetylcarnitine
CAR 2:0
ME415622
-
-
7.272
204.1236
Gly-Lys
Gly-Lys
ME415730
-
-
9.904
204.13492
Tryptophan
Tryptophan
ME415904
-
-
6.973
205.09773
Ser-Val
Ser-Val
ME415880
-
-
8.224
205.1189
Dexpanthenol
Pantothenol
ME415685
-
-
1.931
206.13911
Met-Gly
Met-Gly
ME415802
-
-
7.975
207.08046
Ser-Thr
Ser-Thr
ME415879
-
-
9.251
207.09819
N-Benzyloxycarbonylglycine
N-Benzyloxycarbonylglycine
ME415818
-
-
7.844
210.07693
Cyclo(Leu-Pro)
Cyclo(-Leu-Pro)
ME415680
-
-
1.359
211.14471
Gly-His
Gly-His
ME415726
-
-
9.833
213.09895
Pro-Pro
Pro-Pro
ME415856
-
-
8.027
213.12402
Ala-Gln
Ala-Gln
ME415626
-
-
9.171
218.11403
Gln-Ala
Gln-Ala
ME415697
-
-
8.887
218.1142
Propionylcarnitine
CAR 3:0
ME415855
-
-
6.501
218.13924
Ala-Lys
Ala-Lys
ME415630
-
-
9.781
218.15048
Lys-Ala
Lys-Ala
ME415787
-
-
9.739
218.15056
Glu-Ala
Glu-Ala
ME415709
-
-
8.922
219.09818
Asn-Ser
Asn-Ser
ME415659
-
-
9.555
220.09335
Ser-Asn
Ser-Asn
ME415868
-
-
9.627
220.09349
Pantothenic acid
Pantothenic acid
ME415835
-
-
3.637
220.11845
Ser-Asp
Ser-Asp
ME415869
-
-
9.487
221.07719
Asp-Ser
Asp-Ser
ME415667
-
-
9.752
221.07739
5-Hydroxytryptophan
5-Hydroxy-tryptophan
ME415614
-
-
7.566
221.0927
Thr-Thr
Thr-Thr
ME415892
-
-
8.936
221.11382
Gly-Phe
Gly-Phe
ME415731
-
-
7.73
223.10835
N-Acetyl-D-galactosaminitol
N-Acetyl-D-galactosaminitol
ME415813
-
-
7.392
224.11346
PyroGlu-Pro
-
ME415860
-
-
8.739
227.10321
Carnosine
Carnosine
ME415673
-
-
9.701
227.11435
His-Ala
His-Ala
ME415741
-
-
9.468
227.1144
Proline-hydroxyproline
Pro-hydroxyPro
ME415853
-
-
8.666
229.11888
Leu-Pro
Leu-Pro
ME415780
-
-
7.379
229.15533
Ile-Pro
Ile-Pro
ME415761
-
-
7.277
229.15535
Pro-Asn
Pro-Asn
ME415850
-
-
8.972
230.11424
Asn-Pro
Asn-Pro
ME415657
-
-
8.788
230.11426
Asn-Val
Asn-Val
ME415661
-
-
8.248
232.12978
Gly-Arg
Gly-Arg
ME415721
-
-
9.852
232.14108
Arg-Gly
Arg-Gly
ME415644
-
-
9.903
232.1411
(R)-Butyrylcarnitine
CAR 4:0
ME415583
-
-
5.874
232.15494
Asp-Val
Asp-Val
ME415668
-
-
8.578
233.1138
Ser-Gln
Ser-Gln
ME415870
-
-
9.518
234.1091
Gln-Ser
Gln-Ser
ME415705
-
-
9.441
234.10913
Asn-Thr
Asn-Thr
ME415660
-
-
9.293
234.10918
Ser-Lys
Ser-Lys
ME415876
-
-
9.969
234.14558
Glu-Ser
Glu-Ser
ME415715
-
-
9.511
235.09312
Ser-Glu
Ser-Glu
ME415871
-
-
9.395
235.09315
Phe-Ala
Phe-Ala
ME415837
-
-
7.393
237.12398
S-succinylcysteine
SHexCer 39:0;O3
ME415881
-
-
9.333
238.03871
Cystine
Cystine
ME415682
-
-
10.035
241.03178
Anserine
Anserine
ME415640
-
-
9.638
241.13016
1-Hexadecylamine
1-Hexadecylamine
ME415587
-
-
2.021
242.28482
His-Ser
His-Ser
ME415749
-
-
9.794
243.1095
Ser-His
Ser-His
ME415872
-
-
9.902
243.10956
Cytidine
Cytidine
ME415683
-
-
7.025
244.09363
Gln-Pro
Gln-Pro
ME415704
-
-
8.668
244.12993
Pro-Lys
Pro-Lys
ME415854
-
-
9.569
244.16629
Lys-Pro
Lys-Pro
ME415796
-
-
9.658
244.16634
Glu-Pro
Glu-Pro
ME415714
-
-
8.788
245.11382
Gln-Val
Gln-Val
ME415708
-
-
8.204
246.14554
Val-Gln
Val-Gln
ME415913
-
-
8.553
246.14554
Ile-Asn
Ile-Asn
ME415758
-
-
8.361
246.1456
Arg-Ala
Arg-Ala
ME415641
-
-
9.732
246.15692
Isovaleryl-L-carnitine
CAR 4:0;3Me
ME415771
-
-
5.501
246.17061
Val-Lys
Val-Lys
ME415916
-
-
9.458
246.18198
Lys-Val
Lys-Val
ME415800
-
-
9.311
246.18202
Asn-Asn
Asn-Asn
ME415654
-
-
9.659
247.10446
N-Acetyltryptophan
N-Acetyl-tryptophan
ME415817
-
-
2.922
247.10838
Asp-Leu
Asp-Leu
ME415665
-
-
8.192
247.12958
Glu-Val
Glu-Val
ME415719
-
-
8.279
247.12959
Val-Glu
Val-Glu
ME415914
-
-
8.419
247.12959
Gln-Thr
Gln-Thr
ME415706
-
-
9.175
248.12477
Thr-Gln
Thr-Gln
ME415887
-
-
9.293
248.12485
3-Hydroxybutyrylcarnitine
CAR 4:0;3OH
ME415601
-
-
7.675
248.14989
Lys-Thr
Lys-Thr
ME415797
-
-
9.819
248.16124
Glu-Thr
Glu-Thr
ME415718
-
-
9.244
249.10883
Val-Met
Val-Met
ME415917
-
-
7.385
249.12738
Leu-Val
Leu-Val
ME415782
-
-
6.798
253.15302
Val-His
Val-His
ME415915
-
-
9.293
255.14592
His-Val
His-Val
ME415755
-
-
8.801
255.14595
His-Thr
His-Thr
ME415751
-
-
9.59
257.12503
Thr-His
Thr-His
ME415889
-
-
9.751
257.12503
Androstane-3,17-diol, (3.alpha.,5.alpha.,17.beta.)...
-
ME415639
-
-
6.832
257.22714
5-Methylcytidine
5-Methylcytidine
ME415615
-
-
6.641
258.10925
3'-O-Methylcytidine
-
ME415604
-
-
5.329
258.10928
3-Methylcytidine
3-Methylcytidine
ME415603
-
-
7.213
258.10934
glycerophosphocholine
sn-Glycero-3-phosphocholine
ME415723
-
-
8.71
258.11078
alpha-Galactosamine-1-phosphate
-
ME415636
-
-
7.207
260.05396
Leu-Gln
Leu-Gln
ME415774
-
-
8.117
260.16129
Hexanoyl-L-carnitine
CAR 6:0
ME415740
-
-
5.17
260.18628
Leu-Lys
Leu-Lys
ME415778
-
-
9.073
260.19763
Lys-Leu
Lys-Leu
ME415793
-
-
8.882
260.19781
Lys-Ile
Lys-Ile
ME415791
-
-
8.975
260.19785
PyroGlu-Met
-
ME415859
-
-
6.57
261.09122
Asn-Gln
Asn-Gln
ME415655
-
-
9.547
261.12021
Glu-Leu
Glu-Leu
ME415712
-
-
7.925
261.14517
Leu-Glu
Leu-Glu
ME415775
-
-
8.042
261.14529
Glu-Ile
Glu-Ile
ME415710
-
-
7.976
261.14532
gamma-Glutamylleucine
gamma-Glutamylleucine
ME415696
-
-
8.171
261.14536
Lys-Asn
Lys-Asn
ME415788
-
-
9.997
261.15656
Trp-Gly
Trp-Gly
ME415901
-
-
7.623
262.11932
alpha-L-Asp-L-Lys
Asp-Lys
ME415637
-
-
9.999
262.14056
Ser-Arg
Ser-Arg
ME415867
-
-
9.944
262.15182
(2R)-3-Hydroxyisovaleroylcarnitine
CAR 4:0;OH,Me
ME415581
-
-
7.291
262.16565
Asp-Glu
Asp-Glu
ME415663
-
-
9.585
263.08826
Phe-Pro
Phe-Pro
ME415847
-
-
6.993
263.13977
Val-Phe
Val-Phe
ME415918
-
-
6.78
265.15543
Thr-Phe
Thr-Phe
ME415891
-
-
7.572
267.13477
Adenosine
Adenosine
ME415624
-
-
5.134
268.1048
Inosine
Inosine
ME415768
-
-
6.425
269.08884
His-Leu
His-Leu
ME415745
-
-
8.266
269.1615
Ile-His
Ile-His
ME415760
-
-
8.952
269.16162
His-Asn
His-Asn
ME415742
-
-
9.857
270.12045
1-Octadecylamine
Octadecylamine
ME415590
-
-
1.956
270.3161
4,5,7-Trihydroxyisoflavone
Genistein
ME415605
-
-
1.15
271.06067
3-Cysteinylacetaminophen
-
ME415600
-
-
7.698
271.0755
Asp-His
Asp-His
ME415664
-
-
9.998
271.10428
Arg-Pro
Arg-Pro
ME415649
-
-
9.565
272.17242
Pro-Arg
Pro-Arg
ME415849
-
-
9.51
272.17245
2-Deoxy-2,3-dehydro-n-acetyl-neuraminic acid
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid
ME415594
-
-
9.802
274.09293
Val-Arg
Val-Arg
ME415912
-
-
9.381
274.18805
Arg-Val
Arg-Val
ME415651
-
-
9.275
274.18817
Gln-Gln
Gln-Gln
ME415699
-
-
9.451
275.13571
Lys-Gln
Lys-Gln
ME415789
-
-
9.935
275.17215
Gln-Glu
Gln-Glu
ME415700
-
-
9.325
276.11984
Ala-Trp
Ala-Trp
ME415635
-
-
7.531
276.13504
Lys-Glu
Lys-Glu
ME415790
-
-
9.918
276.15631
Thr-Arg
Thr-Arg
ME415886
-
-
9.8
276.16742
L-Saccharopine
Saccharopine
ME415786
-
-
9.895
277.14038
Thr-Gly-Thr
Thr-Gly-Thr
ME415888
-
-
9.173
278.13541
Lys-Met
Lys-Met
ME415794
-
-
9.244
278.15424
Tyr-Pro
Tyr-Pro
ME415909
-
-
7.588
279.13477
Leu-Phe
Leu-Phe
ME415779
-
-
6.351
279.17108
Asp-phe
Asp-Phe
ME415666
-
-
8.288
281.11398
1-Methyladenosine
1-Methyladenosine
ME415588
-
-
7.516
282.12057
Thr-Tyr
Thr-Tyr
ME415893
-
-
8.108
283.12976
Guanosine
Guanosine
ME415738
-
-
7.346
284.0997
His-Gln
His-Gln
ME415743
-
-
9.774
284.13611
Gln-His
Gln-His
ME415702
-
-
9.851
284.1362
His-Lys
His-Lys
ME415746
-
-
10.178
284.17261
His-Glu
His-Glu
ME415744
-
-
9.732
285.12012
Heptadecasphing-4-enine
C17 Sphingosine
ME415739
-
-
4.831
286.27484
Phenylacetyl-L-glutamine
alpha-N-Phenylacetylglutamine
ME415844
-
-
6.079
287.10114
Leu-Arg
Leu-Arg
ME415773
-
-
8.943
288.2038
Arg-Leu
Arg-Leu
ME415646
-
-
8.823
288.20392
Ile-Arg
Ile-Arg
ME415757
-
-
9.081
288.20392
Octanoylcarnitine
CAR 8:0
ME415832
-
-
4.755
288.21774
Asn-Arg
Asn-Arg
ME415653
-
-
9.939
289.16266
Arg-Asn
Arg-Asn
ME415642
-
-
10.009
289.16275
Asp-Arg
Asp-Arg
ME415662
-
-
9.971
290.14679
Phe-Gln
Phe-Gln
ME415839
-
-
8.056
294.14566
Phe-Lys
Phe-Lys
ME415841
-
-
9.002
294.18216
Lys-Phe
Lys-Phe
ME415795
-
-
8.888
294.18219
Glu-Phe
Glu-Phe
ME415713
-
-
7.995
295.12967
Ile-Tyr
Ile-Tyr
ME415765
-
-
7.22
295.1662
Leu-Tyr
Leu-Tyr
ME415781
-
-
7.129
295.1662
9-Oxo-10E,12Z-octadecadienoic acid
9-OxoODE
ME415620
-
-
1.083
295.2276
Tyr-Asn
Tyr-Asn
ME415906
-
-
8.765
296.12503
Met-Phe
Met-Phe
ME415806
-
-
6.522
297.12766
5'-Methylthioadenosine
5'-Methylthioadenosine
ME415617
-
-
2.63
298.09756
2'-O-Methylguanosine
2'-O-Methylguanosine
ME415595
-
-
5.923
298.11545
N2-Methylguanosine
2-Methylguanosine
ME415811
-
-
6.622
298.11554
7-Methylguanosine
7-Methylguanosine
ME415619
-
-
7.555
298.11572
Gly-Pro-Lys
Gly-Pro-Lys
ME415733
-
-
9.691
301.18796
Trp-Pro
Trp-Pro
ME415903
-
-
7.001
302.15073
Quercetin
Quercetin
ME415863
-
-
1.303
303.05066
Phe-His
Phe-His
ME415840
-
-
8.743
303.14594
His-Phe
His-Phe
ME415747
-
-
8.19
303.14603
Arg-Gln
Arg-Gln
ME415643
-
-
9.94
303.17847
Gln-Arg
Gln-Arg
ME415698
-
-
9.889
303.17847
Met-Arg
Met-Arg
ME415801
-
-
9.256
306.16006
Arg-Met
Arg-Met
ME415647
-
-
9.197
306.1604
N-Acetylneuraminic acid
N-Acetylneuraminic acid
ME415816
-
-
9.443
310.11417
Gln-Tyr
Gln-Tyr
ME415707
-
-
8.404
310.14056
Tyr-Gln
Tyr-Gln
ME415907
-
-
8.602
310.14056
Lys-Tyr
Lys-Tyr
ME415799
-
-
9.44
310.17706
N2,N2-Dimethylguanosine
N2,N2-Dimethylguanosine
ME415810
-
-
5.705
312.1311
Ala-Pro-Lys
Ala-Pro-Lys
ME415633
-
-
9.655
315.20346
Octadecanedioic acid
Octadecanedioic acid
ME415831
-
-
1.216
315.25363
PyroGlu-Trp
-
ME415862
-
-
6.071
316.13025
Gly-Ile-Lys
Gly-Ile-Lys
ME415727
-
-
9.181
317.21909
Gly-Leu-Lys
Gly-Leu-Lys
ME415729
-
-
9.025
317.21939
Trp-Leu
Trp-Leu
ME415902
-
-
6.167
318.18204
Ile-Trp
Ile-Trp
ME415764
-
-
6.373
318.18213
His-Tyr
His-Tyr
ME415754
-
-
8.875
319.14096
Gly-Ser-Arg
Gly-Ser-Arg
ME415734
-
-
9.932
319.17334
Arg-Phe
Arg-Phe
ME415648
-
-
8.816
322.18823
Phe-Arg
Phe-Arg
ME415838
-
-
8.878
322.18826
Gly-Pro-Arg
Gly-Pro-Arg
ME415732
-
-
9.645
329.19412
Ser-Pro-Lys
Ser-Pro-Lys
ME415877
-
-
9.771
331.19843
Ile-Ala-Lys
Ile-Ala-Lys
ME415756
-
-
9.341
331.23474
Ala-Leu-Lys
Ala-Leu-Lys
ME415629
-
-
8.989
331.23477
Ala-Ile-Lys
Ala-Ile-Lys
ME415628
-
-
9.138
331.23486
Lys-Trp
Lys-Trp
ME415798
-
-
8.898
333.1929
Met-Trp
Met-Trp
ME415807
-
-
6.56
336.13846
Tyr-Arg
Tyr-Arg
ME415905
-
-
9.375
338.18317
Pro-Pro-Lys
Pro-Pro-Lys
ME415857
-
-
9.453
341.2193
His-Trp
His-Trp
ME415753
-
-
8.219
342.15695
Ile-Pro-Ile
Ile-Pro-Ile
ME415763
-
-
6.224
342.23975
Disaccharide6
-
ME415689
-
-
9.003
343.12436
2-alpha-Mannobiose
-
ME415592
-
-
9.638
343.12445
Galactinol
Galactinol
ME415693
-
-
9.821
343.12445
Tyr-Tyr
Tyr-Tyr
ME415910
-
-
7.543
345.14545
Gly-Leu-Arg
Gly-Leu-Arg
ME415728
-
-
8.92
345.22549
Corticosterone
Corticosterone
ME415677
-
-
1.085
347.21985
Ser-Ile-Lys
Ser-Ile-Lys
ME415873
-
-
9.237
347.23004
Phe-Trp
Phe-Trp
ME415848
-
-
5.984
352.16669
Pro-Ile-Lys
Pro-Ile-Lys
ME415851
-
-
8.809
357.25058
Monoelaidin
-
ME415808
-
-
5.987
357.30093
Asn-Pro-Lys
Asn-Pro-Lys
ME415658
-
-
9.797
358.20944
Leu-Val-Lys
Leu-Val-Lys
ME415783
-
-
8.866
359.2662
Disaccharide5
-
ME415688
-
-
8.998
360.15085
Disaccharide8
-
ME415691
-
-
9.465
360.15121
Trp-Arg
Trp-Arg
ME415900
-
-
8.882
361.19925
Arg-Trp
Arg-Trp
ME415650
-
-
8.818
361.19934
Thr-Ile-Lys
Thr-Ile-Lys
ME415890
-
-
9.25
361.24557
Disaccharide4
-
ME415687
-
-
8.557
365.1062
Disaccharide1
-
ME415686
-
-
8.008
365.10629
Disaccharide7
-
ME415690
-
-
9.349
365.10638
Leu-Leu-Lys
Leu-Leu-Lys
ME415777
-
-
8.389
373.28201
Ile-Asn-Lys
Ile-Asn-Lys
ME415759
-
-
9.652
374.24078
Glu-Val-Lys
Glu-Val-Lys
ME415720
-
-
9.536
375.22482
Ser-Leu-Arg
Ser-Leu-Arg
ME415875
-
-
9.135
375.23605
His-Pro-Lys
His-Pro-Lys
ME415748
-
-
10.031
381.22525
S-Adenosyl-homocysteine
S-Adenosylhomocysteine
ME415864
-
-
8.899
385.1301
Ile-Pro-Arg
Ile-Pro-Arg
ME415762
-
-
8.796
385.25684
Glu-Ile-Lys
Glu-Ile-Lys
ME415711
-
-
9.31
389.24063
S-Adenosyl-methionine
S-Adenosylmethionine
ME415865
-
-
9.815
399.14548
Leu-Leu-Arg
Leu-Leu-Arg
ME415776
-
-
8.488
401.28809
Gln-Glu-Lys
Gln-Glu-Lys
ME415701
-
-
10.004
404.21497
Galacto/Lacto-N-biose
-
ME415694
-
-
8.879
406.13309
N-Acetyl-D-lactosamine
N-Acetyllactosamine
ME415814
-
-
8.377
406.13309
Gln-Leu-Arg
Gln-Leu-Arg
ME415703
-
-
9.313
416.26245
Lithocholylglycine
Glycolithocholic acid
ME415785
-
-
2.574
416.31683
Oleoyl-L-carnitine
CAR 18:1
ME415833
-
-
3.289
426.35873
3-cysteinylacetaminophen glucuronide
-
ME415919
-
-
9.661
447.1078
1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanola...
LPE 16:0/0:0
ME415591
-
-
5.874
454.29388
Glycocholic acid
Glycocholic acid
ME415725
-
-
6.282
466.31747
1-(1Z-Hexadecenyl)-sn-glycero-3-phosphocholine
LPC P-16:0 or LPC O-16:1
ME415584
-
-
5.465
480.34567
Androstan-3-ol-17-one 3-glucuronide
-
ME415638
-
-
6.128
484.29187
Trisaccharide1
-
ME415897
-
-
9.325
527.15948
Trisaccharide4
-
ME415899
-
-
10.006
527.15967
Trisaccharide3
-
ME415898
-
-
9.783
527.15979
Lacto-N-triaose
-
ME415772
-
-
9.554
546.20453
Stercobilin
L-Urobilin
ME415882
-
-
5.529
595.35052
Ethanolamine
Ethanolamine
ME415692
-
-
7.383
62.06034
Isorhamnetin-3-O-rutinoside
Isorhamnetin-3-O-rutinoside
ME415770
-
-
6.187
625.17828
Tetrasaccharide
-
ME415884
-
-
9.957
689.21289
Imidazole
Imidazole
ME415766
-
-
4.703
69.04492
Glycine
Glycine
ME415724
-
-
8.514
76.03946
TMAO
Trimethylamine N-oxide
ME415895
-
-
5.702
76.07588
Pentasaccharide/ maltopentaose
-
ME415836
-
-
10.275
829.28375
Putrescine
Putrescine
ME415858
-
-
9.399
89.10751
Methylglycinate
-
ME415805
-
-
5.453
90.05516
Alanine
Alanine
ME415631
-
-
8.216
90.05523
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
N-Methylalanine
N-Methylalanine
ME416083
-
-
8.894
102.0544
3-Hydroxybutyric acid
3-Hydroxybutyric acid
ME415938
-
-
1.924
103.0383
Catechol
Pyrocatechol
ME415989
-
-
1.234
109.0278
Pyrrole-2-carboxylic acid
Pyrrole-2-carboxylic acid
ME416107
-
-
7.26
110.0231
Uracil
Uracil
ME416149
-
-
2.583
111.0183
1,3 Cyclohexanedione
Cyclohexane-1,3-dione
ME415920
-
-
1.645
111.0434
Parabanic acid
Parabanic acid
ME416087
-
-
1.511
112.9975
Fumaric acid
Fumaric acid
ME416004
-
-
1.795
115.0019
Ketoisovaleric acid
Ketoisovaleric acid
ME416050
-
-
3.207
115.0384
Valine
Valine
ME416154
-
-
7.938
116.07
3-Hydroxyvaleric acid
3-Hydroxyvaleric acid
ME415939
-
-
2.151
117.054
beta-Hydroxyisovaleric acid
3-Hydroxyisovaleric acid
ME415987
-
-
1.642
117.054
Threonine
Threonine
ME416132
-
-
8.402
118.0493
Homoserine
Homoserine
ME416034
-
-
8.51
118.0494
3-Methylcatechol
-
ME415942
-
-
1.173
123.0434
4-Methylcatechol
4-Methylcatechol
ME415952
-
-
1.417
123.0435
Salicylic alcohol
2-Hydroxybenzyl alcohol
ME416112
-
-
2.923
123.0435
Taurine
Taurine
ME416123
-
-
7.901
124.0058
Citraconic acid
Citraconic acid
ME415994
-
-
1.769
129.0175
3-Methyl-2-oxovaleric acid
3-Methyl-2-oxovaleric acid
ME415941
-
-
2.932
129.054
4-Acetylbutyric acid
5-Ketocaproic acid
ME415947
-
-
1.396
129.054
N-Methylvaline
N-Methyl-valine
ME416085
-
-
7.127
130.0857
Methylsuccinic acid
Methylsuccinic acid
ME416068
-
-
2.818
131.0332
Glutaric acid
Glutaric acid
ME416015
-
-
2.913
131.0333
Asparagine
Asparagine
ME415982
-
-
8.87
131.0446
Gly-Gly
Gly-Gly
ME416020
-
-
9.126
131.0446
2-Hydroxy-4-methylpentanoic acid
Leucinic acid
ME415930
-
-
1.926
131.0696
6-Hydroxycaproic acid
6-Hydroxycaproic acid
ME415958
-
-
1.46
131.0696
Aspartic acid
Aspartic acid
ME415983
-
-
9.672
132.0286
N-Methylthreonine
-
ME416084
-
-
7.981
132.0652
2-Deoxyribose
2-Deoxy-ribose
ME415928
-
-
3.758
133.049
Adenine
Adenine
ME415966
-
-
4.848
134.0455
Threonic acid
Threonic acid
ME416131
-
-
9.672
135.0283
Hypoxanthine
Hypoxanthine
ME416037
-
-
5.105
135.0295
4-Hydroxybenzoic acid
4-Hydroxybenzoic acid
ME415948
-
-
1.676
137.0227
5-Hydroxymethyl-2-furancarboxylic acid
Sumiki's acid
ME415956
-
-
6.168
141.0177
2-Hydroxyquinoline
2-Hydroxyquinoline
ME415931
-
-
1.152
144.0437
2-Methylglutaric acid
2-Methylglutaric acid
ME415933
-
-
2.368
145.049
Tartaric acid
Tartaric acid
ME416122
-
-
10.063
149.0076
Arabinose
Arabinose
ME415975
-
-
6.42
149.044
Xylose
Xylose
ME416160
-
-
6.367
149.044
Vanillin
Vanillin
ME416157
-
-
1.032
151.0382
Arabitol or xylitol
-
ME415976
-
-
7.148
151.0596
2,6-Dihydroxybenzoic acid
2,6-Dihydroxybenzoic acid
ME415926
-
-
1.121
153.0176
4-Nitrocatechol
4-Nitrocatechol
ME415953
-
-
1.371
154.0129
Orotic acid
Orotic acid
ME416086
-
-
7.541
155.0082
Allantoin
Allantoin
ME415974
-
-
5.811
157.0351
N-Acetyl-DL-valine
-
ME416075
-
-
2.602
158.0806
Ala-Ala
Ala-Ala
ME415967
-
-
8.462
159.0759
Ser-Gly
Ser-Gly
ME416115
-
-
9.296
161.0552
Gly-Ser
Gly-Ser
ME416025
-
-
9.414
161.0553
Phenylpyruvic acid
Phenylpyruvic acid
ME416091
-
-
1.487
163.0384
3-Phenyllactic acid
Phenyllactic acid
ME415944
-
-
2.151
165.0541
monosaccharide1
-
ME416071
-
-
5.471
165.0753
3-Hydroxyacetaminophen
-
ME415937
-
-
1.876
166.0494
3,4-Dihydroxyphenylacetic acid
3,4-Dihydroxybenzeneacetic acid
ME415936
-
-
2.553
167.0334
Homogentisic acid
Homogentisic acid
ME416033
-
-
2.912
167.0334
Cysteic Acid
Cysteic acid
ME415995
-
-
9.145
167.9958
Pro-Gly
Pro-Gly
ME416101
-
-
8.4
171.076
Aconitic acid
cis-Aconitic acid
ME415965
-
-
7.878
173.0076
Dehydroascorbic acid
L-Dehydroascorbic acid
ME415996
-
-
4.66
173.0076
DL-Isocitric acid lactone
-
ME416001
-
-
8.09
173.0076
4-Ketopimelic acid
-
ME415951
-
-
3.737
173.044
Shikimic acid
Shikimic acid
ME416119
-
-
8.037
173.044
2-Propylglutaric acid
2-Propylglutaric acid
ME415934
-
-
3.652
173.0804
Val-Gly
Val-Gly
ME416153
-
-
8.498
173.0917
4,4-Dimethyl-L-glutamic acid
-
ME415946
-
-
8.197
174.0757
Ala-Ser
Ala-Ser
ME415972
-
-
9.153
175.0709
Ser-Ala
Ser-Ala
ME416114
-
-
8.949
175.0709
L-Gulono-1,4-lactone
-
ME416059
-
-
4.464
177.039
Isoxanthopterin
Isoxanthopterin
ME416049
-
-
6.651
178.0356
Hippuric acid
Hippuric acid
ME416030
-
-
3.116
178.0494
Inositol
Inositol
ME416047
-
-
7.993
179.0546
Mannose
Mannose
ME416063
-
-
7.913
179.0546
monosaccharide3
-
ME416073
-
-
7.694
179.0546
Psicose
Psicose
ME416106
-
-
5.987
179.0546
1-Methyluric acid
1-Methyluric acid
ME415925
-
-
6.097
181.0352
3,4-Dihydroxyhydrocinnamic acid
3,4-Dihydroxyhydrocinnamic acid
ME415935
-
-
1.866
181.049
Homovanillic acid
Homovanillic acid
ME416035
-
-
1.526
181.049
4-Hydroxyphenyllactic acid
4-Hydroxyphenyllactic acid
ME415950
-
-
4.423
181.0491
Mannitol
Mannitol
ME416062
-
-
7.917
181.0702
Sorbitol
Sorbitol
ME416121
-
-
7.835
181.0702
4-Pyridoxic acid
4-Pyridoxic acid
ME415954
-
-
2.954
182.0444
Pro-Ala
Pro-Ala
ME416097
-
-
8.052
185.0917
N-Acetyl-L-glutamine
N-Acetylglutamine
ME416078
-
-
8.748
187.071
Gly-Ile
Gly-Ile
ME416022
-
-
7.88
187.1074
10-Hydroxydecanoic acid
10-Hydroxydecanoic acid
ME415921
-
-
1.291
187.1324
Kynurenic acid
Kynurenic acid
ME416051
-
-
6.328
188.034
Gly-Gly-Gly
Gly-Gly-Gly
ME416021
-
-
9.348
188.0663
Gly-Asp
Gly-Asp
ME416016
-
-
9.352
189.0503
5-Hydroxy-3-indoleacetic acid
5-Hydroxyindoleacetic acid
ME415955
-
-
1.965
190.0495
N-Acetyl-L-methionine
N-Acetylmethionine
ME416079
-
-
3.23
190.0528
Scopoletin
Scopoletin
ME416113
-
-
1.043
191.0333
Quinic acid
Quinic acid
ME416109
-
-
9.684
191.0546
2-Ketogluconic acid
-
ME415932
-
-
8.719
193.034
Ferulic acid
trans-Ferulic acid
ME416003
-
-
1.417
193.0491
Methyl-beta-galactopyranoside
-
ME416067
-
-
5.439
193.0704
4-Hydroxyhippuric acid
4-Hydroxyhippuric acid
ME415949
-
-
5.916
194.0445
N-Acetylhistidine
N-Acetylhistidine
ME416077
-
-
8.234
196.0714
Pro-Ser
Pro-Ser
ME416103
-
-
8.734
201.0867
Ala-Leu
Ala-Leu
ME415970
-
-
7.764
201.1231
Gln-Gly
Gln-Gly
ME416008
-
-
9.233
202.082
Ala-Asp
Ala-Asp
ME415968
-
-
9.079
203.066
Gly-Glu
Gly-Glu
ME416019
-
-
9.241
203.066
Val-Ser
Val-Ser
ME416156
-
-
8.486
203.1023
N-Cinnamoylglycine
Cinnamoylglycine
ME416082
-
-
2.967
204.0652
Gly-Met
Gly-Met
ME416023
-
-
8.039
205.0639
Thr-Ser
Thr-Ser
ME416135
-
-
9.25
205.0816
N-Acetyl-L-phenylalanine
N-Acetylphenylalanine
ME416080
-
-
2.595
206.0809
His-Gly
His-Gly
ME416031
-
-
9.666
211.0824
Indoxyl sulfate
Indoxyl sulfate
ME416046
-
-
1.393
212.0008
monosaccharide2
-
ME416072
-
-
7.505
215.0315
Pro-Thr
Pro-Thr
ME416104
-
-
8.363
215.1024
Thr-Pro
Thr-Pro
ME416134
-
-
8.237
215.1024
Ala-Glu
Ala-Glu
ME415969
-
-
8.99
217.0816
Ile-Ser
Ile-Ser
ME416044
-
-
8.16
217.118
Thr-Val
Thr-Val
ME416136
-
-
7.908
217.1181
N-Acetylmannosamine
N-Acetyl-mannosamine
ME416081
-
-
7.147
220.0814
Phe-Gly
Phe-Gly
ME416089
-
-
7.666
221.0919
Sinapic acid
Sinapic acid
ME416120
-
-
1.515
223.0598
2'-Deoxycytidine
Deoxycytidine
ME415927
-
-
6.134
226.082
2-Deoxyuridine
Deoxyuridine
ME415929
-
-
3.325
227.066
trans-Traumatic acid
Traumatic acid
ME416138
-
-
1.431
227.1275
Phlorobenzophenone
-
ME416096
-
-
1.494
229.0525
Pro-Asp
Pro-Asp
ME416098
-
-
8.69
229.0818
Ile-Val
Ile-Val
ME416045
-
-
6.903
229.1545
Val-Leu
Val-Leu
ME416155
-
-
6.79
229.1545
Acetaminophen sulfate
Paracetamol sulfate
ME415964
-
-
1.496
230.0113
Val-Asn
Val-Asn
ME416151
-
-
8.708
230.1134
Val-Asp
Val-Asp
ME416152
-
-
8.44
231.0975
Leu-Thr
Leu-Thr
ME416057
-
-
7.889
231.1339
Thr-Leu
Thr-Leu
ME416133
-
-
7.766
231.1339
Thr-Asp
Thr-Asp
ME416130
-
-
9.233
233.0767
Met-Ser
Met-Ser
ME416070
-
-
8.351
235.0746
Ser-Met
Ser-Met
ME416117
-
-
8.21
235.0746
Ala-Phe
Ala-Phe
ME415971
-
-
7.579
235.1076
Gly-Tyr
Gly-Tyr
ME416026
-
-
8.252
237.0869
7-Hydroxycoumarin sulfate
-
ME415960
-
-
1.144
240.9799
Thymidine
Thymidine
ME416137
-
-
2.738
241.0817
Pro-Gln
Pro-Gln
ME416099
-
-
8.786
242.1135
Pseudouridine
Pseudouridine
ME416105
-
-
7.14
243.061
Uridine
Uridine
ME416150
-
-
5.098
243.0611
Pro-Glu
Pro-Glu
ME416100
-
-
8.598
243.0975
Ile-Leu
Ile-Leu
ME416040
-
-
6.202
243.1702
Asn-Ile
Asn-Ile
ME415979
-
-
7.88
244.1292
Leu-Asn
Leu-Asn
ME416053
-
-
8.36
244.1292
Leu-Gly-Gly
Leu-Gly-Gly
ME416054
-
-
7.998
244.1293
Ile-Asp
Ile-Asp
ME416038
-
-
8.041
245.1132
Asn-Asp
Asn-Asp
ME415978
-
-
9.516
246.0721
Asp-Asp
Asp-Asp
ME415984
-
-
9.711
247.0561
Ser-Gly-Ser
Ser-Gly-Ser
ME416116
-
-
9.667
248.0878
Ala-Tyr
Ala-Tyr
ME415973
-
-
7.998
251.1027
His-Pro
His-Pro
ME416032
-
-
9.374
251.1141
Ile-Gln
Ile-Gln
ME416039
-
-
8.219
258.1449
Ile-Lys
Ile-Lys
ME416041
-
-
9.19
258.1814
Gln-Asp
Gln-Asp
ME416007
-
-
9.417
260.0878
Asp-Gln
Asp-Gln
ME415985
-
-
9.714
260.0879
Glu-Asn
Glu-Asn
ME416010
-
-
9.609
260.0879
Homovanillic acid sulfate
-
ME416036
-
-
1.159
261.0062
Met-Ile
Met-Ile
ME416069
-
-
6.452
261.1268
Ile-Met
Ile-Met
ME416042
-
-
6.794
261.1269
Asn-Met
Asn-Met
ME415980
-
-
8.256
262.0858
3-Methoxy-4-hydroxyphenylglycol sulfate
-
ME415940
-
-
2.953
263.0221
Met-Asp
Met-Asp
ME416064
-
-
8.341
263.0697
Abscisic acid
Abscisic acid
ME415962
-
-
1.314
263.1277
Phe-Val
Phe-Val
ME416095
-
-
6.223
263.1391
Phe-Thr
Phe-Thr
ME416093
-
-
7.696
265.1185
Ser-Tyr
Ser-Tyr
ME416118
-
-
8.419
267.0977
Tyr-Ser
Tyr-Ser
ME416146
-
-
8.547
267.0977
Leu-His
Leu-His
ME416056
-
-
8.833
267.1454
5-Hydroxymethyluridine
5-Hydroxymethyluridine
ME415957
-
-
6.473
273.0738
gamma-Glutamylglutamine
gamma-Glutamylglutamine
ME416005
-
-
9.665
274.1036
Glu-Gln
Glu-Gln
ME416011
-
-
9.488
274.1036
Glu-Lys
Glu-Lys
ME416014
-
-
9.917
274.14
L-gamma-Glutamyl-L-glutamic acid
gamma-Glutamylglutamic acid
ME416058
-
-
9.345
275.0876
Gln-Met
Gln-Met
ME416009
-
-
8.208
276.1013
Met-Glu
Met-Glu
ME416065
-
-
8.317
277.0852
Ile-Phe
Ile-Phe
ME416043
-
-
6.346
277.1547
Phe-Leu
Phe-Leu
ME416090
-
-
5.784
277.1547
Phe-Asn
Phe-Asn
ME416088
-
-
8.185
278.1136
Tyr-Val
Tyr-Val
ME416148
-
-
7.399
279.1339
Linoleic acid
Linoleic acid
ME416060
-
-
1.056
279.2316
3'-O-Methylinosine
-
ME415943
-
-
4.462
281.088
Tyr-Thr
Tyr-Thr
ME416147
-
-
8.222
281.1132
Xanthosine
Xanthosine
ME416159
-
-
7.509
283.0673
Glu-His
Glu-His
ME416013
-
-
9.894
283.1038
Epicatechin
Epicatechin
ME416002
-
-
2.95
289.0707
Tyr-Ile
Tyr-Ile
ME416145
-
-
6.877
293.1497
Asn-Tyr
Asn-Tyr
ME415981
-
-
8.476
294.1086
Asp-Tyr
Asp-Tyr
ME415986
-
-
8.807
295.0924
Tyr-Asp
Tyr-Asp
ME416144
-
-
8.475
295.0924
12(13)-Epoxy-9Z-octadecenoic acid
12(13)-EpOME
ME415922
-
-
1.098
295.2263
N-Acetyl-D-galactosamine 4-sulfate
-
ME416074
-
-
7.25
300.0384
Gly-Pro-Glu
Gly-Pro-Glu
ME416024
-
-
8.8
300.1191
Leu-Gly-Leu
Leu-Gly-Leu
ME416055
-
-
7.161
300.1917
Abietic acid
Abietic acid
ME415961
-
-
1.051
301.2159
Trp-Val
Trp-Val
ME416143
-
-
6.583
302.1499
Trp-Thr
Trp-Thr
ME416142
-
-
7.642
304.1292
Resveratrol-3-O-sulfate
-
ME416111
-
-
0.976
307.0267
Gly-Tyr-Ala
Gly-Tyr-Ala
ME416027
-
-
8.1
308.1243
Phe-Phe
Phe-Phe
ME416092
-
-
5.906
311.139
12,13-Dihydroxy-9Z-octadecenoic acid
12,13-DiHOME
ME415923
-
-
1.223
313.2371
Arbutin
Arbutin
ME415977
-
-
5.001
317.0864
Acetaminophen glucuronide
p-Acetamidophenylglucuronide
ME415963
-
-
7.895
326.087
Phe-Tyr
Phe-Tyr
ME416094
-
-
6.809
327.1338
Glu-Gly-Glu
Glu-Gly-Glu
ME416012
-
-
9.416
332.1089
N-Acetylglucosaminylasparagine
Aspartylglycosamine
ME416076
-
-
9.688
334.1245
Disaccharide9
-
ME416000
-
-
9.828
341.1076
Trehalose
Trehalose
ME416139
-
-
9.004
341.1076
Disaccharide2
-
ME415998
-
-
8.111
341.1077
Disaccharide3
-
ME415999
-
-
8.223
341.1078
Lactitol
Lactitol
ME416052
-
-
8.99
343.1233
Guanosine-3',5'-cyclic monophosphate
3',5' cyclic GMP
ME416028
-
-
8.479
344.0389
3 cysteinylacetaminophen sulfate
-
ME416161
-
-
7.646
349.0158
Chlorogenic acid
Chlorogenic acid
ME415991
-
-
7.325
353.0865
Digalacturonic acid
Digalacturonic acid
ME415997
-
-
10.303
369.0661
Geniposide
Geniposide
ME416006
-
-
4.666
387.1283
Cholic acid
Cholic acid
ME415993
-
-
2.602
407.2786
Trehalose-6-Phosphate
Trehalose 6-phosphate
ME416140
-
-
10.143
421.0741
Glycoursodeoxycholic acid AND Glycodeoxycholic aci...
-
ME416018
-
-
4.86
448.3048
Cholesterol 3-sulfate
Cholesterol sulfate
ME415992
-
-
1.157
465.3023
Isorhamnetin-3-glucoside
-
ME416048
-
-
4.685
477.1025
Taurolithocholic acid
Taurolithocholic acid
ME416127
-
-
4.625
482.2928
7.alpha.,17.alpha.-Dimethyl-5.beta.-androstane-3.a...
-
ME415959
-
-
6.195
495.2947
Tauroursodeoxycholic acid
Tauroursodeoxycholic acid
ME416129
-
-
5.528
498.2875
Trisaccharide2
-
ME416141
-
-
9.638
503.1602
Raffinose
Raffinose
ME416110
-
-
9.574
503.1603
Taurocholic acid
Taurocholic acid
ME416126
-
-
6.29
514.2821
Tauro-alpha-muricholic acid
Tauro-alpha-muricholic acid
ME416124
-
-
6.163
514.2825
Tauro-beta-muricholic acid
Tauro-beta-muricholic acid
ME416125
-
-
5.872
514.2825
1-Kestose
1-Kestose
ME415924
-
-
9.447
549.1657
Taurolithocholic acid sulfate
Taurolithocholic acid sulfate
ME416128
-
-
5.802
562.2493
Blood Group A Trisaccharide
-
ME415988
-
-
9.217
564.1689
Chenodeoxycholic acid 24-acyl-.beta.-D-glucuronide
-
ME415990
-
-
6.453
567.3158
hesperidin
Hesperidin
ME416029
-
-
5.661
609.1814
3'-Sialyllactose
3'-Sialyllactose
ME415945
-
-
9.803
632.2029
Maltotetraose
Maltotetraose
ME416061
-
-
10.111
665.2136
Methylacetate
Methyl acetate
ME416066
-
-
4.115
73.0279
Propionic acid
Propionic acid
ME416102
-
-
1.623
73.0279
Glycolic acid
Glycolic acid
ME416017
-
-
7.757
75.0071
Verbascose
Verbascose
ME416158
-
-
10.289
827.2662
Pyruvic acid
Pyruvic acid
ME416108
-
-
5.421
87.0071
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
ACar 8:1
CAR 8:1
ME416171
-
-
0.456
286.2025
ACar 9:0
CAR 9:0
ME416182
-
-
0.489
302.2339
SPB 18:0;2O
Sphinganine
ME416331
-
-
1.494
302.3065
ACar 10:1
CAR 10:1
ME416163
-
-
0.503
314.2337
ACar 10:0
CAR 10:0
ME416162
-
-
0.549
316.2496
ACar 11:1
CAR 11:1
ME416172
-
-
0.548
328.2495
ACar 12:0
CAR 12:0
ME416164
-
-
0.711
344.281
ACar 13:1
CAR 13:1
ME416174
-
-
0.696
356.2809
ACar 13:0
CAR 13:0
ME416173
-
-
0.758
358.2966
ACar 14:2
CAR 14:2
ME416165
-
-
0.674
368.281
Cholesterol
Cholesterol
ME416200
-
-
4.93
369.3531
ACar 14:0
CAR 14:0
ME416175
-
-
1.051
372.3122
ACar 15:2
CAR 15:2
ME416176
-
-
0.716
382.2968
ACar 16:4
CAR 16:4*
ME416180
-
-
0.674
392.2809
ACar 16:3
CAR 16:3
ME416179
-
-
0.758
394.2967
ACar 16:2
CAR 16:2
ME416178
-
-
0.927
396.3124
ACar 16:1
CAR 16:1
ME416177
-
-
1.193
398.328
ACar 16:0
CAR 16:0
ME416166
-
-
1.61
400.3438
ACar 18:3
CAR 18:3
ME416170
-
-
1.055
422.328
ACar 18:2
CAR 18:2
ME416169
-
-
1.342
424.3438
ACar 18:1
CAR 18:1
ME416168
-
-
1.783
426.3593
ACar 18:0
CAR 18:0
ME416167
-
-
2.417
428.3752
LPC 12:0/0:0
LPC 12:0/0:0
ME416254
-
-
0.651
440.2789
ACar 20:1
CAR 20:1
ME416181
-
-
2.567
454.3909
LPE 17:0
LPE 17:0
ME416272
-
-
1.849
468.3105
LPC 14:0
LPC 14:0
ME416255
-
-
0.936
468.3106
LPE 18:1
LPE 18:1
ME416274
-
-
1.636
480.3103
LPC 15:0
LPC 15:0
ME416256
-
-
1.158
482.326
LPE 18:0
LPE 18:0
ME416273
-
-
2.285
482.326
LPC o-16:0
LPC O-16:0
ME416269
-
-
1.72
482.3624
LPC 16:2/0:0
LPC 16:2/0:0*
ME416259
-
-
0.759
492.3106
LPC 16:1
LPC 16:1
ME416258
-
-
1.048
494.3259
LPC 16:0
LPC 16:0
ME416257
-
-
1.444
496.3415
DG 26:0
DG 26:0
ME416210
-
-
4.943
507.4042
LPC 17:1
LPC 17:1
ME416248
-
-
1.29
508.3416
LPC O-18:1
LPC O-18:1
ME416271
-
-
2.526
508.3783
LPC O-18:0
LPC O-18:0
ME416270
-
-
2.611
510.394
Ceramide 32:1;2O|Ceramide 16:1;2O/16:0
Cer 16:1;O2/16:0
ME416192
-
-
5.045
510.4901
LPC 18:3
LPC 18:3
ME416263
-
-
0.927
518.3262
LPC 18:2
LPC 18:2
ME416262
-
-
1.191
520.3413
LPC 18:1
LPC 18:1
ME416261
-
-
1.599
522.3572
LPC 18:0
LPC 18:0
ME416260
-
-
2.229
524.3729
Ceramide 33:1;2O|Ceramide 17:1;2O/16:0
Cer 17:1;O2/16:0
ME416193
-
-
5.378
524.506
DG 28:0
DG 28:0
ME416211
-
-
5.607
535.4356
LPC 19:0/0:0
LPC 19:0/0:0
ME416264
-
-
2.71
538.3893
Ceramide 34:0;2O|Ceramide 18:0;2O/16:0
Cer 18:0;O2/16:0
ME416194
-
-
5.953
540.5375
LPC 20:4
LPC 20:4
ME416266
-
-
1.161
544.3415
LPC 20:3
LPC 20:3
ME416265
-
-
1.397
546.3575
LPC 20:2
LPC 20:2
ME416251
-
-
1.786
548.3731
LPC 20:1
LPC 20:1
ME416250
-
-
2.38
550.3892
LPC 20:0
LPC 20:0
ME416249
-
-
3.081
552.4049
DG 30:0|DG 14:0_16:0
DG 14:0_16:0
ME416212
-
-
6.28
558.5117
DG 30:1
DG 30:1
ME416213
-
-
5.668
561.4514
LPC 20:5
LPC 20:5
ME416267
-
-
0.896
564.308
Ceramide 36:2;2O|Ceramide 18:1;2O/18:1
Cer 18:1;O2/18:1
ME416195
-
-
5.815
564.5374
LPC 22:5
LPC 22:5
ME416268
-
-
1.268
570.3575
LPC 22:4
LPC 22:4
ME416252
-
-
1.625
572.3741
DG 32:2|DG 16:0_16:2
DG 16:0_16:2
ME416215
-
-
5.806
582.5118
DAG 32:1
DG 32:1
ME416201
-
-
6.349
584.5273
DG 32:0|DG 16:0_16:0
DG 16:0_16:0
ME416214
-
-
6.965
586.5432
LPC 22:6
LPC 22:6
ME416253
-
-
1.105
590.3242
Ceramide d38:1
Cer 38:1;O2
ME416196
-
-
7.116
594.5848
DG 33:1
DG 33:1
ME416217
-
-
6.687
603.4985
DG 33:0
DG 33:0
ME416216
-
-
7.301
605.5141
DG 34:4|DG 16:1_18:3
DG 16:1_18:3
ME416219
-
-
5.436
606.512
DAG 34:2
DG 34:2
ME416203
-
-
6.486
610.543
DAG 34:1
DG 34:1
ME416202
-
-
7.028
612.5588
DG 34:0|DG 16:0_18:0
DG 16:0_18:0
ME416218
-
-
7.636
614.5747
Ceramide d40:1
Cer 40:1;O2
ME416197
-
-
7.777
622.6161
DG 35:2|DG 17:1_18:1
DG 17:1_18:1
ME416221
-
-
6.753
624.559
DG 35:1|DG 17:0_18:1
DG 17:0_18:1
ME416220
-
-
7.36
626.5746
DG 35:3
DG 35:3
ME416222
-
-
6.225
627.4986
DAG 36:3
DG 36:3
ME416205
-
-
6.553
636.5589
Ceramide d41:1
Cer 41:1;O2
ME416198
-
-
8.095
636.6319
DAG 36:5
DG 36:5
ME416207
-
-
5.552
637.4829
DAG 36:2
DG 36:2
ME416204
-
-
7.089
638.5747
DAG 36:4
DG 36:4
ME416206
-
-
6.002
639.4985
DG 36:1|DG 18:0_18:1
DG 18:0_18:1
ME416224
-
-
7.027
640.5901
DG 36:0|DG 18:0_18:0
DG 18:0_18:0
ME416223
-
-
8.269
642.6058
CE 16:1
CE 16:1
ME416184
-
-
10.477
645.5615
CE 16:0
CE 16:0
ME416183
-
-
11.023
647.5756
Ceramide d42:1
Cer 42:1;O2
ME416199
-
-
8.408
650.648
DAG 38:5
DG 38:5
ME416208
-
-
6.398
660.5591
DG 38:4|DG 18:1_20:3
DG 18:1_20:3
ME416227
-
-
6.718
662.5754
DAG 38:6
DG 38:6
ME416209
-
-
5.874
663.4989
DG 38:3
DG 38:3
ME416226
-
-
7.195
669.5456
CE 18:3
CE 18:3
ME416187
-
-
10.125
669.5611
CE 18:2
CE 18:2
ME416186
-
-
10.544
671.5769
DG 38:1
DG 38:1
ME416225
-
-
8.327
673.5768
CE 18:1
CE 18:1
ME416185
-
-
11.008
673.5922
SM d32:1
SM 32:1;O2
ME416313
-
-
4.224
675.5462
SM d32:0
SM 32:0;O2
ME416312
-
-
4.422
677.5623
PC 28:0
PC 28:0
ME416278
-
-
4.327
678.5094
DG 40:7
DG 40:7
ME416228
-
-
6.197
689.5146
SM d33:1
SM 33:1;O2
ME416314
-
-
4.514
689.562
CE 20:5
CE 20:5
ME416190
-
-
9.869
693.5618
CE 20:4
CE 20:4
ME416189
-
-
10.286
695.577
NAGly 42:6|NAGly 18:2/24:4
-
ME416277
-
-
4.96
696.5596
CE 20:3
CE 20:3
ME416188
-
-
10.623
697.5927
NAGly 42:5|NAGly 18:1/24:4
-
ME416276
-
-
5.459
698.5749
SM d34:2
SM 34:2;O2
ME416317
-
-
4.323
701.5616
SM d34:1
SM 34:1;O2
ME416316
-
-
4.823
703.578
SM d34:0
SM 34:0;O2
ME416315
-
-
5.052
705.5934
HexCer 34:2;3O|HexCer 18:2;2O/16:0;O
HexCer 18:2;O2/16:0;O
ME416237
-
-
4.555
714.5544
HexCer 34:1;3O|HexCer 18:1;2O/16:0;O
HexCer 18:1;O2/16:0;O
ME416235
-
-
4.911
716.5699
CE 22:6
CE 22:6
ME416191
-
-
10.045
719.577
PC 31:0
PC 31:0
ME416279
-
-
5.214
720.5563
PC o-32:0
PC O-32:0
ME416306
-
-
5.951
720.5931
PC 32:3
PC 32:3
ME416283
-
-
4.914
728.5228
SM d36:2
SM 36:2;O2
ME416320
-
-
4.93
729.5933
PC 32:2
PC 32:2
ME416282
-
-
4.538
730.5413
PC 32:1
PC 32:1
ME416281
-
-
4.971
732.5566
HexCer 34:1;4O|HexCer 18:1;3O/16:0;(2OH)
-
ME416236
-
-
4.352
732.5647
SM d36:0
SM 36:0;O2
ME416318
-
-
5.727
733.6253
PC 32:0
PC 32:0
ME416280
-
-
5.548
734.5726
HexCer 34:0;4O|HexCer 18:0;3O/16:0;(2OH)
-
ME416234
-
-
4.645
734.5806
TG 42:1
TG 42:1
ME416333
-
-
9.072
738.6637
PC 33:2
PC 33:2
ME416285
-
-
4.829
744.5569
TG 42:0
TG 42:0
ME416332
-
-
9.588
745.6347
PC 33:0
PC 33:0
ME416284
-
-
5.757
748.5884
SM d36:1
SM 36:1;O2
ME416319
-
-
5.483
753.5907
PC 34:3 (PC 16:0_18:3)
-
ME416289
-
-
4.815
756.5571
SM d38:2
SM 38:2;O2
ME416323
-
-
5.58
757.6237
PC 34:2
PC 34:2
ME416288
-
-
5.133
758.5725
SM d38:1
SM 38:1;O2
ME416322
-
-
6.172
759.6409
SM d38:0
SM 38:0;O2
ME416321
-
-
6.408
761.6564
PC 34:0
PC 34:0
ME416286
-
-
6.207
762.6041
TG 44:0
TG 44:0
ME416334
-
-
10.074
768.71
PC 35:3
PC 35:3
ME416292
-
-
4.91
770.5728
HexCer 38:2;3O|HexCer 18:2;2O/20:0;O
HexCer 18:2;O2/20:0;O
ME416238
-
-
5.843
770.6176
TG 44:1
TG 44:1
ME416335
-
-
9.634
771.6509
PC 35:2
PC 35:2
ME416291
-
-
5.447
772.5884
SM d39:1
SM 39:1;O2
ME416324
-
-
6.522
773.6564
PC 35:1
PC 35:1
ME416290
-
-
5.927
774.6046
PC 36:5
PC 36:5
ME416298
-
-
4.648
780.5572
PC 34:1
PC 34:1
ME416287
-
-
5.609
782.5696
PC 36:4
PC 36:4
ME416296
-
-
5.04
782.5726
PC 36:4 (PC 18:2_18:2)
-
ME416297
-
-
4.743
782.5728
PC 36:3
PC 36:3
ME416295
-
-
5.301
784.5886
SM d40:2
SM 40:2;O2
ME416327
-
-
6.266
785.6562
PC 36:2
PC 36:2
ME416294
-
-
5.77
786.6042
SM d40:1
SM 40:1;O2
ME416326
-
-
6.852
787.6723
PC 36:1
PC 36:1
ME416293
-
-
6.279
788.6201
SM d40:0
SM 40:0;O2
ME416325
-
-
7.101
789.688
PC p-38:5/PC o-38:6
PC P-38:5 or PC O-38:6
ME416308
-
-
5.227
792.5929
PC p-38:4/PC o-38:5
PC P-38:4 or PC O-38:5
ME416307
-
-
5.452
794.6089
TG 46:1
TG 46:1
ME416336
-
-
10.099
794.727
SHexCer 34:1;3O|SHexCer 18:1;2O/16:0;O
-
ME416309
-
-
4.095
796.5276
MGDG 36:3|MGDG 18:1_18:2
MGDG 18:1_18:2
ME416275
-
-
5.685
798.6123
HexCer 40:1;3O|HexCer 18:1;2O/22:0;O
HexCer 18:1;O2/22:0;O
ME416240
-
-
6.913
800.6649
SM d41:1
SM 41:1;O2
ME416328
-
-
7.177
801.6877
PC 38:7
PC 38:7
ME416303
-
-
4.405
804.5572
PC 38:6
PC 38:6
ME416302
-
-
4.9
806.5731
PC 38:4
PC 38:4
ME416300
-
-
5.669
810.6042
SM d42:3
SM 42:3;O2
ME416330
-
-
6.258
811.672
SM 42:2;2O
SM 42:2;O2
ME416311
-
-
6.824
813.6877
PC 38:2
PC 38:2
ME416299
-
-
6.365
814.6358
SM d42:1
SM 42:1;O2
ME416329
-
-
7.514
815.7043
HexCer 40:1;4O|HexCer 18:1;3O/22:0;(2OH)
-
ME416241
-
-
6.259
816.6597
HexCer 40:0;4O|HexCer 18:0;3O/22:0;(2OH)
-
ME416239
-
-
6.637
818.6752
TG 48:2|TG 14:0_16:0_18:2
TG 14:0_16:0_18:2
ME416340
-
-
10.133
820.7425
TG 48:1|TG 14:0_16:0_18:1
TG 14:0_16:0_18:1
ME416337
-
-
10.56
822.7581
TG 48:2
TG 48:2
ME416338
-
-
10.217
825.6979
TG 48:2|TG 12:0_18:1_18:1
TG 12:0_18:1_18:1
ME416339
-
-
10.129
825.6979
HexCer 42:1;3O|HexCer 18:1;2O/24:0;O
HexCer 18:1;O2/24:0;O
ME416244
-
-
7.564
828.6962
PC 38:5
PC 38:5
ME416301
-
-
5.094
830.5698
PC 40:7
PC 40:7
ME416305
-
-
4.938
832.5889
GlcCer d42:2
GlcCer 42:2;O2
ME416233
-
-
7.074
832.6672
HexCer 41:0;4O|HexCer 18:0;3O/23:0;(2OH)
-
ME416242
-
-
6.972
832.6908
PC 40:6
PC 40:6
ME416304
-
-
5.501
834.6046
GlcCer d42:1
GlcCer 42:1;O2
ME416232
-
-
7.746
834.6829
TG 49:1
TG 49:1
ME416341
-
-
10.764
836.7739
HexCer 42:1;4O|HexCer 18:1;3O/24:0;(2OH)
-
ME416245
-
-
6.934
844.6912
HexCer 42:0;4O|HexCer 18:0;3O/24:0;(2OH)
-
ME416243
-
-
7.301
846.7069
TG 50:1|TG 16:0_16:0_18:1
TG 16:0_16:0_18:1
ME416343
-
-
10.97
850.7899
TG 50:3|TG 14:0_18:1_18:2
TG 14:0_18:1_18:2
ME416346
-
-
10.177
851.7136
TG 50:3|TG 16:0_16:0_18:3
TG 16:0_16:0_18:3
ME416347
-
-
10.259
851.7137
TG 50:0|TG 16:0_16:0_18:0
TG 16:0_16:0_18:0
ME416342
-
-
11.335
852.8057
TG 50:2|TG 16:0_16:0_18:2
TG 16:0_16:0_18:2
ME416345
-
-
10.596
853.7291
TG 50:2|TG 14:0_18:1_18:1
TG 14:0_18:1_18:1
ME416344
-
-
10.557
853.7294
HexCer 44:1;3O|HexCer 20:1;2O/24:0;O
HexCer 20:1;O2/24:0;O
ME416246
-
-
8.176
856.7283
Gal-Gal-Cer d18:1/16:0 or Lactosylceramide d18:1/1...
-
ME416231
-
-
4.878
862.629
TG 52:4|TG 16:0_18:2_18:2
TG 16:0_18:2_18:2
ME416352
-
-
10.246
872.7742
TG 52:3|TG 16:0_18:1_18:2
TG 16:0_18:1_18:2
ME416351
-
-
10.616
874.7901
TG 52:2|TG 16:0_18:0_18:2
TG 16:0_18:0_18:2
ME416349
-
-
10.982
876.8056
TG 52:4|TG 16:1_18:1_18:2
TG 16:1_18:1_18:2
ME416353
-
-
10.238
877.7289
TG 52:3
TG 52:3
ME416350
-
-
10.591
879.7448
TG 52:1|TG 16:0_18:0_18:1
TG 16:0_18:0_18:1
ME416348
-
-
11.351
883.7767
TG 53:4|TG 17:1_18:1_18:2
TG 17:1_18:1_18:2
ME416354
-
-
10.419
886.79
TG 54:4|TG 18:1_18:1_18:2
TG 18:1_18:1_18:2
ME416358
-
-
10.635
900.8058
TG 54:6|TG 18:1_18:2_18:3
TG 18:1_18:2_18:3
ME416362
-
-
9.894
901.7286
TG 54:5|TG 18:1_18:2_18:2
TG 18:1_18:2_18:2
ME416361
-
-
10.276
903.7447
TG 54:5|TG 18:0_18:2_18:3
TG 18:0_18:2_18:3
ME416360
-
-
10.347
903.7452
TG 54:4|TG 18:0_18:1_18:3
TG 18:0_18:1_18:3
ME416357
-
-
10.689
905.7603
TG 54:3|TG 18:0_18:1_18:2
TG 18:0_18:1_18:2
ME416356
-
-
10.995
907.7761
SHexCer 42:1;3O|SHexCer 18:1;2O/24:0;O
-
ME416310
-
-
6.39
908.6541
TG 54:2|TG 16:0_20:0_18:2
TG 16:0_18:2_20:0
ME416355
-
-
11.367
909.7917
TG 54:5
TG 54:5
ME416359
-
-
10.291
919.7194
TG 56:6|TG 18:1_18:1_20:4
TG 18:1_18:1_20:4
ME416365
-
-
10.494
929.7613
TG 56:3|TG 20:0_18:1_18:2
TG 18:1_18:2_20:0
ME416364
-
-
10.997
930.8519
TG 56:1|TG 16:0_22:0_18:1
TG 16:0_18:1_22:0
ME416363
-
-
11.947
934.8841
DGDG 36:4|DGDG 18:2_18:2
DGDG (18:2/18:2)*
ME416230
-
-
4.745
958.6506
DGDG 36:3|DGDG 18:1_18:2
DGDG 18:1_18:2
ME416229
-
-
5.196
960.6669
Lactosylceramide d18:1/24:1 15Z
-
ME416247
-
-
6.794
972.7382
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
FA 8:0 (caprylic acid)
Caprylic acid
ME416406
-
-
0.532
143.1059
FA 10:0 (capric acid)
Capric acid
ME416375
-
-
0.662
171.1373
FA 11:0 (undecylic acid)
Undecylic acid
ME416376
-
-
0.752
185.153
FA 12:0 (lauric acid)
Lauric acid
ME416377
-
-
0.958
199.1688
FA 13:0 (tridecylic acid)
Tridecylic acid
ME416378
-
-
1.191
213.1844
FA 14:1 (physeteric acid)
Physeteric acid
ME416380
-
-
1.091
225.1845
FA 14:0 (myristic acid)
Myristic acid
ME416379
-
-
1.505
227.2002
FA 15:1
Pentadecenoic acid
ME416382
-
-
1.404
239.2002
FA 15:0 (pentadecylic acid)
Pentadecylic acid
ME416381
-
-
1.891
241.216
FA 16:1 (palmitoleic acid)
Palmitoleic acid
ME416384
-
-
1.687
253.2159
FA 16:0 (palmitic acid)
Palmitic acid
ME416383
-
-
2.345
255.2316
FA 17:0 (margaric acid)
Margaric acid
ME416385
-
-
2.843
269.2475
FA 18:3 (linolenic acid)
Octadecatrienoic acid
ME416389
-
-
1.469
277.2158
FA 18:2 (linoleic acid)
Linoleic acid
ME416388
-
-
1.928
279.2315
FA 18:1 (oleic acid)
Oleic acid
ME416387
-
-
2.566
281.2472
FA 18:0 (stearic acid)
Stearic acid
ME416386
-
-
3.201
283.2628
FA 20:5 (eicosapentaenoic acid)
Eicosapentaenoic acid
ME416396
-
-
1.387
301.2157
FA 20:4 (arachidonic acid)
Arachidonic acid
ME416395
-
-
1.801
303.2314
FA 20:3 (homo-gamma-linolenic acid)
Dihomo-gamma-linolenic acid
ME416394
-
-
2.223
305.2472
FA 20:3 (eicosatrienoic acid)
Eicosatrienoic acid
ME416393
-
-
2.371
305.2473
FA 20:2 (eicosadienoic acid)
Eicosadienoic acid
ME416392
-
-
2.801
307.2631
FA 20:1 (eicosenoic acid)
Eicosenoic acid
ME416391
-
-
3.291
309.2785
FA 20:0 (arachidic acid)
Arachidic acid
ME416390
-
-
3.776
311.2942
FA 22:6 (docosahexaenoic acid)
Docosahexaenoic acid
ME416401
-
-
1.595
327.2313
FA 22:5
Docosapentaenoic acid
ME416400
-
-
2.001
329.2471
FA 22:2 (docosadienoic acid)
Docosadienoic acid
ME416399
-
-
3.407
335.2943
FA 22:1 (erucic acid)
cis-Erucic acid
ME416398
-
-
3.828
337.31
FA 22:0 (behenic acid)
Behenic acid
ME416397
-
-
4.419
339.3252
FA 24:1 (nervonic acid)
Nervonic acid
ME416403
-
-
4.443
365.341
FA 24:0 (lignoceric acid)
Lignoceric acid
ME416402
-
-
5.134
367.3565
FA 26:0 (cerotic acid)
Cerotic acid
ME416404
-
-
5.905
395.3877
FA 28:0 (montanic acid)
Montanic acid
ME416405
-
-
6.69
423.4195
LPE 16:0
LPE 16:0
ME416414
-
-
1.432
452.2761
LPE 18:2
LPE 18:2
ME416415
-
-
1.179
476.276
LPE 20:4
LPE 20:4
ME416416
-
-
1.151
500.2764
LPE 22:6
LPE 22:6
ME416417
-
-
1.099
524.2763
Ceramide d32:1
Cer 32:1;O2
ME416366
-
-
5.017
544.4485
Ceramide d33:1
Cer 33:1;O2
ME416367
-
-
5.342
558.464
FAHFA 36:2|FAHFA 18:1/18:1
FAHFA 18:1/O-18:1
ME416409
-
-
5.862
561.4871
FAHFA 18:1/18:0
-
ME416407
-
-
6.04
563.50293
Ceramide d34:1
Cer 34:1;O2
ME416368
-
-
5.677
572.4797
FAHFA 18:1/20:0
FAHFA 18:1/O-20:0
ME416408
-
-
6.76
591.53461
Ceramide d34:2
Cer 34:2;O2
ME416369
-
-
5.112
594.5087
Ceramide d36:1
Cer 36:1;O2
ME416370
-
-
6.37
600.5113
Ceramide d39:1
Cer 39:1;O2
ME416371
-
-
7.419
666.6028
Ceramide d40:2
Cer 40:2;O2
ME416373
-
-
7.072
678.6022
Ceramide d40:0
Cer 40:0;O2
ME416372
-
-
7.728
682.6326
Ceramide d42:2
Cer 42:2;O2
ME416374
-
-
7.7
706.6338
GlcCerd14:14E/20:02OH
-
ME416413
-
-
4.883
750.5273
GlcCer d38:1
GlcCer 38:1;O2
ME416410
-
-
6.222
814.6401
GlcCer d40:1
GlcCer 40:1;O2
ME416411
-
-
7.065
818.6273
PC 35:4
PC 35:4
ME416418
-
-
4.712
826.5584
GlcCer d41:1
GlcCer 41:1;O2
ME416412
-
-
7.388
832.6419
PC 37:4
PC 37:4
ME416419
-
-
5.322
854.5891
PC 38:3
PC 38:3
ME416420
-
-
5.912
870.6211
SM d42:2
SM 42:2;O2
ME416421
-
-
6.788
871.6886
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
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