Log in
/
Register
Home
Overview
Upload / Manage Studies
Browse / Search Studies
Analyze Studies
Data Sharing Policy
Tutorials
FAQ
Data Repository
Overview
Upload / Manage Studies
Browse / Search Studies
Analyze Studies
Data Sharing Policy
Tutorials
FAQ
Databases
Overview
Metabolite Database
Human Metabolome Gene/Protein Database (MGP)
RefMet: Reference List of Metabolite Names
External Metabolomics Databases (Links)
Protocols
Overview
General Protocols
Study-specific Protocols
Tools
Overview
Load and analyze your own dataset
Analyze Studies
MS Searches
Structure drawing
REST Service
External Tools (Links)
About
Overview
Publishing Partners
How to Cite
How to Link
Terms of Use
Personnel
Contact
Sitemap
Search
Keyword Search
Advanced Searches
Return to study ST003278 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
3-Methylcyclopentene
-
ME860137
-
-
2.929
100.11231
N-Methylpyridinium
N-Methylpyridinium
ME860306
-
-
9.425366667
100.308492
Diethanolamine
Diethanolamine
ME860212
-
-
12.0007
100.683359
2-MethylpropanalO-methyloxime
-
ME860119
-
-
9.635163265
102.0916214
Hexylamine
Hexylamine
ME860240
-
-
5.558333333
102.1279667
Methylcyclopentane
-
ME860269
-
-
2.895
102.12798
N-Nitrosodiethylamine
N-Nitrosodiethylamine
ME860307
-
-
5.043
103.08685
Pyrrolidine
Pyrrolidine
ME860339
-
-
7.644086957
103.10612
Choline
Choline
ME860192
-
-
5.18886
104.1071817
IE1225000
-
ME860243
-
-
7.787
104.11796
Cyanopyrazine
Cyanopyrazine
ME860198
-
-
14.172
106.03938
4-Vinylpyridine
-
ME860153
-
-
6.856142857
106.0653224
Cyclohexylamine
Cyclohexylamine
ME860202
-
-
10.84091667
106.9500375
D-2-Amino-hexano-6-lactam
Undecylprodigiosin
ME860204
-
-
7.8945
111.091895
Selsun
-
ME860345
-
-
5.098
112.895795
Creatinine
Creatinine
ME860196
-
-
9.908909091
114.0662773
Pyrazolidine
-
ME860337
-
-
4.619
114.10254
D-Proline
D-Proline
ME860217
-
-
5.393
116.07066
n-Hexanamide
-
ME860299
-
-
8.788666667
116.1071253
tuaminoheptane
-
ME860363
-
-
14.18975
116.1434825
Benzylamine
Benzylamine
ME860181
-
-
10.9363913
116.2239787
[FAamino(5:0)]2S-amino-pentanoicacid
2S-Aminopentanoic acid
ME860071
-
-
7.861129032
118.086319
2-Methylcholine
2-Methylcholine
ME860118
-
-
9.455714286
118.1227
2-Hydroxyphenethylamine
2-Hydroxyphenethylamine
ME860113
-
-
0.415
120.080875
1_2-Diaminobenzene
-
ME860082
-
-
8.752
121.886564
Leucinamide
-
ME860255
-
-
14.449
122.11269
Nicotinamide
Niacinamide
ME860301
-
-
1.370111111
123.0553011
2,4-Diaminotoluene
-
ME860102
-
-
7.258
123.091735
Indane
-
ME860245
-
-
4.66825
123.3421375
Taurine
Taurine
ME860352
-
-
5.304
126.0218
2-Ethyl-4,5-dimethylthiazole
-
ME860112
-
-
1.416
126.09137
Coniine
Coniine
ME860195
-
-
1.065333333
128.14333
heptaminol
-
ME860238
-
-
1.1415
128.143355
1-Phenylethylamine
-
ME860095
-
-
11.1705
128.481255
Isoquinoline
Isoquinoline
ME860250
-
-
0.364
130.06507
4-Guanidinobutanal
4-Guanidinobutanal
ME860147
-
-
4.798
130.09729
4-Trimethylammoniobutanal
-
ME860152
-
-
2.224
130.12244
Octylamine
Octylamine
ME860316
-
-
8.24325
130.1588588
3-Guanidinopropanoate
3-Guanidinopropanoic acid
ME860134
-
-
8.321875
132.0766113
(3R)-beta-Leucine
beta-Leucine
ME860054
-
-
6.608363636
132.1017848
DD9275000
-
ME860205
-
-
3.48525
133.075901
4-Methoxyaniline
p-Anisidine
ME860149
-
-
10.62128571
133.6644514
2,2'-Iminodipropan-1-ol
-
ME860100
-
-
4.717
134.1173
2-Allyl-6-methylpyrazine
-
ME860107
-
-
4.58
135.09141
2-Methyl-6-[(1E)-1-propenyl]pyrazine
-
ME860115
-
-
4.36
135.09142
Cyclohexapyrazine
-
ME860201
-
-
10.66675
135.091515
allopurinol
Allopurinol
ME860168
-
-
3.127428571
137.0454657
gamma-Coniceine
gamma-Coniceine
ME860233
-
-
6.260911765
137.9294909
Isoleucine - 6C13
-
ME860249
-
-
7.0294
138.12177
4-Nitroaniline
4-Nitroaniline
ME860151
-
-
1.934
139.05005
Crotono-betaine
-
ME860197
-
-
14.314
142.12262
Naphthalen-2-amine
2-Aminonaphthalene
ME860291
-
-
13.991
144.08073
Stachydrine
Stachydrine
ME860349
-
-
14.911
144.1017
valpromide
-
ME860366
-
-
2.329
144.13804
LQ1825000
-
ME860259
-
-
14.191
144.4577667
Ethephon
-
ME860222
-
-
12.24
144.98184
Phenelzine
-
ME860324
-
-
6.992666667
145.1070933
Acetylcadaverine
N-Acetylcadaverine
ME860165
-
-
14.221
145.13348
3-Dehydroxycarnitine
3-Dehydroxycarnitine
ME860132
-
-
4.737446429
146.1172911
NFP
-
ME860297
-
-
7.04
146.1173229
Dimethylbenzimidazole
Dimethylbenzimidazole
ME860214
-
-
3.532
147.09142
(3S)-3_6-Diaminohexanoate
-
ME860056
-
-
4.62
147.1124
n-Dibutyl sulfide
-
ME860295
-
-
1.885
147.12061
(+)-N-Methylconiine
-
ME860039
-
-
6.987428571
148.0197643
Amphetamine
Dextroamphetamine
ME860174
-
-
6.961722222
148.4088061
D-Methionine
D-Methionine
ME860215
-
-
5.23
150.05806
Guanine
Guanine
ME860235
-
-
3.859
152.05631
Benzamidine
Benzamidine
ME860180
-
-
14.984
153.10214
4,6-Diamino-5-formamidopyrimidine
FAPy-adenine
ME860144
-
-
2.776
154.071965
Pseudopelletierine
psi-Pelletierine
ME860336
-
-
14.093
154.12256
Phentermine
-
ME860328
-
-
11.801
154.13376
Propylhexedrine
-
ME860335
-
-
9.099
156.17462
EJ4025000
-
ME860219
-
-
13.923
159.1489
Pregabalin
Pregabalin
ME860333
-
-
6.545333333
160.1330178
RH0365500
-
ME860342
-
-
2.338
160.13307
2-Pentylpyridine
-
ME860122
-
-
1.379111111
161.4784444
(S)-Carnitine
Carnitine
ME860067
-
-
6.5635
162.11212
2,4-Dimethyl-5,6,7,8-tetrahydroquinoline
-
ME860103
-
-
12.35666667
162.1274633
Pinidine
Pinidine
ME860329
-
-
13.932
164.4939367
N,N-Dimethyl-N-phenylurea
-
ME860282
-
-
14.735
165.10204
3-Methyl-3-phenylazetidine
-
ME860136
-
-
13.73
165.13832
2,5-Diethyl-3,6-dimethylpyrazine
-
ME860104
-
-
4.606
165.138475
1-Methylguanine
1-Methylguanine
ME860090
-
-
3.117166667
166.0719283
D-Phenylalanine
D-Phenylalanine
ME860216
-
-
3.468666667
166.0859
N-benzyl-N-isopropyl-N'-[4-(trifluoromethoxy)pheny...
-
ME860293
-
-
0.9625
166.08599
4-(4,5-dihydro-1H-imidazol-2-yl)-2,6-dimethylmorph...
-
ME860142
-
-
4.364
167.11752
4-Methyl-2-propyloxazole
-
ME860150
-
-
2.205
167.11752
2-Isobutyl-3-methoxypyrazine
-
ME860114
-
-
7.68425
167.1176625
2,3-Diethyl-5-methylpyrazine
-
ME860101
-
-
4.79075
167.135775
1-Methylpyrrolinium
1-Methylpyrrolinium
ME860091
-
-
7.8985
167.153945
mephentermine
Mephentermine
ME860265
-
-
9.209636364
167.2388873
2-Dimethylamino-5,6-dimethyl-4-hydroxypyrimidine
-
ME860110
-
-
11.711
168.11276
Tropinone
Tropinone
ME860361
-
-
7.36475
168.6265325
Pyridoxamine;2-Methyl-4-aminomethyl-5-hydroxymethy...
-
ME860338
-
-
14.621
169.09696
(+)-exo-5-Hydroxycamphor
-
ME860038
-
-
1.031
169.12201
2-Phenylcyclopropanamine
-
ME860123
-
-
4.6315
171.6251975
Gabapentin
Gabapentin
ME860232
-
-
11.329
172.13284
N-Methylphenylethanolamine
-
ME860305
-
-
6.81
172.6200925
Tryptoline
-
ME860362
-
-
1.318
173.1071042
Bethanidine
-
ME860182
-
-
3.598
178.133385
7-Aminomethyl-7-deazaguanine
7-Aminomethyl-7-carbaguanine
ME860162
-
-
2.26
180.08755
Mexiletine
Mexiletine
ME860270
-
-
9.0395
180.137915
TO0127900
-
ME860355
-
-
10.46666667
180.489
Imagabalin
-
ME860244
-
-
4.9786
180.55378
(R)-2-Methylimino-1-phenylpropan-1-ol
(R)-2-Methylimino-1-phenylpropan-1-ol
ME860064
-
-
14.016
181.13334
Nigrifactin
-
ME860302
-
-
4.895
181.4807758
3-Amino-3-(4-hydroxyphenyl)propanoate
beta-Tyrosine
ME860130
-
-
5.195
182.08098
6-methyltetrahydropterin
6-Methyltetrahydropterin
ME860161
-
-
2.88075
182.1032263
tetridamine
-
ME860353
-
-
6.1475
182.14657
(2E,6Z)-N-Ethyl-2,6-nonadienamide
-
ME860046
-
-
13.747
182.15369
Dicyclohexylamine
N,N-Dicyclohexylamine
ME860209
-
-
13.71514286
182.19004
Cholinephosphate
Choline phosphate
ME860193
-
-
3.84
184.0728
3-Phosphonooxypyruvate
Phosphohydroxypyruvic acid
ME860139
-
-
12.8525
184.98521
(cyclohexylmethyl)pyrazine
-
ME860063
-
-
3.854666667
187.81362
N_N-Dimethyltryptamine
-
ME860284
-
-
2.995
189.13809
1_4-Lactone
-
ME860083
-
-
1.326666667
190.10709
246I1D7TDL
-
ME860106
-
-
3.13
190.15845
Tocainide
Tocainide
ME860356
-
-
13.418
193.1332
Phenmetrazine
Phenmetrazine
ME860327
-
-
2.704
194.13534
(2E,6Z)-N-Cyclopropyl-2,6-nonadienamide
-
ME860045
-
-
3.2105
194.153555
(-)-Lupinine
Lupinine
ME860037
-
-
6.26675
194.1731375
3-Nonyl-1H-pyrazole
-
ME860138
-
-
3.008
195.18528
N-Hydroxydecanamide
N-Decanohydroxamic acid
ME860300
-
-
9.453230769
196.0226
3-Amino-5,7-dimethyl-1-adamantanol
-
ME860131
-
-
14.389
196.16947
Fasoracetam
Fasoracetam
ME860227
-
-
2.964
197.128075
6-Methylnicotinamide
6-Methylnicotinamide
ME860160
-
-
5.934
197.8488025
(4-amino-1,2,5-oxadiazol-3-yl)(1-pyrrolidinyl)meth...
-
ME860058
-
-
1.45
198.0973511
2-(3-Phenylpropyl)pyridine
-
ME860098
-
-
3.053
198.127275
11-Nitro-1-undecene
-
ME860085
-
-
3.392
200.165445
Lauramide
-
ME860253
-
-
8.9242
200.200598
Atagabalin
-
ME860178
-
-
8.415
200.5894007
HMBA
-
ME860241
-
-
4.159
201.15927
Tris(hydroxymethyl)aminomethane
2-Amino-2-methylol-propane-1,3-diol
ME860360
-
-
1.5225
201.595665
11-Aminoundecanoic acid
11-Aminoundecanoic acid
ME860084
-
-
9.224533333
202.1797383
ammodendrine
Ammodendrine
ME860172
-
-
3.469333333
203.1608067
3-Indolepropionicacid
3-Indolepropionic acid
ME860135
-
-
1.567666667
203.7614033
Acetyl-L-carnitine
CAR 2:0
ME860166
-
-
5.757
204.1229
Levamisole hydrochloride
Levamisole
ME860258
-
-
1.679958333
205.0790096
Dexamisole
-
ME860208
-
-
3.105375
205.07904
Indoleacrylicacid
Indoleacrylic acid
ME860246
-
-
4.5385
205.09662
D-Tryptophan
D-Tryptophan
ME860218
-
-
4.523
205.09669
ethambutol
Ethambutol
ME860221
-
-
8.330857143
205.1907414
PEG-4
-
ME860322
-
-
5.410318182
205.5357673
N-Acetyl-D-quinovosamine
-
ME860289
-
-
1.003
206.10186
dicyclohexylcarbodiimide
-
ME860210
-
-
2.936
207.18507
APM
-
ME860176
-
-
1.776
208.117475
Miglitol
Miglitol
ME860273
-
-
1.598
208.1175813
Ciclopirox
Ciclopirox
ME860194
-
-
8.569
208.133095
WS1228A
-
ME860369
-
-
4.561
208.14381
(2,7-Dimethyloctahydro-1H-cyclopenta[c]pyridin-4-y...
-
ME860040
-
-
8.0285
208.18883
Ser-Ser
Ser-Ser
ME860346
-
-
4.2455
210.109245
6-{[2-(2-oxo-1-imidazolidinyl)ethyl]amino}-2-pyrid...
-
ME860158
-
-
5.212
210.13315
Minoxidil
-
ME860275
-
-
2.917
210.13465
5,5-dimethyl-3-morpholinocyclohex-2-en-1-one
-
ME860155
-
-
3.566
210.14821
Cyclo(leucylprolyl)
-
ME860199
-
-
14.74
211.14391
Atipamezole
-
ME860179
-
-
2.917
213.13797
Quwenzhi
-
ME860340
-
-
2.565
216.159145
deoxyhypusine
Deoxyhypusine
ME860207
-
-
4.202
218.18559
prolintane
-
ME860334
-
-
2.777
218.18979
6-fluoro-3,4-dihydro-2H-pyrano[2,3-b]quinolin-5-am...
-
ME860159
-
-
1.008
219.094652
5-Methoxy-N_N-dimethyltryptamine
-
ME860157
-
-
3.578
219.148565
3-(1-Piperazinyl)benzisothiazole
-
ME860125
-
-
1.69225
220.0897575
Pantothenicacid(VitaminB5)
Pantothenic acid
ME860320
-
-
1.136
220.11771
sedamine
-
ME860344
-
-
4.218
220.16905
3-(Isothiocyanatomethyl)-1H-indole
-
ME860127
-
-
1.077
221.07376
4-(1,2-Dihydroxy-2-propanyl)-1-methyl-1,2-cyclohex...
-
ME860140
-
-
12.886
222.16951
Tapentadol
-
ME860351
-
-
3.048
222.18461
(2E,4Z)-N-Isobutyl-2,4-decadienamide
-
ME860043
-
-
14.625
224.20022
UNII:6S7S02945H
-
ME860365
-
-
9.999166667
228.2135633
Myristamide
-
ME860279
-
-
3.083
228.23162
2S-Amino-tridecanoic acid
2S-Aminotridecanoic acid
ME860124
-
-
9.261
230.210998
EPTAZOCINE
-
ME860220
-
-
2.955
232.16915
Ethoxyquin
Ethoxyquin
ME860223
-
-
2.947
235.17996
(R_S)-Tetrahydrobenzylisoquinoline
-
ME860066
-
-
2.9295
240.15582
Mefenamic acid
Mefenamic acid
ME860262
-
-
2.151
242.11679
(3Z,6E)-N-Hydroxy-2,4,4,7-tetramethyl-6,8-nonadien...
-
ME860057
-
-
13.595
242.210905
Huperzine
-
ME860242
-
-
3.278
243.148595
Cytidine;1-beta-delta-Ribofuranosyl-Cytosine
-
ME860203
-
-
4.547
244.09212
N-Undecanoylglycine
NA-Gly 11:0
ME860315
-
-
2.504
244.1901
Orange OT
-
ME860318
-
-
0.98
245.11046
rac-Etomidate
-
ME860341
-
-
1.879
245.12813
(3S)-3-(Pentanoyloxy)-4-(trimethylammonio)butanoat...
-
ME860055
-
-
4.378
246.16926
2-methylbutyrylcarnitine
CAR 4:0;2Me
ME860117
-
-
4.045
246.1693
(4E)-2-Amino-3-oxo-4-undecenoic acid
-
ME860059
-
-
4.313
246.16937
N-cyclohexyl-1-methyl-5-(1H-pyrrol-1-yl)-1H-pyrazo...
-
ME860294
-
-
2.075
251.18458
2-Methyl-6-undecylpiperidine
-
ME860116
-
-
7.951705882
254.2836865
solenopsin
-
ME860348
-
-
7.636
254.283755
Rilmenidine
Rilmenidine
ME860343
-
-
5.346666667
254.8518967
Hexadecanamide;Palmiticamide
-
ME860239
-
-
2.917
256.2628775
N-Methyldioctylamine
-
ME860304
-
-
2.3765
256.29923
2-(6'-methylthio)hexylmalate
-
ME860099
-
-
4.986
265.11086
BORRELINE
Borreline
ME860183
-
-
0.973
267.14879
Inosine
Inosine
ME860247
-
-
4.045
269.08717
Orphenadrine
Orphenadrine
ME860319
-
-
2.82
270.18425
N-Methyl-(R_S)-tetrahydrobenzylisoquinoline
-
ME860303
-
-
2.878
270.18459
Capsi-amide
Capsiamide
ME860189
-
-
7.090777778
270.2785822
ODA
-
ME860317
-
-
4.229833333
270.3147333
voxtalisib
-
ME860367
-
-
14.561
271.13032
N-Acetoxy-4-aminobiphenyl
-
ME860288
-
-
1.400333333
278.5666189
Moxisylyte
-
ME860277
-
-
0.8665
280.190355
N-benzyl-4-ethyl-N-isopropylbenzamide
-
ME860292
-
-
2.954
282.19068
Guanosine
Guanosine
ME860236
-
-
4.672
284.09813
Levallorphan
Levallorphan
ME860257
-
-
0.3275
284.201865
Cetrimonium
-
ME860191
-
-
3.185
284.330413
4-[(1S)-1-Cyclohexyl-2-(2-piperidinyl)ethyl]cycloh...
-
ME860145
-
-
4.558363636
289.3667809
MM3670000
-
ME860276
-
-
1.59825
294.1656725
Tyrosyl-4-hydroxyproline
-
ME860364
-
-
4.124
295.12796
Methyl alpha-aspartylphenylalaninate
-
ME860267
-
-
4.23
295.12797
(5S)-5-hydroxy-1,7-diphenylheptan-3-one
-
ME860061
-
-
1.235571429
295.7354729
Phenethylamineglucuronide
-
ME860325
-
-
1.418
298.12775
Tridemorph
Tridemorph
ME860359
-
-
10.53321212
298.3097491
Dimethylaminopropionylphenothiazine
-
ME860213
-
-
1.0495
299.12063
tinoridine
-
ME860354
-
-
1.078
299.12084
Norethindrone
Norethindrone
ME860308
-
-
1.038
299.19989
[FA(16:2)]N-hexadecyl-ethanolamine
Palmitoyl-EA
ME860068
-
-
2.569428571
300.2888314
Amide C18
-
ME860170
-
-
7.2855
300.30743
9-cis-Retinoicacid
9-cis-Retinoic acid
ME860163
-
-
1.0575
301.21557
flutriafol
-
ME860230
-
-
2.95
302.10977
Fingolimod
-
ME860228
-
-
14.374
308.25777
Dicyclomine
-
ME860211
-
-
9.546625
312.4016888
butoctamide
-
ME860185
-
-
2.2546875
316.2110456
Amorolfine
-
ME860173
-
-
11.81564706
318.2784806
ethyl 1-(4-methylphenyl)-1H-[1,2,4]triazolo[4,3-a]...
-
ME860224
-
-
2.197
321.12996
3-Epihydroxy-2'-deoxymugineicacid
-
ME860133
-
-
14.2776
321.130414
[FA(20:3)]11_12-epoxy-5Z_8Z_14Z-eicosatrienoicacid
-
ME860069
-
-
1.13
321.2419
Mycocyclosin
-
ME860278
-
-
1.884
325.117355
Heptaethylene Glycol
Heptaethylene glycol
ME860237
-
-
1.982333333
327.2003967
(2S)-3-Phenyl-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(...
-
ME860052
-
-
1.83
328.13822
N_N-Dimethylsphing-4-enine
-
ME860283
-
-
9.881666667
328.3204433
3-[(6-Oxodecanoyl)oxy]-4-(trimethylammonio)butanoa...
-
ME860129
-
-
1.852666667
330.2266067
9-fluoro-17?-oxa-dextro-homoandrosta-1,4-diene-3,1...
-
ME860164
-
-
1.255
333.15068
GibberellinA12
-
ME860234
-
-
1.045
333.20526
SteroidO-sulfate
-
ME860350
-
-
0.539
337.1457
NP-008993
-
ME860309
-
-
2.8004
337.2396
[FAhydroxy(20:3)]11_12-dihydroxy-5Z_8Z_14Z-eicosat...
-
ME860072
-
-
1.017
339.25217
Amide C22
-
ME860171
-
-
0.95775
340.356675
trans-2-Dodecenoylcarnitine
CAR 12:1(2E)
ME860357
-
-
2.409666667
342.2627967
2-Dodecylbenzenesulfonic acid
2-Dodecylbenzenesulfonic acid
ME860111
-
-
0.531
344.22697
(2E,4Z,12E)-1-(1-Piperidinyl)-2,4,12-octadecatrien...
-
ME860044
-
-
2.421
346.309375
MACAMIDE 1
-
ME860261
-
-
10.30521739
346.3096952
Capryloylglycine
-
ME860188
-
-
3.9396
347.44179
Tridecyl 4-hydroxybenzenepropanoate
-
ME860358
-
-
1.071
349.27278
anacardic acid
Anacardic acid
ME860175
-
-
0.958
349.27306
2-Amino-3-hydroxy-15-methyl-1-hexadecanesulfonic a...
-
ME860108
-
-
1.9568
352.252206
CETABEN
-
ME860190
-
-
3.595
356.3007983
N-(2,6,10,14-Tetramethylpentadecanoyl)glycine
-
ME860280
-
-
1.552
356.315435
ethyl 2-{4-[(4-methoxyphenyl)methylene]-5-oxo-2-ph...
-
ME860226
-
-
1.210666667
365.1562867
(2R)-2-{[(2R)-2-{[(2S,3R,4R,5S,6R)-3-Acetamido-2,5...
-
ME860051
-
-
14.4105
365.156735
(2Z,4E)-1-(1-Piperidinyl)-2,4-icosadien-1-one
-
ME860053
-
-
10.53626667
373.9550193
(2E,4E,16Z)-1-(1-Piperidinyl)-2,4,16-icosatrien-1-...
-
ME860042
-
-
6.375714286
374.3409093
Arachidonoyl Serinol
-
ME860177
-
-
3.304
378.30256
1,1'-(3,5-Pyridinediyl)di(1-decanone)
-
ME860075
-
-
7.526
388.3199
ethyl 1-{[1-benzyl-3-(tert-butyl)-1H-pyrazol-5-yl]...
-
ME860225
-
-
1.0678
393.844228
[FA]O-Palmitoyl-R-carnitine
CAR 16:0
ME860070
-
-
3.469
400.34099
NP-016596
-
ME860310
-
-
2.225666667
409.18219
(4S)-4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-{[(2R,3R,...
-
ME860060
-
-
1.751333333
409.1827733
NP-022076
-
ME860311
-
-
1.16375
410.240685
Piperlonguminine
-
ME860332
-
-
0.991
410.71105
Solasodine
Solasodine
ME860347
-
-
5.209538462
414.3354831
Inspra
-
ME860248
-
-
1.186
415.21021
Forasartan
-
ME860231
-
-
0.893
417.25275
MFCD22416941
-
ME860272
-
-
3.514
426.356405
Leupeptin
Leupeptin
ME860256
-
-
0.986
427.30177
C18-Carnitine
CAR 18:0
ME860186
-
-
2.959
428.372095
4,4'-diapolycopenedial
-
ME860143
-
-
1.55
429.27886
(24R_24'R)-Fucosterolepoxide
-
ME860041
-
-
1.332333333
429.3716117
Melagatran
-
ME860263
-
-
1.273
430.242445
Pheneturide
-
ME860326
-
-
1.133
430.24281
4-(1-Hydroxy-2-{[6-(4-hydroxy-4-phenylbutoxy)hexyl...
-
ME860141
-
-
0.868
432.27578
Istamycin C1
-
ME860251
-
-
0.518
432.2793
Buclizine
Buclizine
ME860184
-
-
1.216
433.24013
Amfepramone
-
ME860169
-
-
0.119
433.28306
2-(3-Hydroxy-3,7,11,15-tetramethylhexadecyl)-3,5,6...
-
ME860097
-
-
0.963
435.37529
WLH
-
ME860368
-
-
1.0525
437.234675
13-hydroxy-alpha-tocopherol
-
ME860086
-
-
0.83
438.377055
N-Pentacosanoylglycine
-
ME860312
-
-
1.644
440.4088471
N-Stearoyltyrosine
-
ME860313
-
-
3.502
448.34077
N1-bicyclo[2.2.1]hept-2-yl-2-{4-[(dipropylamino)su...
-
ME860286
-
-
1.70275
453.208405
Militarinone A
Militarinone A
ME860274
-
-
1.89
460.2679957
3-[(4E,7E,10E,13E,16E,19E)-4,7,10,13,16,19-Docosah...
-
ME860128
-
-
3.386
472.34075
N8ONU3L3PG
-
ME860287
-
-
1.515
473.263845
Netilmicin
Netilmicin
ME860296
-
-
1.623
476.30559
1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine
-
ME860081
-
-
3.764
494.32264
1-Palmitoylglycerophosphocholine
LPC 16:0/0:0
ME860094
-
-
3.7655
496.33823
N-Acetyl-O-demethylpuromycin
-
ME860290
-
-
0.971
500.22385
(2R)-1-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-3...
-
ME860048
-
-
3.843
500.2754
2-arachidonyl-sn-glycero-3-phosphoethanolamine
-
ME860109
-
-
3.373
502.29131
2-[(11Z,14Z)-icosadienoyl]-sn-glycero-3-phosphoeth...
-
ME860105
-
-
2.1015
506.32315
N-Heptadecanoylglycine
-
ME860298
-
-
4.902166667
514.42276
Candoxatril
-
ME860187
-
-
1.1445
516.29388
N-tert-Butyloxycarbonyl-deacetyl-leupeptin
-
ME860314
-
-
1.112
517.36934
(6E)-5-Hydroxy-4-{[(1R,2S,5S)-2-hydroxy-5-isoprope...
-
ME860062
-
-
0.909
519.31279
1-Linoleoylglycerophosphocholine
LPC 18:2
ME860089
-
-
3.861
520.33834
1-Oleoylglycerophosphocholine
LPC 18:1/0:0
ME860093
-
-
4.19075
522.35386
(2R)-1-[(2S,4R,5Z)-4-Benzyl-2,5-dihydroxy-5-{[(1R,...
-
ME860047
-
-
4.492
523.3308
lysophosphatidylethanolamine (22:6(4Z,7Z,10Z,13Z,1...
-
ME860260
-
-
3.664666667
526.2912033
1-arachidonoyl-sn-glycero-3-phosphocholine
LPC 20:4/0:0
ME860087
-
-
3.791
544.3383
fluphenazine enanthate
-
ME860229
-
-
3.167
550.26944
N-(6-Aminohexanoyl)-6-aminohexanoate
-
ME860281
-
-
4.168
552.37544
1-[(8Z,11Z,14Z)-icosatrienoyl]-sn-glycero-3-phosph...
-
ME860080
-
-
3.558
568.33778
1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glyce...
-
ME860074
-
-
3.852
568.3381533
3-(7'-Hydroxy-4b',8',8',10a'-tetramethyl-5-oxotetr...
-
ME860126
-
-
13.695
610.37005
5,5',6,6'-Tetrahydro-3',6'-epoxy-beta,beta-caroten...
-
ME860154
-
-
1.017
619.43768
1,5-Methano-1H,3H,11H-furo(3,4-g)pyrano(3,2-b)xant...
-
ME860079
-
-
1.434
629.31148
mesaconitine
Mesaconitine
ME860266
-
-
1.896
632.30359
Methyl N-formylnorleucylleucylphenylalaninate
-
ME860268
-
-
0.617
650.89451
jesaconitine
-
ME860252
-
-
1.064
676.32943
Menaquinone 8
Menaquinone
ME860264
-
-
3.428
717.56045
1,2-Dipalmitoleoyl-sn-glycero-3-phosphocholine
PC 16:1/16:1
ME860077
-
-
3.173
730.53627
1-stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolami...
PE 18:0/18:1
ME860096
-
-
3.372
746.5678
1-hexadecanoyl-2-[(11Z)-octadec-9-enoyl]-sn-glycer...
-
ME860088
-
-
2.908
749.52904
1-(1Z,9Z-octadecadienyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-...
-
ME860073
-
-
2.697
774.54039
MFCD00135289
-
ME860271
-
-
3.114
782.56863
Pent-1-ene
-
ME860323
-
-
1.33375
79.599105
(2R)-2-[(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-Icosapent...
-
ME860050
-
-
3.578
808.58197
AL9450000
-
ME860167
-
-
13.503
85.076475
Cyclohexane
Cyclohexane
ME860200
-
-
1.175
85.10141
(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-Do...
-
ME860049
-
-
2.998
856.58367
Piperidine
Piperidine
ME860331
-
-
4.20256
86.0968296
2-Methylpyrrolidine
2-Methyl pyrrolidine
ME860121
-
-
6.3276
86.09688
N-{(2S,3R,4E)-3-Hydroxy-1-[(3-O-sulfo-beta-D-threo...
-
ME860285
-
-
4.24
864.6206
PC
-
ME860321
-
-
3.113
878.566935
Leucamine
-
ME860254
-
-
11.00478947
88.11248105
1,2-Dihydropyrimidine
-
ME860076
-
-
13.48963636
89.05583682
(R)-Acetoin
-
ME860065
-
-
1.803
89.06016
Deanol
Dimethylethanolamine
ME860206
-
-
14.016
90.09179333
2-Methylpropanaloxime
2-Methylpropanal oxime
ME860120
-
-
12.87884615
91.23200692
Piperazine
Piperazine
ME860330
-
-
11.94972727
91.55137636
4-Aminopyridine
4-Aminopyridine
ME860146
-
-
14.15283333
95.06074833
1,4-Dimethylimidazole
-
ME860078
-
-
8.185818182
97.07636455
1-Nitrosopiperidine
-
ME860092
-
-
0.412
97.07643
4-Imidazolemethanol
-
ME860148
-
-
0.817
99.05557
5-Aminopentanamide
5-Aminopentanamide
ME860156
-
-
0.093
99.09192
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Allopurinol
Allopurinol
ME860372
-
-
2.696
135.03014
Xanthine
Xanthine
ME860381
-
-
3.48
151.02546
Imafen
-
ME860374
-
-
12.4355
186.103135
meglumine
-
ME860376
-
-
4.527
194.10284
indanazoline
-
ME860375
-
-
13.516
200.118865
1D-chiro-inositol
1D-chiro-Inositol
ME860370
-
-
5.444
202.058515
tolonidine
-
ME860379
-
-
13.735
208.06424
Zonisamide
Zonisamide
ME860382
-
-
0.917
211.01794
tramazoline
-
ME860380
-
-
9.996
214.1347
1-Methoxypyrene
-
ME860371
-
-
5.684
231.08158
Didanosine
Didanosine
ME860373
-
-
5.4368
235.083598
NP-012534
-
ME860378
-
-
0.954
265.14809
Myristyl sulfate
-
ME860377
-
-
0.948
293.17958
UCSD Metabolomics Workbench, a resource sponsored by the Common Fund of the National Institutes of Health
Terms of use
Site map
Contact
NMDR Personnel