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Return to study ST000421 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
11-amino-undecanoic acid
11-Aminoundecanoic acid
ME138808
-
-
-
-
11-deoxy-PGE2
11-Deoxy-PGE2
ME138063
-
-
-
-
11-deoxy-PGE2 + 1.1395481
11-Deoxy-PGE2
ME138180
-
-
-
-
12,13-dihydroxy-11-methoxy-9-octadecenoic acid
12,13-Dihydroxy-11-methoxy-9-octadecenoic acid
ME138079
-
-
-
-
Hydroxyhydroquinone
1,2,4-Trihydroxybenzene
ME138512
-
-
-
-
Hydroxyhydroquinone + 2.6956372
1,2,4-Trihydroxybenzene
ME138538
-
-
-
-
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic Acid
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic acid
ME137823
-
-
-
-
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic Acid + 0....
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic acid
ME137888
-
-
-
-
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic Acid + 1....
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic acid
ME138192
-
-
-
-
12-oxo-10Z-dodecenoic acid
12-Oxo-10Z-dodecenoic acid
ME138252
-
-
-
-
12-oxo-9-octadecynoic acid
12-Oxo-9-octadecynoic acid
ME137974
-
-
-
-
12-oxo-9-octadecynoic acid + 1.118277
12-Oxo-9-octadecynoic acid
ME138082
-
-
-
-
1-(2-Pyrimidyl)piperazine
1-(2-Pyrimidyl)piperazine
ME138867
-
-
-
-
1,3-Dimethyluric acid
1,3-Dimethyluric acid
ME139396
-
-
-
-
13E,17-octadecadienoic acid
13E,17-Octadecadienoic acid
ME137949
-
-
-
-
14-hydroxy-12-tetradecenoic acid
14-Hydroxy-12-tetradecenoic acid
ME138013
-
-
-
-
15-methyl-15S-PGD2
15-Methyl-15S-PGD2
ME138100
-
-
-
-
16-hydroperoxy-9Z,12,14E-octadecatrienoic acid
16-HpOTrE
ME138164
-
-
-
-
16-hydroperoxy-9Z,12,14E-octadecatrienoic acid + 1...
16-HpOTrE
ME139335
-
-
-
-
19'-Hexanoyloxyfucoxanthinol
19'-Hexanoyloxyfucoxanthinol
ME137862
-
-
-
-
1-Aminocyclopropane-1-carboxylic acid
1-Aminocyclopropanecarboxylic acid
ME139239
-
-
-
-
1-Aminocyclohexanecarboxylic acid
1-Azaniumylcyclohexane-1-carboxylate
ME139271
-
-
-
-
1-Aminocyclohexanecarboxylic acid + 1.2134709
1-Azaniumylcyclohexane-1-carboxylate
ME139581
-
-
-
-
1-Aminocyclohexanecarboxylic acid + 7.9329
1-Azaniumylcyclohexane-1-carboxylate
ME139289
-
-
-
-
1-Hexadecylamine
1-Hexadecylamine
ME138519
-
-
-
-
1-Hexadecylamine + 3.443868
1-Hexadecylamine
ME138628
-
-
-
-
1-Hexadecylamine + 3.5535161
1-Hexadecylamine
ME138638
-
-
-
-
1-Methyladenosine
1-Methyladenosine
ME139078
-
-
-
-
1-Methylguanine
1-Methylguanine
ME138637
-
-
-
-
1-Methylguanosine
1-Methylguanosine
ME138608
-
-
-
-
1-Methylinosine
1-Methylinosine
ME138499
-
-
-
-
(1S,2S)-3-oxo-2-pentyl-cyclopentanebutanoic acid
(1S,2S)-3-Oxo-2-pentyl-cyclopentanebutanoic acid
ME138005
-
-
-
-
20alpha-Dihydroprednisolone
20alpha-dihydroprednisolone
ME138225
-
-
-
-
2,5-decadienoic acid
2,5-Decadienoic acid
ME138033
-
-
-
-
25-hydroxy-26,27-dimethylvitamin D3 / 25-hydroxy-2...
25-Hydroxy-26,27-dimethylvitamin D3
ME137897
-
-
-
-
DL-2-Aminooctanoic acid
2-Aminocaprylic acid
ME139232
-
-
-
-
o-Hydroxyaniline
2-Aminophenol
ME137805
-
-
-
-
2-Aminopropanol
2-Aminopropanol
ME138395
-
-
-
-
2-Aminopropanol + 6.2639914
2-Aminopropanol
ME139125
-
-
-
-
2-decylenic acid
2-Decenoic acid
ME137916
-
-
-
-
alpha-Ketopantoic acid
2-Dehydropantoic acid
ME138084
-
-
-
-
2E,5Z,8Z,11Z,14Z-eicosapentaenoic acid
2E,5Z,8Z,11Z,14Z-Eicosapentaenoic acid
ME137928
-
-
-
-
2-Ethylisonicotinic acid
2-Ethylisonicotinicacid
ME137798
-
-
-
-
2-Hydroxyadipic acid
2-Hydroxyadipic acid
ME138510
-
-
-
-
2-Hydroxyadipic acid + 2.7286863
2-Hydroxyadipic acid
ME139598
-
-
-
-
2-Hydroxyadipic acid + 2.7516344
2-Hydroxyadipic acid
ME138561
-
-
-
-
2-Hydroxyiminodibenzyl
2-Hydroxyiminodibenzyl
ME138500
-
-
-
-
2-Methylbutyrylglycine
2-Methylbutyrylglycine
ME138397
-
-
-
-
2-Methylbutyrylglycine + 2.0688164
2-Methylbutyrylglycine
ME138461
-
-
-
-
2-Methylbutyrylglycine + 6.4871807
2-Methylbutyrylglycine
ME139207
-
-
-
-
(E)-2-Methylglutaconic acid
2-Methylglutaconic acid
ME138509
-
-
-
-
(E)-2-Methylglutaconic acid + 2.7002208
2-Methylglutaconic acid
ME138545
-
-
-
-
(E)-2-Methylglutaconic acid + 2.7561738
2-Methylglutaconic acid
ME139421
-
-
-
-
(E)-2-Methylglutaconic acid + 7.117085
2-Methylglutaconic acid
ME139275
-
-
-
-
2-Methylhippuric acid
2-Methylhippuric acid
ME138467
-
-
-
-
2-methyl-tridecanedioic acid
2-Methyl-tridecanedioic acid
ME137996
-
-
-
-
2-Octenedioic acid
2-Octenedioic acid
ME138275
-
-
-
-
2-Octenedioic acid + 6.6523614
2-Octenedioic acid
ME139547
-
-
-
-
2-oxo capric acid
2-Oxo capric acid
ME138051
-
-
-
-
2-Pyrrolidinone
2-Pyrrolidinone
ME138254
-
-
-
-
2-Pyrrolidinone + 1.5893642
2-Pyrrolidinone
ME138345
-
-
-
-
2-Pyrrolidinone + 2.050616
2-Pyrrolidinone
ME138457
-
-
-
-
2-Pyrrolidinone + 2.8145652
2-Pyrrolidinone
ME138583
-
-
-
-
2-Pyrrolidinone + 3.2609262
2-Pyrrolidinone
ME138616
-
-
-
-
2-Pyrrolidinone + 3.762933
2-Pyrrolidinone
ME138643
-
-
-
-
3,5-hexadienoic acid
3,5-Hexadienoic acid
ME137946
-
-
-
-
3,6,8-dodecatrien-1-ol
3,6,8-Dodecatrien-1-ol
ME137907
-
-
-
-
3,6-octadecadiynoic acid
3,6-Octadecadiynoic acid
ME138022
-
-
-
-
3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-c...
3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-cholest-23-en-26-oic acid
ME138043
-
-
-
-
3alpha,7alpha,12beta-Trihydroxy-11-oxo-5beta-chola...
3alpha,7alpha,12beta-Trihydroxy-11-oxo-5beta-cholan-24-oic acid
ME138985
-
-
-
-
3alpha,7alpha,12beta-Trihydroxy-11-oxo-5beta-chola...
3alpha,7alpha,12beta-Trihydroxy-11-oxo-5beta-cholan-24-oic acid
ME139488
-
-
-
-
3E,5E-tridecadienoic acid
3E,5E-Tridecadienoic acid
ME138198
-
-
-
-
3-hexenal
3-Hexenal
ME138785
-
-
-
-
3-Indolepropionic acid
3-Indolepropionic acid
ME138102
-
-
-
-
(3-Methoxy-4-hydroxyphenyl)ethylene glycol sulfate
3-Methoxy-4-hydroxyphenylethyleneglycol sulfate
ME139711
-
-
-
-
3-Methyl-3Z-Pentenoic Acid
3-Methyl-3Z-pentenoic acid
ME137915
-
-
-
-
3-Methylxanthine
3-Methylxanthine
ME138343
-
-
-
-
3-oxo-4-pentenoic acid
3-Oxo-4-pentenoic acid
ME138529
-
-
-
-
3-Oxovalproic acid
3-Oxovalproicacid
ME138812
-
-
-
-
3R-hydroxy-5Z-dodecenoic acid
3R-Hydroxy-5Z-dodecenoic acid
ME138040
-
-
-
-
3-tert-butyl-3-butenoic acid
3-tert-Butyl-3-butenoic acid
ME137934
-
-
-
-
4,7,10,13,16-docosapentaenoic acid
4,7,10,13,16-Docosapentaenoic acid
ME137831
-
-
-
-
4,7,10,13-hexadecatetraenoic acid
4,7,10,13-Hexadecatetraenoic acid
ME138115
-
-
-
-
4,8,12,15,19,21-tetracosahexaenoic acid
4,8,12,15,19,21-Tetracosahexaenoic acid
ME138228
-
-
-
-
4-Aminobutyraldehyde
4-Aminobutyraldehyde
ME138758
-
-
-
-
4-Aminobutyraldehyde + 5.1598577
4-Aminobutyraldehyde
ME138849
-
-
-
-
4-Aminobutyraldehyde + 5.2646117
4-Aminobutyraldehyde
ME138866
-
-
-
-
4-dodecynoic acid
4-Dodecynoic acid
ME137931
-
-
-
-
4-Guanidinobutanoate
4-Guanidinobutanoic acid
ME139083
-
-
-
-
4-Hydroxybenzyl cyanide
4-Hydroxybenzeneacetonitrile
ME137804
-
-
-
-
4-Hydroxypyridine
4-Pyridone
ME138607
-
-
-
-
4-Hydroxypyridine + 0.82303476
4-Pyridone
ME139295
-
-
-
-
4-undecynoic acid
4-Undecynoic acid
ME137948
-
-
-
-
(+/-)5,6-DiHETrE
5,6-DiHETrE
ME138178
-
-
-
-
5,7-nonadienoic acid
5,7-Nonadienoic acid
ME138242
-
-
-
-
5Z,8Z-tetradecadienoic acid
5,8-Tetradecadienoic acid
ME137983
-
-
-
-
5-Acetyl-4-methylthiazole
5-Acetyl-4-methylthiazole
ME138333
-
-
-
-
5-Hydroxypyrazinamide
5-Hydroxypyrazinamide
ME139434
-
-
-
-
5-Methylcytidine
5-Methylcytidine
ME138626
-
-
-
-
5-Methylthioribose
5-Methylthioribose
ME138576
-
-
-
-
5-O-Methylvisamminol
5-O-Methylvisamminol
ME138295
-
-
-
-
5-oxo-7-octenoic acid
5-Oxo-7-octenoic acid
ME139366
-
-
-
-
6-[3]-ladderane-1-hexanol
6-[3]-Ladderane-1-hexanol
ME137952
-
-
-
-
6,9,12-hexadecatrienoic acid
6,9,12-hexadecatrienoic acid
ME137973
-
-
-
-
6alpha-Hydroxycastasterone
6alpha-Hydroxycastasterone
ME137956
-
-
-
-
6-Dimethylaminopurine
6-Dimethylaminopurine
ME138406
-
-
-
-
6-Formylindolo [3,2-B] carbazole
6-Formylindolo[3,2-B]carbazole
ME138931
-
-
-
-
6-hydroxy-2-hexynoic acid
6-Hydroxy-2-hexynoic acid
ME138437
-
-
-
-
6-methyltetrahydropterin
6-Methyltetrahydropterin
ME138460
-
-
-
-
7,12-Dioxo-5beta-cholan-24-oic Acid
7,12-Dioxo-5beta-cholan-24-oic acid
ME137895
-
-
-
-
7,12-Dioxo-5beta-cholan-24-oic Acid + 1.1811479
7,12-Dioxo-5beta-cholan-24-oic acid
ME138208
-
-
-
-
7,8-dihydroxy stearic acid
7,8-Dihydroxy stearic acid
ME137958
-
-
-
-
7-Aminoclonazepam
7-Aminoclonazepam
ME139402
-
-
-
-
7-Hydroxymethotrexate
7-Hydroxymethotrexate
ME138408
-
-
-
-
8-Amino-7-oxononanoate
8-Amino-7-oxononanoic acid
ME138323
-
-
-
-
8-Amino-7-oxononanoate + 1.2685084
8-Amino-7-oxononanoic acid
ME139582
-
-
-
-
8-Amino-7-oxononanoate + 7.30499
8-Amino-7-oxononanoic acid
ME139279
-
-
-
-
8-Amino Caprylic acid
8-Aminooctanoic acid
ME139257
-
-
-
-
8-methoxy-13-hydroxy-9,11-octadecadienoic acid
8-Methoxy-13-hydroxy-9,11-octadecadienoic acid
ME138083
-
-
-
-
9,12,14-octadecatrienoic acid
9,12,14-Octadecatrienoic acid
ME137954
-
-
-
-
9,13-dihydroxy-11-octadecenoic acid
9,13-DiHOME(11)
ME137950
-
-
-
-
9-amino-nonanoic acid
9-Aminononanoic acid
ME138248
-
-
-
-
9-amino-nonanoic acid + 4.460704
9-Aminononanoic acid
ME139614
-
-
-
-
9-lauroleic acid
9-Dodecenoic acid
ME137912
-
-
-
-
ACECLIDINE
Aceclidine
ME138318
-
-
-
-
Acenocoumarol
Acenocoumarol
ME137796
-
-
-
-
Acetoacetic acid
Acetoacetic acid
ME138528
-
-
-
-
Acetoacetic acid + 2.6840415
Acetoacetic acid
ME138546
-
-
-
-
Acetoacetic acid + 7.57222
Acetoacetic acid
ME139285
-
-
-
-
Acetoin
Acetoin
ME138258
-
-
-
-
Acetoin + 1.6106687
Acetoin
ME138361
-
-
-
-
Acipimox
Acipimox
ME138475
-
-
-
-
Adenine
Adenine
ME138593
-
-
-
-
alpha-Hydroxymetoprolol
alpha-Hydroxymetoprolol
ME139134
-
-
-
-
L-2-Aminoadipic acid
Aminoadipic acid
ME138531
-
-
-
-
2-Aminoisobutyric acid
Aminoisobutyric acid
ME138386
-
-
-
-
ANISOMYCIN
Anisomycin
ME139198
-
-
-
-
L-Alanine n-butyl ester
Arabinonic acid
ME139140
-
-
-
-
L-Alanine n-butyl ester + 7.122861
Arabinonic acid
ME139274
-
-
-
-
ARECOLINE
Arecoline
ME138329
-
-
-
-
Arginine
Arginine
ME139641
-
-
-
-
Asn Phe Ala
Asn-Phe-Ala
ME137841
-
-
-
-
Benserazide
Benserazide
ME139556
-
-
-
-
Benzene
Benzene
ME139326
-
-
-
-
BERGENIN
Bergenin
ME138453
-
-
-
-
beta-Alanine
beta-Alanine
ME139151
-
-
-
-
beta-Alanine + 6.861986
beta-Alanine
ME139260
-
-
-
-
beta-vinyl acrylic acid
beta-Vinyl acrylic acid
ME138506
-
-
-
-
beta-vinyl acrylic acid + 2.6553457
beta-Vinyl acrylic acid
ME138530
-
-
-
-
beta-vinyl acrylic acid + 2.7240262
beta-Vinyl acrylic acid
ME138580
-
-
-
-
Bilirubin
Bilirubin
ME137923
-
-
-
-
Bilirubin + 3.964413
Bilirubin
ME138663
-
-
-
-
Biliverdin IX
Biliverdin
ME138311
-
-
-
-
Biliverdin IX + 1.6432531
Biliverdin
ME138360
-
-
-
-
Biliverdin IX + 5.3967257
Biliverdin
ME139629
-
-
-
-
(+)-Bornane-2,5-dione
Bornane-2,5-dione
ME137976
-
-
-
-
Brassinolide
Brassinolide
ME138217
-
-
-
-
BUFEXAMAC
Bufexamac
ME138489
-
-
-
-
Buprenorphine
Buprenorphine
ME139200
-
-
-
-
Buprenorphine + 6.549572
Buprenorphine
ME139223
-
-
-
-
Cadaverine
Cadaverine
ME138600
-
-
-
-
Caffeine
Caffeine
ME139368
-
-
-
-
Propoxyphene
Caffeine
ME139574
-
-
-
-
n-Hexanoic Acid
Caproic acid
ME138270
-
-
-
-
Capryloylglycine
Capryloylglycine
ME138488
-
-
-
-
Carbaryl
Carbaryl
ME138296
-
-
-
-
Carboxyibuprofen
Carboxyibuprofen
ME139397
-
-
-
-
Chlortetracycline
Chlortetracycline
ME139430
-
-
-
-
ciclopirox
Ciclopirox
ME138340
-
-
-
-
p-Coumaric acid
cis-p-Coumaric acid
ME139019
-
-
-
-
Creatine
Creatine
ME139261
-
-
-
-
Creatinine
Creatinine
ME138497
-
-
-
-
Creatinine + 3.992575
Creatinine
ME138668
-
-
-
-
Creatinine + 4.191031
Creatinine
ME139453
-
-
-
-
Crotonic acid
Crotonic acid
ME139415
-
-
-
-
cyclohexylammonium
Cyclohexylamine
ME138569
-
-
-
-
cyclohexylammonium + 4.572306
Cyclohexylamine
ME138749
-
-
-
-
cyclohexylammonium + 4.9269075
Cyclohexylamine
ME138801
-
-
-
-
cyclohexylammonium + 5.1955566
Cyclohexylamine
ME138858
-
-
-
-
Cys Asn Thr
Cys-Asn-Thr
ME138903
-
-
-
-
Cytosine
Cytosine
ME138483
-
-
-
-
Cytosine + 3.4042628
Cytosine
ME138625
-
-
-
-
Cytosine + 3.9254932
Cytosine
ME138659
-
-
-
-
1-(9Z-hexadecenoyl)-2-(9Z,12Z-heptadecadienoyl)-sn...
DG 16:1_17:2
ME137951
-
-
-
-
Diacetyl
Diacetyl
ME139276
-
-
-
-
Diacetyl + 1.5359212
Diacetyl
ME139376
-
-
-
-
Diacetyl + 2.5729017
Diacetyl
ME139411
-
-
-
-
Diazepam
Diazepam
ME138444
-
-
-
-
Diethanolamine
Diethanolamine
ME138875
-
-
-
-
Diethanolamine + 5.4235935
Diethanolamine
ME138962
-
-
-
-
Diethanolamine + 5.6023684
Diethanolamine
ME138990
-
-
-
-
Diethanolamine + 5.6117415
Diethanolamine
ME139499
-
-
-
-
Diethanolamine + 5.770817
Diethanolamine
ME139022
-
-
-
-
Dihydroxylycopene/ OH-Rhodopin
Dihydroxylycopene
ME137860
-
-
-
-
Dimethylglycine
Dimethylglycine
ME139171
-
-
-
-
dimethyl sulfoxide
Dimethyl sulfoxide
ME138396
-
-
-
-
D-Leucic acid
D-Leucic acid
ME138369
-
-
-
-
D-Leucic acid + 1.7634912
D-Leucic acid
ME138392
-
-
-
-
dodecanamide
Dodecanamide
ME138135
-
-
-
-
p-HYDROXYCINNAMALDEHYDE
(E)-3-(4-Hydroxyphenyl)-2-propenal
ME138966
-
-
-
-
Ecgonine
Ecgonine
ME138991
-
-
-
-
Ecgonine + 6.5281243
Ecgonine
ME139218
-
-
-
-
Eicosanedioic acid
Eicosanedioic acid
ME139089
-
-
-
-
Anandamide (20:5, n-3)
Eicosapentenoyl-EA
ME137905
-
-
-
-
epsilon-Caprolactam
Epsilon-caprolactam
ME138309
-
-
-
-
epsilon-Caprolactam + 1.5566033
Epsilon-caprolactam
ME138341
-
-
-
-
Erythromycin
Erythromycin
ME139189
-
-
-
-
Ethosuximide
Ethosuximide
ME138661
-
-
-
-
Ethosuximide + 4.8916454
Ethosuximide
ME138775
-
-
-
-
Ethosuximide + 5.3117914
Ethosuximide
ME139489
-
-
-
-
Ethosuximide + 5.762143
Ethosuximide
ME139524
-
-
-
-
URETHANE
Ethyl carbamate
ME138502
-
-
-
-
4,6-Diamino-5-formamidopyrimidine
FAPy-adenine
ME138627
-
-
-
-
Fexofenadine
Fexofenadine
ME138883
-
-
-
-
L-Fucose
Fucose
ME139408
-
-
-
-
Gabapentin
Gabapentin
ME139268
-
-
-
-
Glucosamine
Glucosamine
ME138525
-
-
-
-
Glucosamine + 4.094891
Glucosamine
ME139452
-
-
-
-
D-Glucose
Glucose
ME138297
-
-
-
-
D-Glucose + 2.726834
Glucose
ME138549
-
-
-
-
Glu Cys Tyr
Glu-Cys-Tyr
ME139389
-
-
-
-
Glutaral (Glutaraldehyde)
Glutaral
ME138157
-
-
-
-
Glutaral (Glutaraldehyde) + 1.3851916
Glutaral
ME138299
-
-
-
-
Glutaral (Glutaraldehyde) + 6.6251254
Glutaral
ME139231
-
-
-
-
glyceraldehyde
Glyceraldehyde
ME138543
-
-
-
-
Glycoursodeoxycholic acid
Glycoursodeoxycholic acid
ME138788
-
-
-
-
Gly Glu
Gly-Glu
ME139704
-
-
-
-
Gly Gly Gly
Gly-Gly-Gly
ME139665
-
-
-
-
Guanidinosuccinic Acid
Guanidinosuccinic acid
ME139012
-
-
-
-
GUVACINE
Guvacine
ME139675
-
-
-
-
Hippuric acid
Hippuric acid
ME138604
-
-
-
-
His Asn Asp
His-Asn-Asp
ME138544
-
-
-
-
Hypoxanthine
Hypoxanthine
ME138523
-
-
-
-
Hypoxanthine + 2.7262764
Hypoxanthine
ME139412
-
-
-
-
Hypoxanthine + 2.8479283
Hypoxanthine
ME138587
-
-
-
-
Ile Ala
Ile-Ala
ME139270
-
-
-
-
INDOLE-3-CARBINOL
Indole-3-carbinol
ME137802
-
-
-
-
3-Indoleacetic Acid
Indoleacetic acid
ME138139
-
-
-
-
Indoleacrylic acid
Indoleacrylic acid
ME138901
-
-
-
-
Indoleacrylic acid + 5.5371394
Indoleacrylic acid
ME138947
-
-
-
-
Indospicine
Indospicine
ME139108
-
-
-
-
Indoxylsulfuric acid
Indoxyl sulfate
ME137806
-
-
-
-
Isobutyrylglycine
Isobutyrylglycine
ME139635
-
-
-
-
Isoleucine
Isoleucine
ME138355
-
-
-
-
Isoleucine + 4.312832
Isoleucine
ME138704
-
-
-
-
Isoleucine + 6.546938
Isoleucine
ME139548
-
-
-
-
ISOLIQUIRITIGENIN
Isoliquiritigenin
ME138602
-
-
-
-
Isoniazid
Isoniazid
ME139369
-
-
-
-
ISOPIMPINELLIN
Isopimpinellin
ME138558
-
-
-
-
Isoquinoline
Isoquinoline
ME138125
-
-
-
-
Isoquinoline + 3.7221823
Isoquinoline
ME138640
-
-
-
-
ISOSAFROLE
Isosafrole
ME137903
-
-
-
-
KOBUSONE
Kobusone
ME137997
-
-
-
-
Kynurenine
Kynurenine
ME138955
-
-
-
-
Lactic acid
Lactic acid
ME138511
-
-
-
-
Lamivudine
Lamivudine
ME137810
-
-
-
-
Leucine
Leucine
ME139015
-
-
-
-
Leucine + 1.5093799
Leucine
ME139375
-
-
-
-
Leucine + 6.6482687
Leucine
ME139238
-
-
-
-
Leu His Cys
Leu-His-Cys
ME138438
-
-
-
-
Leupeptin
Leupeptin
ME138200
-
-
-
-
Leu Pro
Leu-Pro
ME139288
-
-
-
-
Leu Pro + 7.9430532
Leu-Pro
ME139290
-
-
-
-
Limonene-1,2-epoxide
Limonene-1,2-epoxide
ME137917
-
-
-
-
Limonene-1,2-epoxide + 1.2240425
Limonene-1,2-epoxide
ME138249
-
-
-
-
Linoleamide
Linoleamide
ME139344
-
-
-
-
Linolenoyl lysolecithin
LPC 18:3
ME139637
-
-
-
-
GPEtn(18:0/0:0)
LPE 18:0/0:0
ME139212
-
-
-
-
Lys Asn Pro
Lys-Asn-Pro
ME139060
-
-
-
-
Lys Asn Pro + 5.9515862
Lys-Asn-Pro
ME139633
-
-
-
-
Lys Gln Ile
Lys-Gln-Ile
ME138629
-
-
-
-
Lys His Met
Lys-His-Met
ME138087
-
-
-
-
Lys Leu Ser
Lys-Leu-Ser
ME137876
-
-
-
-
Lys Trp Pro
Lys-Trp-Pro
ME138377
-
-
-
-
Lys Val Leu
Lys-Val-Leu
ME137891
-
-
-
-
MELOXICAM
Meloxicam
ME138983
-
-
-
-
Met Glu Cys
Met-Glu-Cys
ME139436
-
-
-
-
Methionine
Methionine
ME138614
-
-
-
-
1-Monopalmitin
MG 16:0/0:0/0:0
ME138026
-
-
-
-
1-octadecanoyl-rac-glycerol
MG 18:0
ME137993
-
-
-
-
1-(11E-octadecenoyl)-rac-glycerol
MG 18:1
ME138106
-
-
-
-
1-(9Z,12Z-octadecadienoyl)-rac-glycerol
MG 18:2
ME138044
-
-
-
-
Phthalic acid Mono-2-ethylhexyl Ester
Monoethylhexyl phthalic acid
ME137896
-
-
-
-
Myricetin
Myricetin
ME138366
-
-
-
-
N1-Acetylspermidine
N1-Acetylspermidine
ME139557
-
-
-
-
N-Acetyl-9-O-lactoylneuraminic acid
N-Acetyl-9-O-lactoylneuraminic acid
ME139443
-
-
-
-
N-Acetylarylamine
N-Acetylarylamine
ME139020
-
-
-
-
N-Acryloylglycine
N-Acryloylglycine
ME138838
-
-
-
-
Nadolol
Nadolol
ME139098
-
-
-
-
Nalorphine
Nalorphine
ME138066
-
-
-
-
Netilmicin
Netilmicin
ME138693
-
-
-
-
Niacinamide
Niacinamide
ME138353
-
-
-
-
Nitrosobenzene
Nitrosobenzene
ME138491
-
-
-
-
3-Nitrotyrosine
Nitrotyrosine
ME138471
-
-
-
-
n-methylnicotinamide
N-Methylnicotinamide
ME138302
-
-
-
-
n-methylnicotinamide + 5.7782574
N-Methylnicotinamide
ME139027
-
-
-
-
n-methylnicotinamide + 5.9732666
N-Methylnicotinamide
ME139068
-
-
-
-
Norcodeine
Norcodeine
ME138124
-
-
-
-
Normeperidinic acid
Normeperidinicacid
ME139095
-
-
-
-
n-Pentadecylamine
N-Pentadecylamine
ME139410
-
-
-
-
5-NITRO-2-PHENYLPROPYLAMINOBENZOIC ACID [NPPB]
NPPB
ME138168
-
-
-
-
5-NITRO-2-PHENYLPROPYLAMINOBENZOIC ACID [NPPB] + 1...
NPPB
ME138413
-
-
-
-
Ophiobolin A
Ophiobolin A
ME138936
-
-
-
-
2-Oxovaleric acid
Oxovaleric acid
ME139417
-
-
-
-
Oxymorphone
Oxymorphone
ME138148
-
-
-
-
GPA(21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PA 21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME138848
-
-
-
-
p-Aminobenzoic acid
p-Aminobenzoic acid
ME138407
-
-
-
-
p-Aminobenzoic acid + 6.457855
p-Aminobenzoic acid
ME139532
-
-
-
-
p-Aminobenzoic acid + 6.608752
p-Aminobenzoic acid
ME139229
-
-
-
-
Pantothenic Acid
Pantothenic acid
ME138501
-
-
-
-
Paraxanthine
Paraxanthine
ME138316
-
-
-
-
Paraxanthine + 3.9014282
Paraxanthine
ME139445
-
-
-
-
GPEtn(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PE 16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME138725
-
-
-
-
Distearyl phosphatidyl ethanolamine
PE 18:0/18:0
ME139470
-
-
-
-
GPEtn(18:0/18:3(9Z,12Z,15Z))[U]
PE 18:0/18:3(9Z,12Z,15Z)
ME138734
-
-
-
-
GPEtn(18:0/20:4(5Z,8Z,11Z,14Z))[U]
PE 18:0/20:4(5Z,8Z,11Z,14Z)
ME138722
-
-
-
-
GPEtn(18:1(11Z)/18:1(9Z))[U]
PE 18:1(11Z)/18:1(9Z)
ME139373
-
-
-
-
GPEtn(22:0/20:1(11Z))
PE 22:0/20:1(11Z)
ME138819
-
-
-
-
pentanamide
Pentanamide
ME139286
-
-
-
-
GPEtn(O-16:0/22:5(4Z,7Z,10Z,13Z,16Z))
PE O-16:0/22:5(4Z,7Z,10Z,13Z,16Z)
ME139454
-
-
-
-
PGI3
PGI3
ME138153
-
-
-
-
Phe Leu
Phe-Leu
ME139604
-
-
-
-
Phenacetine
Phenacetin
ME139069
-
-
-
-
Phendimetrazine
Phendimetrazine
ME138113
-
-
-
-
Phenylmethyl methyl ketone
Phenylacetone
ME138098
-
-
-
-
Phenylalanine
Phenylalanine
ME139017
-
-
-
-
Phenylethylamine
Phenylethylamine
ME139490
-
-
-
-
Phenylethylmalonamide (PEMA)
Phenylethylmalonamide
ME139431
-
-
-
-
Ethanolamine phosphate (Phosphoethanolamine)
Phosphoethanolamine
ME138490
-
-
-
-
Phosphoric acid
Phosphoric acid
ME138019
-
-
-
-
GPIns(16:0/16:0)
PI 16:0/16:0
ME138831
-
-
-
-
GPIns(16:0/18:1(9Z))
PI 16:0/18:1(9Z)
ME138610
-
-
-
-
GPIns(16:0/18:1(9Z)) + 5.0012336
PI 16:0/18:1(9Z)
ME138820
-
-
-
-
Pilocarpine
Pilocarpine
ME138272
-
-
-
-
Pinacidil
Pindac
ME139208
-
-
-
-
Pro Arg Asp
Pro-Arg-Asp
ME138110
-
-
-
-
Pro His
Pro-His
ME139026
-
-
-
-
Pro His Gly
Pro-His-Gly
ME138367
-
-
-
-
Proline
Proline
ME139122
-
-
-
-
Proparacaine
Proparacaine
ME137835
-
-
-
-
Propofol
Propofol
ME137922
-
-
-
-
Pro Pro Leu
Pro-Pro-Leu
ME138958
-
-
-
-
GPSer(16:0/20:0)
PS 16:0/20:0
ME138836
-
-
-
-
1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-ph...
PS 18:0_18:1
ME138854
-
-
-
-
Pyrazinoic acid
Pyrazine-2-carboxylic ccid
ME138470
-
-
-
-
Pyridine
Pyridine
ME138283
-
-
-
-
Pyroglutamic acid
Pyroglutamic acid
ME139023
-
-
-
-
Pyroglutamic acid + 6.9008365
Pyroglutamic acid
ME139253
-
-
-
-
Methylglyoxal
Pyruvaldehyde
ME138508
-
-
-
-
Methylglyoxal + 0.99377394
Pyruvaldehyde
ME139306
-
-
-
-
Methylglyoxal + 2.6880658
Pyruvaldehyde
ME138547
-
-
-
-
OXYQUINOLINE
Quinolin-8-ol
ME138090
-
-
-
-
OXYQUINOLINE + 1.1740991
Quinolin-8-ol
ME138176
-
-
-
-
OXYQUINOLINE + 5.5401073
Quinolin-8-ol
ME138949
-
-
-
-
Quinone
Quinone
ME138507
-
-
-
-
Quinone + 2.690432
Quinone
ME138542
-
-
-
-
Rhodoxanthin
Rhodoxanthin
ME137824
-
-
-
-
SAFROLE
Safrole
ME138072
-
-
-
-
Ser Pro Asn
Ser-Pro-Asn
ME138376
-
-
-
-
stigmasta-7,22E,25-trien-3beta-ol
Stigmasta-7,22E,25-trien-3beta-ol
ME137941
-
-
-
-
Succinic anhydride
Succinic anhydride
ME138539
-
-
-
-
Succinylacetone
Succinylacetone
ME139262
-
-
-
-
Sulfaquinoxaline
Sulfaquinoxaline
ME138504
-
-
-
-
5-(hydroxymethyl)- 2-Furancarboxylic acid
Sumiki's acid
ME138859
-
-
-
-
5-(hydroxymethyl)- 2-Furancarboxylic acid + 5.2783...
Sumiki's acid
ME138888
-
-
-
-
5-(hydroxymethyl)- 2-Furancarboxylic acid + 5.4691...
Sumiki's acid
ME138992
-
-
-
-
Tacrolimus
Tacrolimus
ME139363
-
-
-
-
Taurine
Taurine
ME138847
-
-
-
-
TEGASEROD
Tegaserod
ME139492
-
-
-
-
Terephthalic acid
Terephthalic acid
ME137889
-
-
-
-
TG(17:2(9Z,12Z)/18:0/22:3(10Z,13Z,16Z))[iso6]
TG 17:2(9Z,12Z)/18:0/22:3(10Z,13Z,16Z)
ME138927
-
-
-
-
TG(18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16...
TG 18:0/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)
ME138908
-
-
-
-
Tranexamic acid
Tranexamic acid
ME138372
-
-
-
-
Tranexamic acid + 6.6438603
Tranexamic acid
ME139233
-
-
-
-
Trolamine
Triethanolamine
ME138981
-
-
-
-
Trihydroxycoprostanoic acid
Trihydroxycoprostanoic acid
ME137970
-
-
-
-
Trimethylamine
Trimethylamine
ME138997
-
-
-
-
Triparanol
Triparanol
ME138374
-
-
-
-
Triparanol + 6.3799906
Triparanol
ME139166
-
-
-
-
Triparanol + 6.662329
Triparanol
ME139240
-
-
-
-
Triparanol + 7.607654
Triparanol
ME139287
-
-
-
-
Trp Phe
Trp-Phe
ME138787
-
-
-
-
Trp Trp His
Trp-Trp-His
ME137866
-
-
-
-
Trp Tyr Tyr
Trp-Tyr-Tyr
ME138620
-
-
-
-
Indole-3-ethanol
Tryptophanol
ME138823
-
-
-
-
Indole-3-ethanol + 5.098097
Tryptophanol
ME138835
-
-
-
-
Indole-3-ethanol + 6.3566046
Tryptophanol
ME139536
-
-
-
-
Indole-3-ethanol + 6.4458528
Tryptophanol
ME139193
-
-
-
-
Tylosin
Tylosin
ME138841
-
-
-
-
Tyr Pro
Tyr-Pro
ME138273
-
-
-
-
Uracil
Uracil
ME138351
-
-
-
-
Urea
Urea
ME138405
-
-
-
-
Urea + 1.9498616
Urea
ME139593
-
-
-
-
Urea + 5.2478967
Urea
ME139674
-
-
-
-
Uridine
Uridine
ME138352
-
-
-
-
Uridine + 2.1526797
Uridine
ME138473
-
-
-
-
Urocanic acid
Urocanic acid
ME138371
-
-
-
-
Urocanic acid + 2.6179063
Urocanic acid
ME138533
-
-
-
-
Valine
Valine
ME138394
-
-
-
-
Valine + 6.5252156
Valine
ME139219
-
-
-
-
Vidarabine
Vidarabine
ME138592
-
-
-
-
Vigabatrin
Vigabatrin
ME138300
-
-
-
-
Vigabatrin + 3.9106317
Vigabatrin
ME138656
-
-
-
-
Vigabatrin + 5.8527026
Vigabatrin
ME139039
-
-
-
-
Vigabatrin + 6.230679
Vigabatrin
ME139115
-
-
-
-
10-hydroxy-2E,8E-Decadiene-4,6-diynoic acid
-
ME138282
-
-
-
-
1-(10Z,13Z,16Z-docosatrienoyl)-2-(4Z,7Z,10Z,13Z,16...
-
ME138017
-
-
-
-
1-(14-methyl-pentadecanoyl)-2-(8-[3]-ladderane-oct...
-
ME139612
-
-
-
-
1,2-di-(9Z,12Z,15Z-octadecatrienoyl)-3-(8-(2E,4Z-d...
-
ME139043
-
-
-
-
1,2-di-(9Z-heptadecenoyl)-3-(9Z,12Z,15Z-octadecatr...
-
ME139299
-
-
-
-
13S-hydroxy-9E,11Z-octadecadienoic acid
-
ME137969
-
-
-
-
(17Z)-1alpha,25-dihydroxy-26,27-dimethyl-17,20,22,...
-
ME139567
-
-
-
-
1-(8-[3]-ladderane-octanoyl)-2-(8-[3]-ladderane-oc...
-
ME138713
-
-
-
-
1-(8-[3]-ladderane-octanoyl)-2-(8-[3]-ladderane-oc...
-
ME138843
-
-
-
-
1-(9Z-hexadecenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraen...
-
ME137886
-
-
-
-
1alpha,25-dihydroxy-11alpha-[(1R)-oxiranyl]vitamin...
-
ME138578
-
-
-
-
1alpha,25-dihydroxy-11alpha-[(1R)-oxiranyl]vitamin...
-
ME139701
-
-
-
-
1alpha,25-dihydroxy-11beta-methoxyvitamin D3 / 1al...
-
ME137985
-
-
-
-
1alpha,25-dihydroxy-16,17-didehydrovitamin D_3 / 1...
-
ME138197
-
-
-
-
1alpha,25-dihydroxy-22-oxavitamin D3 3-hemiglutara...
-
ME139118
-
-
-
-
1alpha,25-dihydroxy-24-oxovitamin D_3 / 1alpha,25-...
-
ME138156
-
-
-
-
1alpha,25-dihydroxy-26,27-dimethyl-20,21,22,22,23,...
-
ME139651
-
-
-
-
1alpha,25-dihydroxy-2beta-(4-hydroxybutoxy)vitamin...
-
ME138648
-
-
-
-
1alpha,25-dihydroxy-2beta-(5-hydroxypentoxy)vitami...
-
ME138068
-
-
-
-
1alpha-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-ben...
-
ME138162
-
-
-
-
1alpha-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-ben...
-
ME139649
-
-
-
-
1alpha-hydroxy-23-[3-(1-hydroxy-1-methylethyl)phen...
-
ME138151
-
-
-
-
1beta,25-dihydroxy-2beta-(3-hydroxypropoxy)vitamin...
-
ME138631
-
-
-
-
1-heneicosanoyl-2-(13Z,16Z-docosadienoyl)-sn-glyce...
-
ME137980
-
-
-
-
1-heneicosanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahex...
-
ME139625
-
-
-
-
1-heptadecanoyl, 2-(5Z,8Z,11Z,14Z-eicosatetraenoyl...
-
ME138833
-
-
-
-
1-heptadecanoyl-2-(9Z-tetradecenoyl)-sn-glycero-3-...
-
ME138832
-
-
-
-
1-heptadecanoyl-2-(9Z-tetradecenoyl)-sn-glycero-3-...
-
ME138846
-
-
-
-
1-O-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-doco...
-
ME138716
-
-
-
-
1-O-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-doco...
-
ME139610
-
-
-
-
(22E,24E,24bE)-1alpha,25-dihydroxy-26,27-dimethyl-...
-
ME138010
-
-
-
-
(22E,24E,24bE)-1alpha,25-dihydroxy-26,27-dimethyl-...
-
ME139330
-
-
-
-
(22E)-3beta-Hydroxychola-5,22-dien-24-oic Acid
-
ME138215
-
-
-
-
(22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23...
-
ME138030
-
-
-
-
(22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23...
-
ME138134
-
-
-
-
(23R,25R)-1alpha,25-dihydroxyvitamin D3 26,23-lact...
-
ME138166
-
-
-
-
2,4-Diamino-6,7-dimethoxyquinazoline
-
ME138402
-
-
-
-
(24S)-1alpha,24-dihydroxy-22-oxavitamin D3 / (24S)...
-
ME139298
-
-
-
-
26,27-diethyl-1alpha,25-dihydroxy-20,21-methano-23...
-
ME139302
-
-
-
-
2-Amino-2-methyl-1-propanol
-
ME138342
-
-
-
-
2-Amino-2-methyl-1-propanol + 5.1816993
-
ME138852
-
-
-
-
2-Amino-2-methyl-1-propanol + 5.2878256
-
ME138886
-
-
-
-
2-Amino-3-methyl-1-butanol
-
ME138375
-
-
-
-
2-Amino-3-methyl-1-butanol + 5.2393837
-
ME139627
-
-
-
-
2-Amino-3-methyl-1-butanol + 5.6115484
-
ME138996
-
-
-
-
2-Amino-3-methyl-1-butanol + 5.725701
-
ME139054
-
-
-
-
2-Amino-3-methyl-1-butanol + 6.3776693
-
ME139164
-
-
-
-
2-Amino-3-methyl-1-butanol + 6.443457
-
ME139183
-
-
-
-
2-Amino-3-methyl-1-butanol + 6.487953
-
ME139205
-
-
-
-
2-amino-4-cyano-butanoic acid
-
ME138276
-
-
-
-
2-amino-4'-hydroxy-Propiophenone
-
ME139252
-
-
-
-
2-Butanone
-
ME138260
-
-
-
-
2E,4E,8Z-eicosatrienoic acid
-
ME138154
-
-
-
-
2H-Indol-2-one, 1,3-dihydro-4-[2-hydroxy-3-[(1-met...
-
ME137961
-
-
-
-
3,3',5-Triiodothyropropionic acid
-
ME139062
-
-
-
-
3,5-Pyridinedicarboxylic acid, 2,6-dimethyl-4-(3-n...
-
ME138384
-
-
-
-
3alpha-HYDROXY-4,4-BISNOR-8,11,13-PODOCARPATRIENE
-
ME138224
-
-
-
-
3-(a-Naphthoxy)lactic acid
-
ME138944
-
-
-
-
3-(a-Naphthoxy)lactic acid glucuronide
-
ME138559
-
-
-
-
3-Hydroxyphenytoin
-
ME139429
-
-
-
-
3-Methylamino-1,2-propandiol
-
ME139141
-
-
-
-
(3S,4R,3'R)-4-Hydroxyalloxanthin
-
ME139564
-
-
-
-
4-Amino-6,7-dimethoxy-2-(1-piperazinyl)quinazoline
-
ME139248
-
-
-
-
4-Aminophenyl 1-thio-beta-D-glucuronide
-
ME138503
-
-
-
-
4-Aminophenyl 1-thio-beta-D-glucuronide + 2.618879...
-
ME138535
-
-
-
-
4-Aminophenyl 1-thio-beta-D-glucuronide + 2.781170...
-
ME138564
-
-
-
-
4-hydroxy-3,5-bis(1-methylethyl)phenyl glucuronide
-
ME139691
-
-
-
-
4-Hydroxylevamisole Glucuronide
-
ME139503
-
-
-
-
4-pentyn-1-ol
-
ME138238
-
-
-
-
(5E,10Z)-19-fluoro-1alpha-hydroxyvitamin-D3 / (5E,...
-
ME137921
-
-
-
-
6'-Hydroxysiphonaxanthin ester/ 6'-Hydroxysiphonax...
-
ME138893
-
-
-
-
8,11,14-nonadecatriynoic acid
-
ME137845
-
-
-
-
8R-hydroxy-9Z-octadecenoic acid
-
ME137940
-
-
-
-
8R-hydroxy-9Z-octadecenoic acid + 1.1166265
-
ME138136
-
-
-
-
Allocortol
-
ME138126
-
-
-
-
Benorilate
-
ME139385
-
-
-
-
Bis (2-hydroxypropyl) amine
-
ME138786
-
-
-
-
Bis (2-hydroxypropyl) amine + 5.2407393
-
ME138872
-
-
-
-
Bis (2-hydroxypropyl) amine + 5.448429
-
ME138932
-
-
-
-
Bis (2-hydroxypropyl) amine + 5.5734115
-
ME138957
-
-
-
-
Bis (2-hydroxypropyl) amine + 5.6669173
-
ME138989
-
-
-
-
B-ureidoisobutyric acid
-
ME139427
-
-
-
-
Calcipotriene
-
ME139300
-
-
-
-
CARYLOPHYLLENE OXIDE
-
ME137981
-
-
-
-
cefamandole nafate
-
ME139663
-
-
-
-
cefamandole nafate + 2.0600944
-
ME139667
-
-
-
-
Chloramphenicol alcohol
-
ME138595
-
-
-
-
desmethylnortriptyline glucuronide
-
ME137808
-
-
-
-
Dihydrocodeine-6-glucuronide
-
ME138212
-
-
-
-
Dinorpromazine
-
ME138605
-
-
-
-
dirithromycin
-
ME139527
-
-
-
-
FENDILINE
-
ME138655
-
-
-
-
GABOXADOL
-
ME139280
-
-
-
-
Gemeprost
-
ME138054
-
-
-
-
Gemeprost + 6.1370444
-
ME139104
-
-
-
-
Glc-GP(18:0/20:4(5Z,8Z,11Z,14Z))
-
ME138707
-
-
-
-
GPEtn(20:2(5Z,8Z)/18:0)[S]
-
ME138844
-
-
-
-
GPEtnNMe(18:1(9Z)/18:1(9Z))[U]
-
ME138842
-
-
-
-
GPEtnNMe(18:1(9Z)/18:1(9Z))[U] + 5.188982
-
ME138870
-
-
-
-
GPEtnNMe(18:1(9Z)/18:1(9Z))[U] + 5.253908
-
ME138953
-
-
-
-
HYDROLYSIS PRODUCT OF BUSSEIN
-
ME138174
-
-
-
-
HYDROLYSIS PRODUCT OF BUSSEIN + 1.4087132
-
ME139587
-
-
-
-
HYDROLYSIS PRODUCT OF BUSSEIN + 1.4680848
-
ME138336
-
-
-
-
HYDROLYSIS PRODUCT OF BUSSEIN + 1.9674853
-
ME138416
-
-
-
-
Hydroxytinidazole glucuronide
-
ME139509
-
-
-
-
Ivermectin B1a
-
ME139588
-
-
-
-
L-4-Hydroxy-3-methoxy-a-methylphenylalanine
-
ME138454
-
-
-
-
L-4-Hydroxy-3-methoxy-a-methylphenylalanine + 2.05...
-
ME139699
-
-
-
-
Lanthionine ketimine
-
ME137803
-
-
-
-
LEVULINIC ACID, 3-BENZYLIDENYL-
-
ME137901
-
-
-
-
L-gamma-Cyano-gamma-aminobutyric acid
-
ME139278
-
-
-
-
L-Glutamic acid dibutyl ester
-
ME139143
-
-
-
-
L-Glutamic acid n-butyl ester
-
ME139272
-
-
-
-
LOMATIN
-
ME138382
-
-
-
-
Lyxosylamine
-
ME139075
-
-
-
-
Metoprolol acid
-
ME138370
-
-
-
-
Mono-N-depropylprobenecid
-
ME139399
-
-
-
-
N-Acetyltranexamic acid
-
ME139129
-
-
-
-
N-Deacetylketoconazole
-
ME139433
-
-
-
-
N-Didesethylquinagolide glucuronide
-
ME139516
-
-
-
-
N-Didesethylquinagolide sulfate
-
ME138667
-
-
-
-
N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine
-
ME139478
-
-
-
-
N-HISTIDYL-2-AMINONAPHTHALENE (betaNA)
-
ME138097
-
-
-
-
N-Methyl-2-pyridone-5-carboxamide (Nudifloramide)
-
ME138399
-
-
-
-
N-Methyl-2-pyridone-5-carboxamide (Nudifloramide) ...
-
ME138403
-
-
-
-
N,N-Didemethylchlorpromazine
-
ME138588
-
-
-
-
N,N-HEXAMETHYLENEAMILORIDE
-
ME138623
-
-
-
-
OLEANANOIC ACID ACETATE
-
ME137864
-
-
-
-
Oxprenolol
-
ME139360
-
-
-
-
Pinacidil-N-Oxide
-
ME139281
-
-
-
-
Podophyllotoxin (Podophyllum)
-
ME139387
-
-
-
-
Poloxalene
-
ME138286
-
-
-
-
Propanoic acid, 2-hydroxy-3-[2-(2-propenyloxy)phen...
-
ME138338
-
-
-
-
Propionylglycine methyl ester
-
ME138456
-
-
-
-
Ritodrine glucuronide
-
ME138250
-
-
-
-
Ritodrine glucuronide 2
-
ME138821
-
-
-
-
Tetrahydrothiophene sulfoxide
-
ME138619
-
-
-
-
Ubiquinone
-
ME138143
-
-
-
-
Ubiquinone + 1.6377995
-
ME139381
-
-
-
-
URSINIC ACID
-
ME138943
-
-
-
-
VALERYL SALYCILATE
-
ME139340
-
-
-
-
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
11-deoxy-11-methylene-15-keto-PGD2
11-Deoxy-11-methylene-15-keto-PGD2
ME140038
-
-
1.1066309
-
PYROGALLIN
1,2,3-Trihydroxybenzene
ME140237
-
-
1.9216946
-
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic Acid
12beta-Hydroxy-3-oxo-5beta-cholan-24-oic acid
ME139995
-
-
1.0898025
-
1,3-Dimethyluric acid
1,3-Dimethyluric acid
ME140232
-
-
1.8525208
-
1,3-Dimethyluric acid - 1.9407203
1,3-Dimethyluric acid
ME140242
-
-
1.9407203
-
13E,17-octadecadienoic acid
13E,17-Octadecadienoic acid
ME139890
-
-
1.0408382
-
(+/-)-13-HDoHE
13-HDoHE
ME140073
-
-
1.1265143
-
16-hydroperoxy-9Z,12,14E-octadecatrienoic acid
16-HpOTrE
ME140033
-
-
1.1063778
-
1-Methylguanosine
1-Methylguanosine
ME140267
-
-
1.969839
-
1-Methylinosine
1-Methylinosine
ME140318
-
-
2.255001
-
1-Methyluric acid
1-Methyluric acid
ME140319
-
-
2.2793014
-
1-Methyluric acid - 2.6832187
1-Methyluric acid
ME140341
-
-
2.6832187
-
2,2-Dimethylsuccinic acid
2,2-Dimethylsuccinic acid
ME140180
-
-
1.4739592
-
2,4-DICHLOROPHENOXYACETIC ACID
2,4-Dichlorophenoxyacetic acid
ME139716
-
-
0.6518314
-
2,4-DICHLOROPHENOXYACETIC ACID - 0.93742573
2,4-Dichlorophenoxyacetic acid
ME140673
-
-
0.93742573
-
2,4-DINITROPHENOL
2,4-Dinitrophenol
ME139847
-
-
0.9808641
-
(24R)-1alpha,24,25-trihydroxyvitamin D2 / (24R)-1a...
(24R)-1alpha,24,25-Trihydroxyvitamin D2
ME139956
-
-
1.0698428
-
25-Hydroxy[26,27-methyl]vitamin D3 3beta-(1,2-epox...
25-Hydroxy[26,27-methyl]vitamin D3 3beta-(1,2-epoxypropyl)ether
ME139970
-
-
1.0784656
-
a-hydroxyisovalerate
2-Hydroxy-3-methylbutyric acid
ME140158
-
-
1.3197827
-
a-hydroxyisovalerate - 1.5014749
2-Hydroxy-3-methylbutyric acid
ME140187
-
-
1.5014749
-
2-Hydroxyethanesulfonate
2-Hydroxyethanesulfonate
ME140323
-
-
2.2981968
-
2-Hydroxyethinylestradiol
2-Hydroxyethinylestradiol
ME139834
-
-
0.9556034
-
2-Hydroxyethinylestradiol - 1.9711667
2-Hydroxyethinylestradiol
ME140269
-
-
1.9711667
-
2-Hydroxyfelbamate
2-Hydroxyfelbamate
ME139773
-
-
0.8071837
-
alpha-hydroxyisobutyrate
2-Hydroxyisobutyric acid
ME140174
-
-
1.3954662
-
alpha-hydroxyisobutyrate - 1.5336198
2-Hydroxyisobutyric acid
ME140199
-
-
1.5336198
-
alpha-hydroxyisobutyrate - 5.106458
2-Hydroxyisobutyric acid
ME140661
-
-
5.106458
-
2-Methoxyestrone 3-glucuronide
2-Methoxyestrone 3-glucuronide
ME140145
-
-
1.1994473
-
2-Methyl-3-ketovaleric acid
2-Methyl-3-ketovaleric acid
ME140322
-
-
2.380169
-
2-methyl-tridecanedioic acid
2-Methyl-tridecanedioic acid
ME140064
-
-
1.1205089
-
2-Naphthaleneacetic acid, 6-hydroxy-
2-Octenoic acid
ME140564
-
-
0.8081368
-
2-Oxo-3-hydroxy-4-phosphobutanoate
2-Oxo-3-hydroxy-4-phosphobutanoic acid
ME139799
-
-
0.88811946
-
2-oxo capric acid
2-Oxo capric acid
ME140062
-
-
1.142973
-
2-Propylglutaric acid
2-Propylglutaric acid
ME140151
-
-
1.2877134
-
2-propyl-tridecanoic acid
2-Propyl-tridecanoic acid
ME139895
-
-
1.0415518
-
2,3-Dihydroxybenzoic acid
2-Pyrocatechuic acid
ME139823
-
-
0.9199644
-
3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9...
3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione
ME140241
-
-
1.9586757
-
,4-Dimethoxyphenethylamine
3,4-Dimethoxyphenylethylamine
ME140091
-
-
1.1427581
-
3,6,8-dodecatrien-1-ol
3,6,8-Dodecatrien-1-ol
ME140614
-
-
1.1366317
-
3,9,15-Docosatriynoic acid
3,9,15-Docosatriynoic acid
ME139892
-
-
1.0415773
-
3alpha,6alpha,7alpha,12alpha-Tetrahydroxy-5beta-ch...
3alpha,6alpha,7alpha,12alpha-Tetrahydroxy-5beta-cholest-24-en-26-oic acid
ME140360
-
-
2.8502896
-
3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-c...
3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-cholest-23-en-26-oic acid
ME139986
-
-
1.0717597
-
3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-c...
3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-cholest-23-en-26-oic acid
ME140111
-
-
1.1177537
-
3beta,6alpha,7beta-Trihydroxy-5beta-cholan-24-oic ...
3beta,6alpha,7beta-Trihydroxy-5beta-cholan-24-oic acid
ME140021
-
-
1.102059
-
3beta,7beta-Dihydroxy-12-oxo-5beta-cholan-24-oic A...
3beta,7beta-Dihydroxy-12-oxo-5beta-cholan-24-oic acid
ME140056
-
-
1.1135335
-
3beta,7beta-Dihydroxy-5beta-cholestan-26-oic acid
3beta,7beta-Dihydroxy-5beta-cholestan-26-oic acid
ME139925
-
-
1.0573045
-
3-Dehydroquinic acid
3-Dehydroquinate
ME140376
-
-
3.3175597
-
3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid
3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid
ME140351
-
-
2.8625486
-
3-DESMETHYL-5-DESHYDROXYSCLEROIN
3-Desmethyl-5-deshydroxyscleroin
ME140566
-
-
0.8328858
-
3E,5E-tridecadienoic acid
3E,5E-Tridecadienoic acid
ME140071
-
-
1.1276501
-
3E-undecenoic acid
3E-Undecenoic acid
ME140088
-
-
1.1442921
-
m-Salicylic acid
3-Hydroxybenzoic acid
ME139850
-
-
0.9760224
-
DL-3-hydroxy caproic acid
3-Hydroxycaproic acid
ME140159
-
-
1.3305575
-
3-Hydroxysuberic acid
3-Hydroxysuberic acid
ME140315
-
-
2.165642
-
3-Indolepropionic acid
3-Indolepropionic acid
ME140048
-
-
1.1133118
-
3-keto palmitic acid
3-Ketopalmitic acid
ME139971
-
-
1.082288
-
3-Methylindole
3-Methylindole
ME140076
-
-
1.1423597
-
3-Methylxanthine
3-Methylxanthine
ME140203
-
-
1.5744089
-
4,7,10,13,16-docosapentaenoic acid
4,7,10,13,16-Docosapentaenoic acid
ME139879
-
-
1.0359886
-
4,8-dimethyl-dodecanoic acid
4,8-Dimethyl-dodecanoic acid
ME140599
-
-
1.0540603
-
4-dodecynoic acid
4-Dodecynoic acid
ME139973
-
-
1.0759698
-
4-Hydroxybenzyl cyanide
4-Hydroxybenzeneacetonitrile
ME139766
-
-
0.7924188
-
4-hydroxy lauric acid
4-Hydroxylauric acid
ME140090
-
-
1.1435484
-
4-hydroxy pelargonic acid
4-Hydroxypelargonic acid
ME140117
-
-
1.1650017
-
4Z,7Z,10Z,13Z-eicosatetraenoic acid
4Z,7Z,10Z,13Z-Eicosatetraenoic acid
ME139888
-
-
1.0386413
-
5,11-Eicosadienoic acid
5,11-Eicosadienoic acid
ME140583
-
-
1.0350163
-
(+/-)5,6-DiHETrE
5,6-DiHETrE
ME140015
-
-
1.0998138
-
5,6-Dihydrouridine
5,6-Dihydrouridine
ME140227
-
-
1.7604738
-
5-Acetyl-4-methylthiazole
5-Acetyl-4-methylthiazole
ME140183
-
-
1.4993798
-
5a-Tetrahydrocorticosterone
5alpha-Tetrahydrocorticosterone
ME140013
-
-
1.0992585
-
5beta-Androstan-3alpha-ol-17-one sulfate
5beta-Androstan-3alpha-ol-17-one sulfate
ME139806
-
-
0.8973279
-
5-methyl-2E-tridecenoic acid
5-Methyl-2E-tridecenoic acid
ME140602
-
-
1.0580504
-
6alpha-Hydroxycastasterone
6alpha-Hydroxycastasterone
ME139955
-
-
1.0700508
-
6-Hydroxynicotinic acid
6-Hydroxynicotinic acid
ME139946
-
-
1.0644873
-
6-Methoxy-2-naphthylacetic acid
6-Methoxy-2-naphthylaceticacid
ME140175
-
-
1.3948398
-
6-Methoxy-2-naphthylacetic acid - 1.5383995
6-Methoxy-2-naphthylaceticacid
ME140200
-
-
1.5383995
-
5-octadecylenic acid
6-Octadecylenic acid
ME139886
-
-
1.0368551
-
7-Dehydrologanin tetraacetate
7-Dehydrologanin tetraacetate
ME140570
-
-
0.8552172
-
7-Ethoxycoumarin
7-Ethoxycoumarin
ME140642
-
-
2.0200706
-
7-Hydroxymethotrexate
7-Hydroxymethotrexate
ME140248
-
-
1.9490175
-
7-Hydroxyoctanoic acid
7-Hydroxyoctanoic acid
ME140119
-
-
1.1756889
-
7-palmitoleic acid
7-Palmitoleic acid
ME139907
-
-
1.0458771
-
8,13-dihydroxy-9,11-octadecadienoic acid
8,13-DiHODE
ME140014
-
-
1.1000245
-
9,12,14-octadecatrienoic acid
9,12,14-Octadecatrienoic acid
ME139908
-
-
1.0452757
-
9,13-dihydroxy-11-octadecenoic acid
9,13-DiHOME(11)
ME140006
-
-
1.0940467
-
9-lauroleic acid
9-Dodecenoic acid
ME139976
-
-
1.0810757
-
ABSCISIC ACID (cis,trans)
Abscisic acid
ME140045
-
-
1.1120745
-
Acenocoumarol
Acenocoumarol
ME139742
-
-
0.7453638
-
Acetoacetic acid
Acetoacetic acid
ME140003
-
-
1.083087
-
Acetoacetic acid - 2.6111403
Acetoacetic acid
ME140332
-
-
2.6111403
-
Acetoacetic acid - 2.7794967
Acetoacetic acid
ME140340
-
-
2.7794967
-
Acetoin
Acetoin
ME140157
-
-
1.31947
-
Acipimox
Acipimox
ME140313
-
-
2.1570835
-
Acrylic acid
Acrylic acid
ME140335
-
-
2.688724
-
Allantoin
Allantoin
ME140225
-
-
1.7481529
-
Allantoin - 1.9150978
Allantoin
ME140259
-
-
1.9150978
-
Allantoin - 2.0730007
Allantoin
ME140308
-
-
2.0730007
-
Allysine
Allysine
ME140294
-
-
2.0350397
-
Anhydrorhodovibrin
Anhydrorhodovibrin
ME139963
-
-
1.0722339
-
Arbekacin
Arbekacin
ME140591
-
-
1.0458964
-
Arg Met Thr
Arg-Met-Thr
ME140619
-
-
1.1827407
-
Arg Phe Arg
Arg-Phe-Arg
ME140429
-
-
5.3455305
-
Asn Thr Phe
Asn-Thr-Phe
ME140593
-
-
1.0438757
-
Asp Gly Gly
Asp-Gly-Gly
ME139827
-
-
0.9432561
-
Benazeprilat
Benazeprilat
ME140129
-
-
1.1856011
-
Benzene
Benzene
ME140370
-
-
3.0336587
-
Benzoic acid
Benzoic acid
ME139859
-
-
1.0264018
-
Benzoic acid - 1.0895942
Benzoic acid
ME139997
-
-
1.0895942
-
Benzyl alcohol
Benzyl alcohol
ME139753
-
-
0.76441646
-
Benzyl alcohol - 1.1619599
Benzyl alcohol
ME140112
-
-
1.1619599
-
beta-Alanine
beta-Alanine
ME140545
-
-
6.8590274
-
3-Amino-3-(4-hydroxyphenyl)propanoate
beta-Tyrosine
ME140502
-
-
5.8024077
-
bicyclo-PGE2
Bicyclo-PGE2
ME140123
-
-
1.1298813
-
Bilirubin
Bilirubin
ME139931
-
-
1.0526514
-
Biliverdin IX
Biliverdin
ME140128
-
-
1.1910514
-
Biliverdin IX - 1.3259428
Biliverdin
ME140153
-
-
1.3259428
-
BUFEXAMAC
Bufexamac
ME140643
-
-
2.2581103
-
n-Hexanoic Acid
Caproic acid
ME140143
-
-
1.1958305
-
Castasterone
Castasterone
ME140680
-
-
1.1069212
-
Pyrocatechol sulfate
Catechol sulfate
ME139728
-
-
0.71349394
-
Chenodeoxycholic acid sulfate
Chenodeoxycholic acid sulfate
ME139862
-
-
1.015848
-
Cholesterol sulfate
Cholesterol sulfate
ME139775
-
-
0.81566954
-
Cilastatin
Cilastatin
ME140480
-
-
5.6328225
-
Creatinine
Creatinine
ME140392
-
-
3.9833267
-
Cystine
Cystine
ME140720
-
-
5.1538153
-
Cys Tyr Met
Cys-Tyr-Met
ME140576
-
-
0.93840325
-
Desmosine
Desmosine
ME140430
-
-
5.3001194
-
Diacetyl
Diacetyl
ME139856
-
-
1.007082
-
Diacetyl - 1.6697811
Diacetyl
ME140223
-
-
1.6697811
-
Dihydroxyacetone (glycerone)
Dihydroxyacetone
ME140475
-
-
5.485711
-
Dihydroxyacetone (glycerone) - 2.5921504
Dihydroxyacetone
ME140696
-
-
2.5921504
-
dihydroxyacetone phosphate (DHAP)
Dihydroxyacetone phosphate
ME139801
-
-
0.88888854
-
Docosanedioic acid
Docosanedioic acid
ME139944
-
-
1.0686239
-
Dodecaprenyl phosphate-galacturonic acid
Dodecaprenyl phosphate-galacturonic acid
ME140709
-
-
1.0679086
-
D-Urobilinogen
D-Urobilinogen
ME140612
-
-
1.0850482
-
Ecgonine
Ecgonine
ME140542
-
-
6.5143647
-
Eicosanedioic acid
Eicosanedioic acid
ME139972
-
-
1.0820543
-
Embelin
Embelin
ME139713
-
-
0.6474809
-
Embelin - 0.8075919
Embelin
ME139776
-
-
0.8075919
-
Embelin - 1.0076177
Embelin
ME139857
-
-
1.0076177
-
Embelin - 1.105527
Embelin
ME140029
-
-
1.105527
-
Embelin - 1.2979721
Embelin
ME140621
-
-
1.2979721
-
Embelin - 1.9461942
Embelin
ME140243
-
-
1.9461942
-
Embelin - 1.9698637
Embelin
ME140276
-
-
1.9698637
-
Embelin - 5.0215707
Embelin
ME140414
-
-
5.0215707
-
Ethacrynic acid
Ethacrynic acid
ME140466
-
-
5.454551
-
Fenoprofen
Fenoprofen
ME140550
-
-
0.7209766
-
Fexofenadine
Fexofenadine
ME140432
-
-
5.319173
-
fludrocortisone
Fludrocortisone
ME139805
-
-
0.8892744
-
Fluorescein
Fluorescein
ME140144
-
-
1.1986483
-
Fumaric acid
Fumaric acid
ME139852
-
-
0.99849445
-
Gemfibrozil
Gemfibrozil
ME140011
-
-
1.1106489
-
Gentisic acid
Gentisic acid
ME139864
-
-
1.0239431
-
Glucoheptonic acid
Glucoheptonic acid
ME140215
-
-
1.6262119
-
D-Glucose
Glucose
ME140334
-
-
2.5917861
-
D-Glucose - 2.7780893
Glucose
ME140346
-
-
2.7780893
-
Glu Glu Arg
Glu-Glu-Arg
ME140068
-
-
1.1250521
-
Glutaconic acid
Glutaconic acid
ME139855
-
-
1.0055801
-
Glutaral (Glutaraldehyde)
Glutaral
ME140177
-
-
1.4589323
-
Glutaral (Glutaraldehyde) - 1.5350673
Glutaral
ME140198
-
-
1.5350673
-
glyceraldehyde
Glyceraldehyde
ME140546
-
-
6.669476
-
Glycolaldehyde
Glycolaldehyde
ME140629
-
-
1.5325236
-
Glycolaldehyde - 2.7607846
Glycolaldehyde
ME140697
-
-
2.7607846
-
Glycoursodeoxycholic acid
Glycoursodeoxycholic acid
ME140410
-
-
4.6801243
-
Glycoursodeoxycholic acid - 4.796306
Glycoursodeoxycholic acid
ME140411
-
-
4.796306
-
Glyoxylic acid
Glyoxylic acid
ME140698
-
-
4.658795
-
griseorhodin A
Griseorhodin A
ME140650
-
-
2.7929454
-
Guaiacol
Guaiacol
ME139727
-
-
0.7171119
-
Hexadecanedioic acid
Hexadecanedioic acid
ME140030
-
-
1.1046736
-
Hippuric acid
Hippuric acid
ME140369
-
-
3.0313997
-
Hydantoin-5-propionic acid
Hydantoin-5-propionic acid
ME140238
-
-
1.9154087
-
Hydrocortisone caproate
Hydrocortisone caproate
ME140690
-
-
1.1929646
-
Hypoxanthine
Hypoxanthine
ME140331
-
-
2.5793762
-
3-(Imidazol-4-yl)-2-oxopropyl phosphate
Imidazole acetol-phosphate
ME140275
-
-
1.9674133
-
Imidazolone
Imidazolone
ME139717
-
-
0.65606064
-
Imidazolone - 0.95026875
Imidazolone
ME139842
-
-
0.95026875
-
Imidazolone - 1.1720481
Imidazolone
ME140120
-
-
1.1720481
-
Imidazolone - 2.03967
Imidazolone
ME140305
-
-
2.03967
-
3-Indoleacetic Acid
Indoleacetic acid
ME140687
-
-
1.1449207
-
Indoxylsulfuric acid
Indoxyl sulfate
ME139764
-
-
0.79179853
-
Isoacitretin
Isoacitretin
ME139830
-
-
0.9435931
-
Isoacitretin - 1.9718536
Isoacitretin
ME140268
-
-
1.9718536
-
Isoacitretin - 2.8220913
Isoacitretin
ME140361
-
-
2.8220913
-
ISOEUGENITOL
Isoeugenitol
ME140649
-
-
2.78455
-
isoflurophate
Isoflurophate
ME140226
-
-
1.7370381
-
2-oxoisocaproic acid
Ketoleucine
ME140317
-
-
2.2028594
-
Ketoleucine
Ketoleucine
ME140391
-
-
3.9798589
-
KOBUSONE
Kobusone
ME139906
-
-
1.0506043
-
D-Phenyllactic acid
L-3-Phenyllactic acid
ME140092
-
-
1.1437984
-
Lactaldehyde
Lactaldehyde
ME140173
-
-
1.3948408
-
Lactaldehyde - 1.8436897
Lactaldehyde
ME140236
-
-
1.8436897
-
Lactaldehyde - 1.9245304
Lactaldehyde
ME140637
-
-
1.9245304
-
Lactic acid
Lactic acid
ME140648
-
-
2.7752757
-
Lecanoric acid
Lecanoric acid
ME140324
-
-
2.429789
-
Leucine
Leucine
ME140495
-
-
5.729006
-
Limonene-1,2-epoxide
Limonene-1,2-epoxide
ME140616
-
-
1.1469882
-
Sulfolithocholic acid
Lithocholic acid sulfate
ME139807
-
-
0.9001632
-
Lorazepam
Lorazepam
ME140325
-
-
2.502062
-
Lorazepam - 2.8117664
Lorazepam
ME140349
-
-
2.8117664
-
GPEtn(18:0/0:0)
LPE 18:0/0:0
ME140535
-
-
6.441452
-
Ribulose
L-Ribulose
ME140383
-
-
3.610877
-
Lys Cys His
Lys-Cys-His
ME139835
-
-
0.9772623
-
Lys Cys His - 1.0133727
Lys-Cys-His
ME139876
-
-
1.0133727
-
Mesalamine
Mesalazine
ME139932
-
-
1.0596817
-
Methionine
Methionine
ME140507
-
-
5.878307
-
Met His Lys
Met-His-Lys
ME139844
-
-
0.97052854
-
Methyl jasmonate
Methyl jasmonate
ME140081
-
-
1.1365737
-
Phthalic acid Mono-2-ethylhexyl Ester
Monoethylhexyl phthalic acid
ME140077
-
-
1.1274997
-
Murocholic acid
Murideoxycholic acid
ME139958
-
-
1.0708891
-
Murocholic acid - 1.1891849
Murideoxycholic acid
ME140137
-
-
1.1891849
-
Murocholic acid - 1.323932
Murideoxycholic acid
ME140160
-
-
1.323932
-
N-Acetylarylamine
N-Acetylarylamine
ME140368
-
-
3.0335941
-
N-Acetylgalactosamine 4-sulphate
N-Acetylglucosamine
ME140150
-
-
1.2783242
-
Naproxen
Naproxen
ME140558
-
-
0.7722246
-
N-formylmethionine
N-Formylmethionine
ME140387
-
-
3.571371
-
O-Desmethylnaproxen
O-Desmethylnaproxen
ME139762
-
-
0.7891679
-
OSTHOL
Osthole
ME139748
-
-
0.7559433
-
OXOLINIC ACID
Oxolinicacid
ME140506
-
-
5.877554
-
Paraxanthine
Paraxanthine
ME140154
-
-
1.3169199
-
GPEtn(16:0/18:2(9Z,12Z))
PE 16:0/18:2(9Z,12Z)
ME140422
-
-
5.139908
-
GPEtn(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PE 16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME140398
-
-
4.37748
-
GPEtn(16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) - 4.432953...
PE 16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)*
ME140403
-
-
4.4329534
-
GPEtn(18:0/20:4(5Z,8Z,11Z,14Z))[U]
PE 18:0/20:4(5Z,8Z,11Z,14Z)
ME140397
-
-
4.361787
-
GPEtn(18:0/20:4(5Z,8Z,11Z,14Z))[U] - 4.411743
PE 18:0/20:4(5Z,8Z,11Z,14Z)*
ME140402
-
-
4.411743
-
GPEtn(18:0/20:4(5Z,8Z,11Z,14Z))[U] - 5.0317707
PE 18:0/20:4(5Z,8Z,11Z,14Z)*
ME140416
-
-
5.0317707
-
GPEtn(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PE 18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME140417
-
-
4.999873
-
GPEtnNMe(16:0/18:1(9Z))
PE-NMe 16:0/18:1(9Z)
ME140423
-
-
5.135334
-
GPEtn(O-16:0/22:5(4Z,7Z,10Z,13Z,16Z))
PE O-16:0/22:5(4Z,7Z,10Z,13Z,16Z)
ME140399
-
-
4.3383937
-
GPEtn(O-16:0/22:5(4Z,7Z,10Z,13Z,16Z)) - 4.972112
PE O-16:0/22:5(4Z,7Z,10Z,13Z,16Z)
ME140412
-
-
4.972112
-
PEUCEDANIN
Peucedanin
ME140565
-
-
0.81379384
-
GPGro(17:0/20:4(5Z,8Z,11Z,14Z))
PG 17:0/20:4(5Z,8Z,11Z,14Z)
ME140420
-
-
5.0991473
-
PGB3
PGB3
ME139904
-
-
1.1497705
-
Phenol
Phenol
ME139751
-
-
0.7595993
-
Phenylalanine
Phenylalanine
ME140482
-
-
5.638607
-
Phenyl sulfate
Phenyl hydrogen sulfate
ME139752
-
-
0.7613782
-
Ethanolamine phosphate (Phosphoethanolamine)
Phosphoethanolamine
ME140263
-
-
1.9664164
-
Pregnenolone sulfate
Pregnenolone sulfate
ME139784
-
-
0.8499369
-
Procarbazine
Procarbazine
ME140023
-
-
1.0835094
-
Procarbazine - 1.0658925
Procarbazine
ME140582
-
-
1.0658925
-
Proline
Proline
ME140513
-
-
6.250035
-
GPSer(18:0/20:4(5Z,8Z,11Z,14Z))
PS 18:0/20:4(5Z,8Z,11Z,14Z)
ME140419
-
-
5.10199
-
GPSer(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PS 18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME140415
-
-
5.031182
-
Pseudouridine
Pseudouridine
ME140314
-
-
2.1573422
-
Pteridine
Pteridine
ME140220
-
-
1.6441826
-
Purine
Purine
ME139715
-
-
0.64599144
-
Purine - 0.85180575
Purine
ME139782
-
-
0.85180575
-
Purine - 0.9651424
Purine
ME139837
-
-
0.9651424
-
Purine - 1.9555072
Purine
ME140274
-
-
1.9555072
-
Pyrocatechol
Pyrocatechol
ME139732
-
-
0.71577495
-
Pyrocatechol - 0.9365421
Pyrocatechol
ME139831
-
-
0.9365421
-
Pyrocatechol - 1.0253521
Pyrocatechol
ME140579
-
-
1.0253521
-
Pyroglutamic acid
Pyroglutamic acid
ME140499
-
-
5.763102
-
Pyrrole-2-carboxylic acid
Pyrrole-2-carboxylic acid
ME140214
-
-
1.6228802
-
Methylglyoxal
Pyruvaldehyde
ME139853
-
-
1.0001063
-
Pyruvic acid
Pyruvic acid
ME140379
-
-
3.4656305
-
Quinaldic acid
Quinaldic acid
ME140085
-
-
1.1376376
-
3,4,5-Trihydroxystilbene
Resveratrol
ME139736
-
-
0.73002815
-
Rhodovibrin
Rhodovibrin
ME140069
-
-
1.1288389
-
Saccharin
Saccharin
ME140721
-
-
0.95127445
-
Ser Asp Gly
Ser-Asp-Gly
ME140487
-
-
5.6421533
-
Ser Phe Lys
Ser-Phe-Lys
ME140568
-
-
0.85098267
-
Stearic acid
Stearic acid
ME139874
-
-
1.0339742
-
Succinic acid
Succinic acid
ME140235
-
-
1.8438562
-
Succinic anhydride
Succinic anhydride
ME140233
-
-
1.8462903
-
Sulfate
Sulfate
ME139828
-
-
0.86388755
-
Sulfate - 0.96911985
Sulfate
ME139945
-
-
0.96911985
-
Sulfisoxazole
Sulfisoxazole
ME140497
-
-
5.7364345
-
Sulfolithocholylglycine
Sulfoglycolithocholic acid
ME140356
-
-
2.883989
-
Taurine
Taurine
ME140425
-
-
5.170413
-
Teasterone
Teasterone
ME139920
-
-
1.051482
-
TENIPOSIDE
Teniposide
ME140685
-
-
1.1241754
-
Testosterone sulfate
Testosterone sulfate
ME139735
-
-
0.72462183
-
Testosterone sulfate - 0.86699945
Testosterone sulfate
ME139794
-
-
0.86699945
-
Tetracosanedioic acid
Tetracosanedioic acid
ME140594
-
-
1.0492009
-
Theobromine
Theobromine
ME140178
-
-
1.4483591
-
Threonate
Threonic acid
ME140350
-
-
2.8534584
-
Thr Ile Gln
Thr-Ile-Gln
ME140124
-
-
1.1556512
-
Traumatic acid
Traumatic acid
ME140098
-
-
1.143463
-
Tricosanedioic acid
Tricosanedioic acid
ME139922
-
-
1.0509782
-
Trihydroxycoprostanoic acid
Trihydroxycoprostanoic acid
ME139959
-
-
1.0702078
-
Triparanol
Triparanol
ME140019
-
-
1.1065028
-
Trp Gln Gln
Trp-Gln-Gln
ME140046
-
-
1.1103233
-
Tryptophan
Tryptophan
ME140471
-
-
5.528442
-
Tuberonic acid
Tuberonic acid
ME140106
-
-
1.1534125
-
Tyr Leu Arg
Tyr-Leu-Arg
ME140389
-
-
3.8415985
-
Uracil
Uracil
ME140219
-
-
1.6220974
-
Uric acid
Uric acid
ME140381
-
-
3.4419954
-
Uridine
Uridine
ME140209
-
-
1.6219187
-
Valine
Valine
ME140510
-
-
6.045695
-
Xanthine
Xanthine
ME140231
-
-
1.8483262
-
Xanthine - 1.9284873
Xanthine
ME140239
-
-
1.9284873
-
11-hydroperoxy-12,13-epoxy-9-octadecenoic acid
-
ME140103
-
-
1.1511214
-
1,2,4-Triazole-3-carboxamide
-
ME140184
-
-
1.4973084
-
1-(3-Carboxypropyl)-3,7-dimethylxanthine
-
ME140636
-
-
1.797599
-
1,3-di-(11Z,14Z-eicosadienoyl)-2-(6Z,9Z,12Z-octade...
-
ME140451
-
-
5.4010916
-
13S-hydroxy-9E,11Z-octadecadienoic acid
-
ME139968
-
-
1.0768985
-
17a-Ethynylestradiol 4-glucuronide
-
ME139787
-
-
0.85248953
-
19-hydroxy-17-oxoandrost-5-en-3-beta-yl sulfate
-
ME139815
-
-
0.92224216
-
1alpha,25-Dihydroxy-2-[3'-(methoxymethoxy)propylid...
-
ME140044
-
-
1.1097512
-
1alpha,25-dihydroxy-24-oxovitamin D_3 / 1alpha,25-...
-
ME140101
-
-
1.1505421
-
1alpha,25-dihydroxy-26,27-dimethyl-22-oxavitamin D...
-
ME139935
-
-
1.0597173
-
1alpha,25-dihydroxy-2beta-(5-hydroxypentoxy)vitami...
-
ME140024
-
-
1.089391
-
1alpha,25-dihydroxy-2beta-butoxyvitamin D3 / 1alph...
-
ME139980
-
-
1.086736
-
1alpha,2beta,25-trihydroxy-19-norvitamin D3 / 1alp...
-
ME139933
-
-
1.0588114
-
1alpha-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-ben...
-
ME140074
-
-
1.1274693
-
1-Fluoro-25-hydroxy-16-ene-23-yne-26,27-hexadeuter...
-
ME140037
-
-
1.1056118
-
1-heneicosanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahex...
-
ME140413
-
-
4.97241
-
1H-Imidazole-4-carboxamide, 5-[3-(hydroxymethyl)-3...
-
ME140148
-
-
1.2768117
-
1-Hydroxyvitamin D3 diacetate
-
ME140060
-
-
1.1127288
-
1-O-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-doco...
-
ME140394
-
-
4.3118987
-
1-O-(1Z-hexadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-doco...
-
ME140400
-
-
4.375872
-
(20S)-1alpha,20,25-trihydroxyvitamin D_3 / (20S)-1...
-
ME139934
-
-
1.0598555
-
(22E,24E)-1alpha,25-dihydroxy-22,23,24,24a-tetrade...
-
ME140078
-
-
1.0917845
-
(22R)-1alpha,22,25-trihydroxy-23,24-tetradehydro-2...
-
ME139867
-
-
1.0326495
-
23-methyl-5Z,9Z-tetracosadienoic acid
-
ME139921
-
-
1.0513964
-
2,3-Naphthalenedicarboxylic acid
-
ME140333
-
-
2.5892563
-
2,3-Naphthalenedicarboxylic acid - 2.702536
-
ME140343
-
-
2.702536
-
2,3-Naphthalenedicarboxylic acid - 2.7786124
-
ME140347
-
-
2.7786124
-
24,24-difluoro-1alpha,25-dihydroxy-26,27-dimethyl-...
-
ME140105
-
-
1.1405823
-
2,4-DICHLOROPHENOXYBUTYRIC ACID, METHYL ESTER
-
ME139765
-
-
0.8901311
-
2,4-DICHLOROPHENOXYBUTYRIC ACID, METHYL ESTER - 1....
-
ME140080
-
-
1.1258451
-
(24S)-1alpha,24,25-trihydroxy-22-oxavitamin D3 / (...
-
ME140052
-
-
1.11575
-
26,27-diethyl-1alpha,25-dihydroxy-20,21-methano-23...
-
ME139998
-
-
1.0911984
-
2-(Fluoromethoxy)-1,1,3,3,3-pentafluoro-1-propene ...
-
ME140426
-
-
5.254733
-
2-(Fluoromethoxy)-1,1,3,3,3-pentafluoro-1-propene ...
-
ME140488
-
-
5.56906
-
2-Heptenedioic acid, 4-oxo-
-
ME140633
-
-
1.5366391
-
2-Hydroxy-3-(4-methoxyethylphenoxy)-propanoic acid
-
ME140149
-
-
1.2184952
-
2-Hydroxy-3-(4-methoxyethylphenoxy)-propanoic acid...
-
ME140617
-
-
1.1841643
-
3,3-Dimethylglutarate
-
ME140624
-
-
1.3834422
-
3,7,12-Trioxochol-5-en-24-oic Acid
-
ME139813
-
-
0.93587273
-
3,7-EPOXYCARYOPHYLLAN-6-ONE
-
ME140034
-
-
1.0985756
-
3-Deoxy-3-azido-25-hydroxyvitamin D3
-
ME139941
-
-
1.0617051
-
3-Hydroxy-2-methyl-[R-(R,S)]-butanoic acid
-
ME140705
-
-
4.9459333
-
3-NOR-3-OXOPANASINSAN-6-OL
-
ME140027
-
-
1.1008831
-
4-(2-Hydroxy-3-isopropylaminoproxy)-benzyloxy acet...
-
ME140040
-
-
1.1091374
-
4-(2-hydroxypropoxy)-3,5-dimethyl-Phenol
-
ME140618
-
-
1.1818466
-
4-AMINOETHYLBENZENESULFONYL FLUORIDE
-
ME140270
-
-
1.9633558
-
4'-Apo-3,4-didehydrolycopene/ (4-Apo-3',4'-didehyd...
-
ME140087
-
-
1.1279049
-
5-[2-(hydroxymethyl)-5-methylphenoxy]-2,2-dimethyl...
-
ME140116
-
-
1.1300397
-
5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethyl-Pen...
-
ME140260
-
-
1.9671462
-
5,9-tetracosadienoic acid
-
ME139905
-
-
1.0463288
-
5beta-Cholane-3alpha,24-diol
-
ME139924
-
-
1.0545899
-
5beta;-CHOLANIC ACID-3alpha;, 12alpha;-DIOL N-(2-S...
-
ME140655
-
-
3.0500865
-
5beta;-CHOLANIC ACID-3alpha;, 12alpha;-DIOL N-(2-S...
-
ME140657
-
-
3.1736035
-
(5E,10E)-19-(3-carboxylpropyl)vitamin D3 / (5E,10E...
-
ME140004
-
-
1.0710083
-
5'-Hydroxysulfapyridine glucuronide
-
ME140678
-
-
1.0767686
-
6alpha-METHYLPREDNISOLONE ACETATE
-
ME140578
-
-
1.0240637
-
6-Methylthioguanine
-
ME139870
-
-
1.02634
-
(6S)-1alpha,25-dihydroxyvitamin D3 6,19-sulfur dio...
-
ME139777
-
-
0.8264969
-
7-Hydroxyfluphenazine glucuronide
-
ME140575
-
-
0.9356952
-
7-hydroxy Tetranor Iloprost
-
ME139951
-
-
1.0655414
-
ANGOLENSIC ACID, METHYL ESTER
-
ME139846
-
-
0.976117
-
ANGOLENSIN (R)
-
ME139771
-
-
0.8031628
-
Bifemelane (M4)
-
ME139758
-
-
0.7816851
-
Bumetanide M1
-
ME140122
-
-
1.1737663
-
B-ureidoisobutyric acid
-
ME140548
-
-
6.90165
-
D1-2-Hydroxymethylethisterone
-
ME139819
-
-
0.93322694
-
D1-2-Hydroxymethylethisterone - 1.9729741
-
ME140261
-
-
1.9729741
-
Dehydronifedipine
-
ME140218
-
-
1.6309508
-
Demethylclomipramine
-
ME140556
-
-
0.76193076
-
Demethylmethoxsalen
-
ME139745
-
-
0.75294673
-
deschlorobenzoyl Indomethacin
-
ME140656
-
-
3.1186907
-
Dibenzo[b,e]thiepin, 1-propanamine deriv
-
ME140541
-
-
6.5142407
-
DIMETHYLCAFFEIC ACID
-
ME140289
-
-
2.0222857
-
Glc-GP(18:0/20:4(5Z,8Z,11Z,14Z))
-
ME140393
-
-
4.291109
-
Glc-GP(18:0/20:4(5Z,8Z,11Z,14Z)) - 4.3366427
-
ME140396
-
-
4.3366427
-
GPEtnNMe(18:1(9Z)/18:1(9Z))[U]
-
ME140418
-
-
5.097229
-
HYDROLYSIS PRODUCT OF BUSSEIN
-
ME140118
-
-
1.1667608
-
HYDROLYSIS PRODUCT OF BUSSEIN - 1.9642363
-
ME140258
-
-
1.9642363
-
Isoquinoline N-oxide
-
ME140049
-
-
1.1095375
-
Lactone of PGF-MUM
-
ME140113
-
-
1.1624509
-
LEVULINIC ACID, 3-BENZYLIDENYL-
-
ME140635
-
-
1.6234778
-
L-gamma-Cyano-gamma-aminobutyric acid
-
ME140357
-
-
2.9196572
-
MADECASSIC ACID
-
ME140610
-
-
1.1138122
-
MERBROMIN
-
ME140458
-
-
5.401387
-
methyl-10-hydroperoxy-8E,12Z,15Z-octadecatrienoate
-
ME140007
-
-
1.1000305
-
Mono-N-depropylprobenecid
-
ME140296
-
-
2.026425
-
N- (2-AMINOETHYL)-4-CHLOROBENZAMIDE (RO-16-6491)
-
ME139954
-
-
1.0659298
-
N-Acetyl-5-aminosalicylic acid
-
ME140384
-
-
3.5030603
-
N-Acetyl-5-hydroxysulfapyridine
-
ME140205
-
-
1.6175979
-
N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine
-
ME140421
-
-
5.133795
-
NIMUSTINE
-
ME140472
-
-
5.5330176
-
Normetanephrine glucuronide
-
ME140367
-
-
3.0297897
-
ORTHOTHYMOTINIC ACID
-
ME140099
-
-
1.1786828
-
Oxymetholone
-
ME140066
-
-
1.1249424
-
Panaxynol
-
ME140075
-
-
1.130511
-
Parahydroxyphenylacetic acid
-
ME140108
-
-
1.1404095
-
Parahydroxyphenylacetic acid - 0.7270009
-
ME140552
-
-
0.7270009
-
Parahydroxyphenylacetic acid - 1.0767124
-
ME140679
-
-
1.0767124
-
Prednicarbate
-
ME139927
-
-
1.0513736
-
Pregnanolone sulfate
-
ME139798
-
-
0.8868142
-
SAPPANONE A 7-METHYL ETHER
-
ME139723
-
-
0.70591396
-
Spheroidenone
-
ME140042
-
-
1.0998391
-
Sulfadoxine suflate
-
ME140168
-
-
1.3902026
-
Sulfite
-
ME139769
-
-
0.7893286
-
Tetranor Iloprost
-
ME140067
-
-
1.1276175
-
TUBAIC ACID
-
ME140244
-
-
1.9441836
-
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
11-deoxy-PGE2
11-Deoxy-PGE2
ME141616
-
-
-
-
12,13-dihydroxy-11-methoxy-9-octadecenoic acid
12,13-Dihydroxy-11-methoxy-9-octadecenoic acid
ME141268
-
-
-
-
Hydroxyhydroquinone
1,2,4-Trihydroxybenzene
ME140783
-
-
-
-
12-amino-dodecanoic acid
12-Aminododecanoic acid
ME141037
-
-
-
-
13E,17-octadecadienoic acid
13E,17-Octadecadienoic acid
ME141609
-
-
-
-
13E,17-octadecadienoic acid + 11.910782
13E,17-Octadecadienoic acid
ME141886
-
-
-
-
13E,17-octadecadienoic acid + 12.073682
13E,17-Octadecadienoic acid
ME141889
-
-
-
-
13E,17-octadecadienoic acid + 12.292003
13E,17-Octadecadienoic acid
ME141901
-
-
-
-
13E,17-octadecadienoic acid + 12.457504
13E,17-Octadecadienoic acid
ME141906
-
-
-
-
13(S)-HpOTrE(gamma)
13S-HpOTrE(gamma)
ME141474
-
-
-
-
15-methyl-15S-PGD2
15-Methyl-15S-PGD2
ME141187
-
-
-
-
15-methyl-15S-PGD2 + 10.410704
15-Methyl-15S-PGD2
ME141211
-
-
-
-
15-methyl-15S-PGD2 + 10.565441
15-Methyl-15S-PGD2
ME141225
-
-
-
-
15(R)-HEDE
15R-HEDE
ME141961
-
-
-
-
16,16-dimethyl-PGF2beta
16,16-Dimethyl-PGF2beta
ME141872
-
-
-
-
17alpha-hydroxypregnenolone
17alpha-Hydroxypregnenolone
ME141987
-
-
-
-
17a-Hydroxyprogesterone
17alpha-Hydroxyprogesterone
ME141495
-
-
-
-
18-Hydroxycorticosterone
18-Hydroxycorticosterone
ME141021
-
-
-
-
18-oxo-nonadecanoic acid
18-Oxononadecanoic acid
ME141592
-
-
-
-
18-oxo-nonadecanoic acid + 13.657046
18-Oxononadecanoic acid
ME141631
-
-
-
-
1a,1b-dihomo-15-deoxy-delta-12,14-PGD2
1a,1b-Dihomo-15-deoxy-delta-12,14-PGD2
ME141702
-
-
-
-
1-Aminocyclopropane-1-carboxylic acid
1-Aminocyclopropanecarboxylic acid
ME141743
-
-
-
-
1-Aminocyclohexanecarboxylic acid
1-Azaniumylcyclohexane-1-carboxylate
ME140817
-
-
-
-
1-Aminocyclohexanecarboxylic acid + 1.2353454
1-Azaniumylcyclohexane-1-carboxylate
ME140842
-
-
-
-
1-Hexadecylamine
1-Hexadecylamine
ME141071
-
-
-
-
1-Hexadecylamine + 10.711269
1-Hexadecylamine
ME141269
-
-
-
-
1-Methyladenosine
1-Methyladenosine
ME140854
-
-
-
-
1-methylhistidine
1-Methylhistidine
ME140767
-
-
-
-
(1R,2R)-3-oxo-2-pentyl-cyclopentanehexanoic acid
(1R,2R)-3-Oxo-2-pentyl-cyclopentanehexanoic acid
ME141366
-
-
-
-
(1S,2S)-3-oxo-2-pentyl-cyclopentanebutanoic acid
(1S,2S)-3-Oxo-2-pentyl-cyclopentanebutanoic acid
ME141591
-
-
-
-
20alpha-Dihydroprednisolone
20alpha-dihydroprednisolone
ME141391
-
-
-
-
20-oxo-heneicosanoic acid
20-Oxoheneicosanoic acid
ME141704
-
-
-
-
20-oxo-heneicosanoic acid + 14.690148
20-Oxoheneicosanoic acid
ME141717
-
-
-
-
2,4-Dihydroxybutyric acid
2,4-Dihydroxybutanoic acid
ME140722
-
-
-
-
2-amino-tetradecanoic acid
2-Aminotetradecanoic acid
ME141811
-
-
-
-
2-decylenic acid
2-Decenoic acid
ME141601
-
-
-
-
2-Deoxyglucose
2-Deoxy-glucose
ME141750
-
-
-
-
2-Deoxyglucose + 1.0106846
2-Deoxy-glucose
ME141752
-
-
-
-
2-Hydroxyadipic acid
2-Hydroxyadipic acid
ME141981
-
-
-
-
2-ISOPROPYL-3-METHOXYCINNAMIC ACID
2-Isopropyl-3-methoxycinnamic acid
ME141356
-
-
-
-
(E)-2-Methylglutaconic acid
2-Methylglutaconic acid
ME140786
-
-
-
-
2-propyl-tridecanoic acid
2-Propyl-tridecanoic acid
ME141629
-
-
-
-
2R-aminohexadecanoic acid
2R-Aminohexadecanoic acid
ME141578
-
-
-
-
3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9...
3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione
ME141101
-
-
-
-
3,4-Dihydroxybutyric acid
3,4-Dihydroxybutyric acid
ME140822
-
-
-
-
3,6,8-dodecatrien-1-ol
3,6,8-Dodecatrien-1-ol
ME141655
-
-
-
-
3alpha,6alpha,7alpha,12alpha-Tetrahydroxy-5beta-ch...
3alpha,6alpha,7alpha,12alpha-Tetrahydroxy-5beta-cholan-24-oic acid
ME141597
-
-
-
-
3-Aminopropanal
3-Aminopropionaldehyde
ME140773
-
-
-
-
3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid
3-Deoxy-D-glycero-D-galacto-2-nonulosonic acid
ME140874
-
-
-
-
3E,13Z-octadecadien-1-ol
3E,13Z-Octadecadien-1-ol
ME141705
-
-
-
-
3E,13Z-octadecadien-1-ol + 14.688305
3E,13Z-Octadecadien-1-ol
ME141724
-
-
-
-
3E,5E-tridecadienoic acid
3E,5E-Tridecadienoic acid
ME141642
-
-
-
-
3-Guanidinopropionic acid
3-Guanidinopropanoic acid
ME140803
-
-
-
-
3-keto palmitic acid
3-Ketopalmitic acid
ME142001
-
-
-
-
3-keto palmitic acid + 11.555159
3-Ketopalmitic acid
ME142004
-
-
-
-
3-methyl valeric acid
3-Methylvaleric acid
ME140871
-
-
-
-
3-Oxochola-1,4,6-trien-24-oic Acid
3-Oxochola-1,4,6-trien-24-oic acid
ME141625
-
-
-
-
4,8,12,15,19,21-tetracosahexaenoic acid
4,8,12,15,19,21-Tetracosahexaenoic acid
ME141809
-
-
-
-
5-(3,4-Dihydroxy-1,5-cyclohexadien-1-yl)-5-phenylh...
5-(3,4-Dihydroxy-1,5-cyclohexadien-1-yl)-5-phenylhydantoin
ME140960
-
-
-
-
6alpha-Hydroxycastasterone
6alpha-Hydroxycastasterone
ME141568
-
-
-
-
6-Formylindolo [3,2-B] carbazole
6-Formylindolo[3,2-B]carbazole
ME140941
-
-
-
-
6Z,9Z-hexadecadienoic acid
6Z,9Z-Hexadecadienoic acid
ME141844
-
-
-
-
7,8-Diaminononanoate
7,8-Diaminononanoic acid
ME140754
-
-
-
-
7,8-Diaminononanoate + 0.84967834
7,8-Diaminononanoic acid
ME140756
-
-
-
-
8-Amino Caprylic acid
8-Aminooctanoic acid
ME140840
-
-
-
-
9,13-dihydroxy-11-octadecenoic acid
9,13-DiHOME(11)
ME141595
-
-
-
-
9-lauroleic acid
9-Dodecenoic acid
ME141910
-
-
-
-
ABSCISIC ACID (cis,trans)
Abscisic acid
ME141224
-
-
-
-
ACECLIDINE
Aceclidine
ME141762
-
-
-
-
Acetoin
Acetoin
ME140904
-
-
-
-
Acetoin + 3.5543795
Acetoin
ME140930
-
-
-
-
Ala Phe Phe
Ala-Phe-Phe
ME141942
-
-
-
-
Ala Trp Arg
Ala-Trp-Arg
ME141141
-
-
-
-
Allotetrahydrocortisol
Allotetrahydrocortisol
ME141202
-
-
-
-
Arginine
Arginine
ME140762
-
-
-
-
Arg Phe Arg
Arg-Phe-Arg
ME141212
-
-
-
-
Arg Phe Arg + 10.675178
Arg-Phe-Arg
ME141238
-
-
-
-
Arg Val Trp
Arg-Val-Trp
ME141140
-
-
-
-
Beclomethasone
Beclomethasone
ME141133
-
-
-
-
Benserazide
Benserazide
ME140760
-
-
-
-
BENZYLBUTYLPHTHALATE
Benzyl butyl phthalate
ME141395
-
-
-
-
Estradiol
beta-Estradiol
ME141431
-
-
-
-
3-Amino-3-(4-hydroxyphenyl)propanoate
beta-Tyrosine
ME140861
-
-
-
-
3-Amino-3-(4-hydroxyphenyl)propanoate + 1.7813773
beta-Tyrosine
ME140862
-
-
-
-
Bilirubin
Bilirubin
ME141060
-
-
-
-
Bilirubin + 14.756282
Bilirubin
ME141734
-
-
-
-
Biliverdin IX
Biliverdin
ME141116
-
-
-
-
Buprenorphine
Buprenorphine
ME141174
-
-
-
-
Caffeine
Caffeine
ME140952
-
-
-
-
cis-11-Hexadecenal
cis-11-Hexadecenal
ME141632
-
-
-
-
p-Coumaric acid
cis-p-Coumaric acid
ME141100
-
-
-
-
Creatinine
Creatinine
ME140806
-
-
-
-
Creatinine + 0.9782891
Creatinine
ME140807
-
-
-
-
cyclandelate
Cyclandelate
ME141103
-
-
-
-
cyclandelate + 10.333184
Cyclandelate
ME141203
-
-
-
-
cyclandelate + 11.35672
Cyclandelate
ME141355
-
-
-
-
cyclohexylammonium
Cyclohexylamine
ME140835
-
-
-
-
cyclohexylammonium + 4.089639
Cyclohexylamine
ME140951
-
-
-
-
Cys Ala Gly
Cys-Ala-Gly
ME141940
-
-
-
-
Cys Cys
Cys-Cys
ME140771
-
-
-
-
Cys Pro Ile
Cys-Pro-Ile
ME141073
-
-
-
-
Desethylchloroquine
Desethylchloroquine
ME142016
-
-
-
-
Didrovaltratum
Didrovaltratum
ME141508
-
-
-
-
Asymmetric dimethylarginine
Dimethylarginine
ME140818
-
-
-
-
Disulfiram
Disulfiram
ME141824
-
-
-
-
D-Lysine
D-Lysine
ME140724
-
-
-
-
dodecanamide
Dodecanamide
ME141179
-
-
-
-
dodecanamide + 10.644595
Dodecanamide
ME141234
-
-
-
-
Doxapram
Doxapram
ME141941
-
-
-
-
D-Proline
D-Proline
ME140811
-
-
-
-
p-HYDROXYCINNAMALDEHYDE
(E)-3-(4-Hydroxyphenyl)-2-propenal
ME141015
-
-
-
-
Ecgonine
Ecgonine
ME140846
-
-
-
-
Embelin
Embelin
ME141138
-
-
-
-
Embelin + 11.928356
Embelin
ME141462
-
-
-
-
epsilon-Caprolactam
Epsilon-caprolactam
ME140945
-
-
-
-
ESTRADIOL CYPIONATE
Estradiol cypionate
ME141720
-
-
-
-
Estrone sulfate
Estrone 3-sulfate
ME141753
-
-
-
-
Fexofenadine
Fexofenadine
ME141215
-
-
-
-
Fexofenadine + 10.656503
Fexofenadine
ME141235
-
-
-
-
Fexofenadine + 11.475676
Fexofenadine
ME141378
-
-
-
-
Anandamide (18:3, n-6)
gamma-Linolenoyl-EA
ME141351
-
-
-
-
Anandamide (18:3, n-6) + 12.584168
gamma-Linolenoyl-EA
ME141552
-
-
-
-
Anandamide (18:3, n-6) + 13.313286
gamma-Linolenoyl-EA
ME141582
-
-
-
-
Gln Pro Lys
Gln-Pro-Lys
ME140977
-
-
-
-
Glucosamine
Glucosamine
ME140787
-
-
-
-
D-Glucose
Glucose
ME140823
-
-
-
-
Glu Tyr Thr
Glu-Tyr-Thr
ME140832
-
-
-
-
Gly Ala
Gly-Ala
ME140763
-
-
-
-
Cholylglycine
Glycocholic acid
ME141053
-
-
-
-
Glycodeoxycholate
Glycodeoxycholic acid
ME141092
-
-
-
-
Lithocholic acid glycine conjugate
Glycolithocholic acid
ME141952
-
-
-
-
Lithocholic acid glycine conjugate + 13.876054
Glycolithocholic acid
ME141958
-
-
-
-
Gly Val His
Gly-Val-His
ME140992
-
-
-
-
His Cys Met
His-Cys-Met
ME141559
-
-
-
-
His Gly Gly
His-Gly-Gly
ME140765
-
-
-
-
His Thr Ala
His-Thr-Ala
ME140935
-
-
-
-
Histidine
Histidine
ME140757
-
-
-
-
His Trp Gly
His-Trp-Gly
ME141029
-
-
-
-
His Val Arg
His-Val-Arg
ME141387
-
-
-
-
Homoarginine
Homoarginine
ME141749
-
-
-
-
Hypoxanthine
Hypoxanthine
ME141755
-
-
-
-
Ile Pro
Ile-Pro
ME140856
-
-
-
-
Indoleacrylic acid
Indoleacrylic acid
ME140914
-
-
-
-
Indoleacrylic acid + 4.0787907
Indoleacrylic acid
ME140943
-
-
-
-
Isoleucine
Isoleucine
ME140865
-
-
-
-
Isoleucine + 2.3072839
Isoleucine
ME140868
-
-
-
-
ISOPIMPINELLIN
Isopimpinellin
ME140776
-
-
-
-
ISOSAFROLE
Isosafrole
ME141058
-
-
-
-
ISOSAFROLE + 11.335749
Isosafrole
ME141360
-
-
-
-
Lactic acid
Lactic acid
ME140779
-
-
-
-
Lecanoric acid
Lecanoric acid
ME141840
-
-
-
-
Leucine
Leucine
ME140867
-
-
-
-
Leupeptin
Leupeptin
ME141870
-
-
-
-
Leu Pro Pro
Leu-Pro-Pro
ME141172
-
-
-
-
Leu Pro Pro + 9.409358
Leu-Pro-Pro
ME141789
-
-
-
-
Linoleamide
Linoleamide
ME141920
-
-
-
-
Linolenoyl lysolecithin
LPC 18:3
ME141191
-
-
-
-
Linolenoyl lysolecithin + 11.245934
LPC 18:3
ME141335
-
-
-
-
GPEtn(16:0/0:0)
LPE 16:0/0:0
ME141319
-
-
-
-
GPEtn(18:0/0:0)
LPE 18:0/0:0
ME141233
-
-
-
-
GPEtn(18:1(9Z)/0:0)
LPE 18:1
ME141379
-
-
-
-
LTB4 ethanol amide
LTB4 ethanol amide
ME141555
-
-
-
-
LTB4 ethanol amide + 13.095308
LTB4 ethanol amide
ME141560
-
-
-
-
Lys Asn Pro
Lys-Asn-Pro
ME140953
-
-
-
-
Lys Asp Trp
Lys-Asp-Trp
ME141137
-
-
-
-
Lys Gln Ile
Lys-Gln-Ile
ME140965
-
-
-
-
Lys Lys Lys
Lys-Lys-Lys
ME141950
-
-
-
-
METHOPRENE (S)
Methoprene
ME141992
-
-
-
-
Met Lys His
Met-Lys-His
ME141146
-
-
-
-
Met Lys His + 9.989336
Met-Lys-His
ME141185
-
-
-
-
Met Thr Gly
Met-Thr-Gly
ME141110
-
-
-
-
1-hexadecanoyl-sn-glycerol
MG 16:0/0:0/0:0
ME141623
-
-
-
-
1-hexadecanoyl-sn-glycerol + 13.638916
MG 16:0/0:0/0:0
ME141627
-
-
-
-
1-octadecanoyl-rac-glycerol
MG 18:0
ME141703
-
-
-
-
1-octadecanoyl-rac-glycerol + 14.688478
MG 18:0
ME141719
-
-
-
-
1-eicosanoyl-rac-glycerol
MG 20:0
ME141605
-
-
-
-
Phthalic acid Mono-2-ethylhexyl Ester
Monoethylhexyl phthalic acid
ME141426
-
-
-
-
Phthalic acid Mono-2-ethylhexyl Ester + 11.67471
Monoethylhexyl phthalic acid
ME141428
-
-
-
-
Phthalic acid Mono-2-ethylhexyl Ester + 11.737526
Monoethylhexyl phthalic acid
ME141439
-
-
-
-
Phthalic acid Mono-2-ethylhexyl Ester + 11.739214
Monoethylhexyl phthalic acid
ME141435
-
-
-
-
myo-Inositol
Myo-inositol
ME140770
-
-
-
-
(-)N-(1R-methyl-propyl) arachidonoyl amine
N-(1R-Methyl-propyl) arachidonoyl amine
ME141531
-
-
-
-
N-AcetylCilastatin
N-AcetylCilastatin
ME141023
-
-
-
-
Nadolol
Nadolol
ME141018
-
-
-
-
Nadolol + 6.797542
Nadolol
ME141030
-
-
-
-
N-arachidonoyl D-serine
N-Arachidonoyl D-serine
ME141119
-
-
-
-
Netilmicin
Netilmicin
ME140973
-
-
-
-
Isobutylglycine
N-Isobutylglycine
ME140839
-
-
-
-
Isobutylglycine + 4.0776467
N-Isobutylglycine
ME140942
-
-
-
-
N-METHYLISOLEUCINE
N-Methylisoleucine
ME140813
-
-
-
-
N,N-dimethylsphing-4-enine
N,N-Dimethylsphingosine
ME141963
-
-
-
-
n-Pentadecylamine
N-Pentadecylamine
ME141792
-
-
-
-
Octadecanedioic acid
Octadecanedioic acid
ME141593
-
-
-
-
Octocrylene
Octocrylene
ME141939
-
-
-
-
Oleandomycin
Oleandomycin
ME141921
-
-
-
-
OLEANDOMYCIN
Oleandomycin
ME141918
-
-
-
-
N-oleoylethanolamine
Oleoyl-EA
ME141697
-
-
-
-
DL-Ornithine
Ornithine
ME140890
-
-
-
-
Oxalosuccinic acid
Oxalosuccinic acid
ME140849
-
-
-
-
GPA(21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PA 21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME141647
-
-
-
-
N-(2-hydroxyethyl)palmitamide
Palmitoyl-EA
ME141266
-
-
-
-
N-(2-hydroxyethyl)palmitamide + 10.900234
Palmitoyl-EA
ME141278
-
-
-
-
N-(2-hydroxyethyl)palmitamide + 11.029883
Palmitoyl-EA
ME141299
-
-
-
-
N-(2-hydroxyethyl)palmitamide + 11.126383
Palmitoyl-EA
ME141314
-
-
-
-
N-(2-hydroxyethyl)palmitamide + 11.2943125
Palmitoyl-EA
ME141350
-
-
-
-
N-(2-hydroxyethyl)palmitamide + 12.8659935
Palmitoyl-EA
ME141553
-
-
-
-
N-(2-hydroxyethyl)palmitamide + 14.25288
Palmitoyl-EA
ME141690
-
-
-
-
Pantetheine
Pantetheine
ME140994
-
-
-
-
Pantothenic Acid
Pantothenic acid
ME140900
-
-
-
-
GPEtn(18:1(9Z)/18:1(9Z))[U]
PE 18:1(9Z)/18:1(9Z)
ME141469
-
-
-
-
Penbutolol
Penbutolol
ME141775
-
-
-
-
Pentoxifylline
Pentoxifylline
ME140815
-
-
-
-
1-heptadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)...
PG 17:0_20:4(5Z,8Z,11Z,14Z)
ME141908
-
-
-
-
GPGro(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PG 18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME141337
-
-
-
-
GPGro(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) + 11.26811...
PG 18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME141851
-
-
-
-
PGE1 alcohol
PGE1 alcohol
ME141540
-
-
-
-
PGF2alpha isopropyl ester
PGF2alpha isopropyl ester
ME141321
-
-
-
-
PGF2alpha isopropyl ester + 11.351006
PGF2alpha isopropyl ester
ME141364
-
-
-
-
PGF2alpha isopropyl ester + 11.451276
PGF2alpha isopropyl ester
ME141988
-
-
-
-
PGF2alpha isopropyl ester + 11.698368
PGF2alpha isopropyl ester
ME141422
-
-
-
-
Phenoperidine
Phenoperidine
ME141842
-
-
-
-
Phensuximide
Phensuximide
ME141027
-
-
-
-
Phenylalanine
Phenylalanine
ME140883
-
-
-
-
GPIns(16:0/16:0)
PI 16:0/16:0
ME141549
-
-
-
-
GPIns(16:0/16:0) + 13.551874
PI 16:0/16:0
ME141606
-
-
-
-
GPIns(16:0/16:0) + 14.135602
PI 16:0/16:0
ME141693
-
-
-
-
GPIns(16:0/18:1(9Z))
PI 16:0/18:1(9Z)
ME141463
-
-
-
-
GPIns(16:0/18:1(9Z)) + 12.047834
PI 16:0/18:1(9Z)
ME141890
-
-
-
-
GPIns(16:0/18:1(9Z)) + 14.137217
PI 16:0/18:1(9Z)
ME141679
-
-
-
-
GPIns(16:0/18:1(9Z)) + 14.414539
PI 16:0/18:1(9Z)
ME141706
-
-
-
-
Pinacidil
Pindac
ME140958
-
-
-
-
Pinacidil + 4.3858333
Pindac
ME140963
-
-
-
-
Pinacidil + 4.4855013
Pindac
ME141998
-
-
-
-
PIPERINE
Piperine
ME141112
-
-
-
-
PIPERINE + 9.30038
Piperine
ME141121
-
-
-
-
PIPERINE + 9.393668
Piperine
ME141125
-
-
-
-
Procyclidine
Procyclidine
ME141040
-
-
-
-
Pro His
Pro-His
ME140927
-
-
-
-
Pro His His
Pro-His-His
ME140827
-
-
-
-
Proline
Proline
ME140755
-
-
-
-
Pro Pro Phe
Pro-Pro-Phe
ME141359
-
-
-
-
GPSer(18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))
PS 18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z)
ME141326
-
-
-
-
Purine
Purine
ME140723
-
-
-
-
Purine + 0.8628673
Purine
ME140759
-
-
-
-
Pyrroline hydroxycarboxylic acid
Pyrroline hydroxycarboxylic acid
ME140761
-
-
-
-
OXYQUINOLINE
Quinolin-8-ol
ME141759
-
-
-
-
OXYQUINOLINE + 5.7667704
Quinolin-8-ol
ME141771
-
-
-
-
Ser Asp Asp
Ser-Asp-Asp
ME141833
-
-
-
-
Ser Ser Arg
Ser-Ser-Arg
ME140954
-
-
-
-
Ser Ser Arg + 10.906904
Ser-Ser-Arg
ME141835
-
-
-
-
Dihydrosphingosine
Sphinganine
ME141371
-
-
-
-
octadecanamide
Stearamide
ME141699
-
-
-
-
Stearic acid
Stearic acid
ME141716
-
-
-
-
Sulfamethazine
Sulfamethazine
ME141079
-
-
-
-
Sulfaquinoxaline
Sulfaquinoxaline
ME141080
-
-
-
-
Tacrolimus
Tacrolimus
ME141380
-
-
-
-
TEGASEROD
Tegaserod
ME140923
-
-
-
-
Tetradecylamine
Tetradecylamine
ME141128
-
-
-
-
Theophylline
Theophylline
ME140899
-
-
-
-
Theophylline + 3.6554136
Theophylline
ME140925
-
-
-
-
Threonate
Threonic acid
ME140859
-
-
-
-
Thr Glu
Thr-Glu
ME140809
-
-
-
-
TIAPRIDE
Tiapride
ME140974
-
-
-
-
TIAPRIDE + 5.395146
Tiapride
ME141003
-
-
-
-
Tranexamic acid
Tranexamic acid
ME140850
-
-
-
-
trans-3-Hydroxycotinine glucuronide
trans-3-Hydroxycotinine glucuronide
ME141493
-
-
-
-
trans-3-Hydroxycotinine glucuronide + 12.100258
trans-3-Hydroxycotinine glucuronide
ME141895
-
-
-
-
Cinnamic acid
trans-Cinnamic acid
ME140894
-
-
-
-
Triparanol
Triparanol
ME140816
-
-
-
-
Trp Phe
Trp-Phe
ME141984
-
-
-
-
Tryptophan
Tryptophan
ME140916
-
-
-
-
Tyr Thr Cys
Tyr-Thr-Cys
ME140789
-
-
-
-
Urea
Urea
ME140797
-
-
-
-
Uric acid
Uric acid
ME140845
-
-
-
-
Uridine
Uridine
ME140837
-
-
-
-
Val Ala
Val-Ala
ME140838
-
-
-
-
Valine
Valine
ME140796
-
-
-
-
Valine + 1.1855006
Valine
ME140824
-
-
-
-
Val Pro Thr
Val-Pro-Thr
ME141077
-
-
-
-
Val Val Trp
Val-Val-Trp
ME141507
-
-
-
-
Vigabatrin
Vigabatrin
ME140725
-
-
-
-
Vigabatrin + 1.0069108
Vigabatrin
ME140814
-
-
-
-
Zopiclone
Zopiclone
ME141430
-
-
-
-
10-hydroxy-8E-Decene-2,4,6-triynoic acid
-
ME141097
-
-
-
-
1,2-di-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-...
-
ME141622
-
-
-
-
1,2 di-(9Z,12Z,15Z-octadecatrienoyl)-3-O-Beta-D-ga...
-
ME141816
-
-
-
-
13S-hydroxy-9E,11Z-octadecadienoic acid
-
ME141539
-
-
-
-
1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-2-(7Z,10Z,13Z,1...
-
ME141626
-
-
-
-
16a-Hydroxydydrogesterone glucoronide
-
ME141024
-
-
-
-
(17Z)-1alpha,25-dihydroxy-26,27-dimethyl-17,20,22,...
-
ME141633
-
-
-
-
1,9Z,16-heptadecatrien-4,6-diyn-3,8-diol
-
ME141812
-
-
-
-
1alpha,25-dihydroxy-24-oxovitamin D_3 / 1alpha,25-...
-
ME141258
-
-
-
-
1alpha,25-dihydroxy-26,27-dimethyl-24a-homo-22-oxa...
-
ME141599
-
-
-
-
1alpha-hydroxy-21-nor-20-oxavitamin D3 / 1alpha-hy...
-
ME141565
-
-
-
-
1alpha-hydroxy-23-[3-(1-hydroxy-1-methylethyl)phen...
-
ME140948
-
-
-
-
1alpha-hydroxy-23-[3-(1-hydroxy-1-methylethyl)phen...
-
ME140989
-
-
-
-
1beta,25-dihydroxy-2beta-(3-hydroxypropoxy)vitamin...
-
ME141581
-
-
-
-
1beta,25-dihydroxy-2beta-(3-hydroxypropoxy)vitamin...
-
ME141614
-
-
-
-
1beta,25-dihydroxy-2beta-(3-hydroxypropoxy)vitamin...
-
ME141653
-
-
-
-
1-heneicosanoyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahex...
-
ME141995
-
-
-
-
1-heptadecanoyl-rac-glycerol
-
ME141681
-
-
-
-
20alpha-Dihydroprednisone
-
ME141028
-
-
-
-
(23R,25S)-1alpha,25-dihydroxyvitamin D3 26,23-lact...
-
ME141362
-
-
-
-
24-Nor-5beta-cholane-3alpha,7alpha,12alpha,23-tetr...
-
ME141707
-
-
-
-
24-Nor-5beta-cholane-3alpha,7beta,22,23-tetrol
-
ME141718
-
-
-
-
25-azavitamin D3 / 25-azacholecalciferol
-
ME141468
-
-
-
-
25-azavitamin D3 / 25-azacholecalciferol + 12.0819...
-
ME141476
-
-
-
-
2-Amino-2-methyl-1-propanol
-
ME141748
-
-
-
-
2-Amino-3-methyl-1-butanol
-
ME141173
-
-
-
-
2-Amino-3-methyl-1-butanol + 10.085568
-
ME141180
-
-
-
-
2-Amino-3-methyl-1-butanol + 10.351037
-
ME141205
-
-
-
-
2-Amino-3-methyl-1-butanol + 10.517659
-
ME141221
-
-
-
-
2-Amino-3-methyl-1-butanol + 10.61672
-
ME141229
-
-
-
-
2-Amino-3-methyl-1-butanol + 10.7055645
-
ME141245
-
-
-
-
2-Amino-3-methyl-1-butanol + 10.748854
-
ME141257
-
-
-
-
2-Amino-3-methyl-1-butanol + 11.012477
-
ME141295
-
-
-
-
2-Amino-3-methyl-1-butanol + 11.133931
-
ME141306
-
-
-
-
2-Amino-3-methyl-1-butanol + 11.151311
-
ME141311
-
-
-
-
2-Amino-3-methyl-1-butanol + 11.254089
-
ME141323
-
-
-
-
2-Amino-3-methyl-1-butanol + 11.316804
-
ME141338
-
-
-
-
2-Amino-3-methyl-1-butanol + 11.528235
-
ME141400
-
-
-
-
2-Amino-3-methyl-1-butanol + 12.160485
-
ME141497
-
-
-
-
2-Amino-3-methyl-1-butanol + 12.509543
-
ME141523
-
-
-
-
2-Amino-3-methyl-1-butanol + 8.130119
-
ME141778
-
-
-
-
2E,4Z-hexadecadienoic acid
-
ME141828
-
-
-
-
2E,4Z-hexadecadienoic acid + 10.974914
-
ME141837
-
-
-
-
2E,4Z-hexadecadienoic acid + 11.287469
-
ME141852
-
-
-
-
3,3,45-Tetrahydroxystilbene
-
ME141786
-
-
-
-
3-(a-Naphthoxy)lactic acid glucuronide
-
ME140778
-
-
-
-
3-Hydroxy-4-methoxyphenylacetic acid
-
ME141102
-
-
-
-
3-n-decyl acrylic acid
-
ME141989
-
-
-
-
3-O-Methyldobutamine
-
ME141131
-
-
-
-
3-O-Methyldobutamine + 9.71352
-
ME141153
-
-
-
-
3-O-Sulfogalactosylceramide
-
ME141903
-
-
-
-
4-Amino-6,7-dimethoxy-2-(1-piperazinyl)quinazoline
-
ME140975
-
-
-
-
4-Chloro-N1-methyl-N1-(4-carboxy-2-hydroxy-2-methy...
-
ME141935
-
-
-
-
4-Oxo-4-(3-pyridyl)-butanoic acid
-
ME140962
-
-
-
-
5,11,14,17-Eicosatetraenoic acid
-
ME141897
-
-
-
-
5-methyl-tetradecanedioic acid
-
ME141459
-
-
-
-
(6RS)-22-oxo-23,24,25,26,27-pentanorvitamin D3 6,1...
-
ME141964
-
-
-
-
8-hydroxy-17-octadecene-10,12-diynoic acid
-
ME141567
-
-
-
-
8R-hydroxy-9Z-octadecenoic acid
-
ME141503
-
-
-
-
alpha-Phenylcyclohexylglycolic acid
-
ME141130
-
-
-
-
Arachidonyl lysolecithin
-
ME141223
-
-
-
-
Arachidonyl lysolecithin + 10.70548
-
ME141246
-
-
-
-
Avermectin A2a
-
ME141847
-
-
-
-
avobenzone
-
ME141938
-
-
-
-
Bis (2-hydroxypropyl) amine
-
ME140855
-
-
-
-
Cerebroside C
-
ME141522
-
-
-
-
CEVADINE
-
ME141008
-
-
-
-
cis-3-(6-Hydroxy-7-methoxy-5-benzofuranyl)acrylic ...
-
ME141990
-
-
-
-
Cyclohexanone, 4-[1-hydroxy-1-phenyl-3-(1-pyrrolid...
-
ME141109
-
-
-
-
DIHYDROFISSINOLIDE
-
ME140940
-
-
-
-
ethotoin
-
ME140911
-
-
-
-
Gemeprost
-
ME141339
-
-
-
-
Gemeprost + 11.412178
-
ME141372
-
-
-
-
Gemeprost + 11.486941
-
ME141388
-
-
-
-
Gemeprost + 11.5606575
-
ME141413
-
-
-
-
Gemeprost + 11.649413
-
ME141424
-
-
-
-
Gemeprost + 11.766222
-
ME141441
-
-
-
-
Gemeprost + 11.914792
-
ME141455
-
-
-
-
Gemeprost + 11.990591
-
ME141467
-
-
-
-
Gemeprost + 12.058225
-
ME141475
-
-
-
-
GPEtnNMe(18:1(9Z)/18:1(9Z))[U]
-
ME141563
-
-
-
-
GPEtnNMe(18:1(9Z)/18:1(9Z))[U] + 14.125486
-
ME141683
-
-
-
-
isoamyl nitrite
-
ME140782
-
-
-
-
isoamyl nitrite + 1.1783686
-
ME140826
-
-
-
-
Ivermectin B1a
-
ME141352
-
-
-
-
Ivermectin B1a + 11.394018
-
ME141370
-
-
-
-
Ivermectin B1b
-
ME141850
-
-
-
-
L-Alaninol
-
ME140802
-
-
-
-
LEVULINIC ACID, 3-BENZYLIDENYL-
-
ME141429
-
-
-
-
LEVULINIC ACID, 3-BENZYLIDENYL- + 11.726488
-
ME141438
-
-
-
-
L-Glutamic acid dibutyl ester
-
ME140999
-
-
-
-
L-Glutamic acid n-butyl ester
-
ME140853
-
-
-
-
L-Glutamic acid n-butyl ester + 1.5098839
-
ME140860
-
-
-
-
Meradimate
-
ME141076
-
-
-
-
Meradimate + 9.542891
-
ME141129
-
-
-
-
Meradimate + 9.780986
-
ME141154
-
-
-
-
methyl-10-hydroperoxy-8E,12Z,15Z-octadecatrienoate
-
ME141515
-
-
-
-
methyl 8-[2-(2-formyl-vinyl)-3-hydroxy-5-oxo-cyclo...
-
ME141115
-
-
-
-
Mifepristone (RU 486)
-
ME141167
-
-
-
-
N-Desethyloxybutynin
-
ME141189
-
-
-
-
N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine
-
ME140959
-
-
-
-
N-Hexadecyl-L-hydroxyproline
-
ME141577
-
-
-
-
N-Hexadecyl-L-hydroxyproline + 14.517754
-
ME141709
-
-
-
-
N-HISTIDYL-2-AMINONAPHTHALENE (betaNA)
-
ME141145
-
-
-
-
N-Methyl-2-pyridone-5-carboxamide (Nudifloramide)
-
ME140872
-
-
-
-
N-Methyl-2-pyridone-5-carboxamide (Nudifloramide) ...
-
ME140873
-
-
-
-
N,N-(2,2-dihydroxy-ethyl) arachidonoyl amine
-
ME141933
-
-
-
-
OLEANANOIC ACID ACETATE
-
ME141529
-
-
-
-
Oleoyl amine
-
ME141279
-
-
-
-
Oleoyl amine + 11.019689
-
ME141297
-
-
-
-
Oleoyl amine + 11.148188
-
ME141316
-
-
-
-
Oleoyl amine + 11.303992
-
ME141348
-
-
-
-
Oleoyl amine + 11.436401
-
ME141392
-
-
-
-
Oleoyl amine + 12.276432
-
ME141500
-
-
-
-
Oleoyl amine + 12.400412
-
ME141510
-
-
-
-
Oleoyl amine + 13.464861
-
ME141596
-
-
-
-
pentan-3-one
-
ME140791
-
-
-
-
Pentazocine trans acid
-
ME141095
-
-
-
-
PEUCENIN
-
ME141057
-
-
-
-
PEUCENIN + 7.903765
-
ME141061
-
-
-
-
Phenytoin-N-glucuronide
-
ME140924
-
-
-
-
Pinacidil-N-Oxide
-
ME140878
-
-
-
-
Pindolol
-
ME141780
-
-
-
-
PRACTOLOL
-
ME141272
-
-
-
-
PRACTOLOL + 10.951184
-
ME141287
-
-
-
-
RETUSOQUINONE
-
ME141105
-
-
-
-
RETUSOQUINONE + 11.358456
-
ME141353
-
-
-
-
Ritodrine glucuronide 2
-
ME141012
-
-
-
-
SAPINDOSIDE A
-
ME141855
-
-
-
-
Thioridazine
-
ME141819
-
-
-
-
Ubiquinone
-
ME141108
-
-
-
-
Ubiquinone + 8.070654
-
ME141777
-
-
-
-
VALERYL SALYCILATE
-
ME141055
-
-
-
-
(Z)-N-(2-hydroxyethyl)hexadec-7-enamide
-
ME141608
-
-
-
-
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
10-methyl-hexadecanoic acid
10-Methyl-hexadecanoic acid
ME142315
-
-
14.705269
-
DL-12-hydroxy stearic acid
12-Hydroxy stearic acid
ME142367
-
-
12.189199
-
13E,17-octadecadienoic acid
13E,17-Octadecadienoic acid
ME142236
-
-
13.513562
-
13E,17-octadecadienoic acid - 13.613921
13E,17-Octadecadienoic acid
ME142249
-
-
13.613921
-
2-Hydroxyadipic acid
2-Hydroxyadipic acid
ME142051
-
C02360
0.8979196
-
a-hydroxybutyrate
2-Hydroxybutyric acid
ME142075
-
-
2.2812512
-
a-hydroxybutyrate - 2.692548
2-Hydroxybutyric acid
ME142078
-
-
2.692548
-
2-Hydroxyethinylestradiol
2-Hydroxyethinylestradiol
ME142162
-
-
10.058822
-
2-Hydroxyethinylestradiol - 10.176795
2-Hydroxyethinylestradiol
ME142164
-
-
10.176795
-
2-Hydroxyethinylestradiol - 10.331066
2-Hydroxyethinylestradiol
ME142167
-
-
10.331066
-
2-Hydroxyethinylestradiol - 13.766247
2-Hydroxyethinylestradiol
ME142243
-
-
13.766247
-
2-propyl-tridecanoic acid
2-Propyl-tridecanoic acid
ME142279
-
-
14.075377
-
2-propyl-tridecanoic acid - 14.683501
2-Propyl-tridecanoic acid
ME142312
-
-
14.683501
-
2,3-Dihydroxybenzoic acid
2-Pyrocatechuic acid
ME142109
-
C00196
4.3990135
-
3,9,15-Docosatriynoic acid
3,9,15-Docosatriynoic acid
ME142228
-
-
13.10277
-
3-Methyl-2-oxovaleric acid
3-Methyl-2-oxovaleric acid
ME142096
-
C00671
3.6866663
-
3-Methyl-2-oxovaleric acid - 3.8886838
3-Methyl-2-oxovaleric acid
ME142103
-
C00671
3.8886838
-
3-Methylsuberic acid
3-Methylsuberic acid
ME142126
-
-
5.7509704
-
4,7,10,13,16-docosapentaenoic acid
4,7,10,13,16-Docosapentaenoic acid
ME142258
-
-
13.615754
-
4,7,10,13-docosatetraenoic acid
4,7,10,13-Docosatetraenoic acid
ME142267
-
-
14.011637
-
4,8-dimethyl-dodecanoic acid
4,8-Dimethyl-dodecanoic acid
ME142229
-
-
13.12732
-
4-Hydroxybenzenesulfonic acid
4-Hydroxybenzenesulfonic acid
ME142101
-
-
3.8414772
-
4Z,7Z,10Z,13Z-eicosatetraenoic acid
4Z,7Z,10Z,13Z-Eicosatetraenoic acid
ME142232
-
-
13.328448
-
5beta-Androstan-3alpha-ol-17-one sulfate
5beta-Androstan-3alpha-ol-17-one sulfate
ME142127
-
-
6.371507
-
5beta-Androstan-3alpha-ol-17-one sulfate - 7.17387...
5beta-Androstan-3alpha-ol-17-one sulfate
ME142132
-
-
7.173876
-
5beta-Androstan-3alpha-ol-17-one sulfate - 7.36693...
5beta-Androstan-3alpha-ol-17-one sulfate
ME142134
-
-
7.3669353
-
5-Methoxyindoleacetate
5-Methoxyindoleacetic acid
ME142402
-
C05660
5.335415
-
5-octadecylenic acid
6-Octadecylenic acid
ME142296
-
-
14.258506
-
5-octadecylenic acid - 14.302397
6-Octadecylenic acid
ME142300
-
-
14.302397
-
7-palmitoleic acid
7-Palmitoleic acid
ME142231
-
-
13.2896
-
9,12,14-octadecatrienoic acid
9,12,14-Octadecatrienoic acid
ME142222
-
-
12.842068
-
9,12,14-octadecatrienoic acid - 12.930276
9,12,14-Octadecatrienoic acid
ME142226
-
-
12.930276
-
9R-hydroxy-12E-octadecenoic acid
9R-HOME(12E)
ME142223
-
-
12.564822
-
alpha-Hydroxytriazolam
alpha-Hydroxytriazolam
ME142069
-
-
1.2602226
-
Arg Ala Phe
Arg-Ala-Phe
ME142283
-
-
14.183214
-
Arg Asn Gln
Arg-Asn-Gln
ME142240
-
-
13.515578
-
Arg Phe Arg
Arg-Phe-Arg
ME142169
-
-
10.474156
-
Arg Phe Arg - 10.677579
Arg-Phe-Arg
ME142177
-
-
10.677579
-
Arg Ser Phe
Arg-Ser-Phe
ME142334
-
-
6.688555
-
Benzyl alcohol
Benzyl alcohol
ME142112
-
-
4.7950974
-
3-Amino-3-(4-hydroxyphenyl)propanoate
beta-Tyrosine
ME142073
-
C04368
1.6767582
-
Bilirubin
Bilirubin
ME142319
-
C00486
14.773233
-
Castasterone
Castasterone
ME142380
-
-
13.696995
-
Pyrocatechol sulfate
Catechol sulfate
ME142085
-
-
3.551135
-
clavulone I
Clavulone I
ME142353
-
-
10.659008
-
clavulone I - 10.765902
Clavulone I
ME142357
-
-
10.765902
-
cyclandelate
Cyclandelate
ME142165
-
-
10.328802
-
Desmosine
Desmosine
ME142173
-
-
10.584751
-
1,2-di-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol
DG 20:3_20:3
ME142254
-
-
13.650778
-
1-(13Z-docosenoyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapen...
DG 22:1_22:5
ME142310
-
-
14.7029505
-
Dihydroxyacetone (glycerone)
Dihydroxyacetone
ME142071
-
C00184
1.2743208
-
Ellagic acid
Ellagic acid
ME142018
-
C10788
0.7126449
-
Ellagic acid - 3.0870278
Ellagic acid
ME142328
-
C10788
3.0870278
-
Embelin
Embelin
ME142143
-
-
8.9943075
-
Embelin - 13.489656
Embelin
ME142235
-
-
13.489656
-
Embelin - 13.636872
Embelin
ME142252
-
-
13.636872
-
Embelin - 14.135789
Embelin
ME142278
-
-
14.135789
-
Embelin - 14.246171
Embelin
ME142294
-
-
14.246171
-
Embelin - 14.705376
Embelin
ME142311
-
-
14.705376
-
Embelin - 9.617185
Embelin
ME142154
-
-
9.617185
-
Fexofenadine
Fexofenadine
ME142176
-
C06999
10.659602
-
Gemfibrozil M2
Gemfibrozil
ME142199
-
-
11.33377
-
Gln Trp Gln
Gln-Trp-Gln
ME142157
-
-
9.6747
-
Glucoheptonic acid
Glucoheptonic acid
ME142091
-
-
3.6418886
-
D-Glucose
Glucose
ME142095
-
C00031
3.6702254
-
Glu Tyr Thr
Glu-Tyr-Thr
ME142351
-
-
10.655648
-
Glycoursodeoxycholic acid
Glycoursodeoxycholic acid
ME142140
-
-
8.627424
-
Glycoursodeoxycholic acid - 8.836754
Glycoursodeoxycholic acid
ME142341
-
-
8.836754
-
Hexacosanedioic acid
Hexacosanedioic acid
ME142304
-
-
14.549026
-
Hippuric acid
Hippuric acid
ME142108
-
C01586
4.3385744
-
Histidine
Histidine
ME142043
-
C00135
0.8347747
-
Indole
Indole
ME142089
-
C00463
3.6428
-
Indoxylsulfuric acid
Indoxyl sulfate
ME142106
-
-
4.1105456
-
Isoacitretin
Isoacitretin
ME142178
-
-
10.573217
-
Isoacitretin - 10.747422
Isoacitretin
ME142184
-
-
10.747422
-
Isoacitretin - 10.9078665
Isoacitretin
ME142187
-
-
10.9078665
-
Isoacitretin - 14.180219
Isoacitretin
ME142273
-
-
14.180219
-
Isoarachidic acid
Isoarachidic acid
ME142391
-
-
14.715561
-
ISOEUGENITOL
Isoeugenitol
ME142322
-
-
0.8965298
-
Isoleucine
Isoleucine
ME142074
-
C00407
2.0716634
-
KOBUSONE
Kobusone
ME142146
-
-
8.99445
-
Lactic acid
Lactic acid
ME142050
-
C00186
0.89742315
-
Lauric acid
Lauric acid
ME142211
-
C02679
11.902032
-
Leucine
Leucine
ME142077
-
C00123
2.303852
-
Loroxanthin ester/ Loroxanthin dodecenoate
Loroxanthin dodecenoate
ME142286
-
-
14.050976
-
Loroxanthin ester/ Loroxanthin dodecenoate - 14.56...
Loroxanthin dodecenoate
ME142313
-
-
14.5606
-
Lys Trp Arg
Lys-Trp-Arg
ME142369
-
-
12.740759
-
Met His Lys
Met-His-Lys
ME142331
-
-
6.4232845
-
methyl 9,11-epidioxy-12,15-dihydroperoxy-5,7,13-ei...
Methyl 9,11-epidioxy-12,15-dihydroperoxy-5,7,13-eicosatrienoate
ME142142
-
-
8.990774
-
Murocholic acid
Murideoxycholic acid
ME142225
-
-
12.819016
-
Murocholic acid - 10.139921
Murideoxycholic acid
ME142347
-
-
10.139921
-
Murocholic acid - 12.997159
Murideoxycholic acid
ME142227
-
-
12.997159
-
O-Desmethylnaproxen
O-Desmethylnaproxen
ME142076
-
-
2.2713454
-
O-Desmethylnaproxen - 2.6897879
O-Desmethylnaproxen
ME142079
-
-
2.6897879
-
Panaxytriol
Panaxytriol
ME142214
-
-
12.057284
-
Phenol
Phenol
ME142100
-
C00146
3.8402092
-
Phosphoglycolic acid
Phosphoglycolic acid
ME142083
-
C00988
3.1699057
-
Phosphoglycolic acid - 3.6416552
Phosphoglycolic acid
ME142092
-
C00988
3.6416552
-
PRISTIMEROL
Pristimerol
ME142272
-
-
14.15772
-
Proline
Proline
ME142061
-
C00148
0.9706227
-
PROTOVERATRINE A
Protoveratrine A
ME142047
-
-
0.84864813
-
Purine
Purine
ME142019
-
C00465
0.76929986
-
Purine - 1.1767727
Purine
ME142065
-
C00465
1.1767727
-
Methylglyoxal
Pyruvaldehyde
ME142049
-
C00546
0.8967081
-
5Z,11Z,14Z-eicosatrienoic acid
Sciadonic acid
ME142261
-
-
13.766287
-
Ser His His
Ser-His-His
ME142148
-
-
8.995068
-
L-Serine
Serine
ME142044
-
C00065
0.8373182
-
Stearic acid
Stearic acid
ME142307
-
C01530
14.518841
-
Teasterone
Teasterone
ME142257
-
-
13.667785
-
Teasterone - 13.719101
Teasterone
ME142260
-
-
13.719101
-
Teasterone - 14.130692
Teasterone
ME142271
-
-
14.130692
-
Testosterone sulfate
Testosterone sulfate
ME142129
-
C00535
7.008918
-
Tetrahydrofuran
Tetrahydrofuran
ME142099
-
-
3.7447748
-
TG(16:1(9Z)/18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z))[...
TG 16:1(9Z)/18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)
ME142287
-
-
14.147302
-
TG(16:1(9Z)/18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z))[...
TG 16:1(9Z)/18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)*
ME142305
-
-
14.429592
-
TG(16:1(9Z)/18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z))[...
TG 16:1(9Z)/18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)*
ME142314
-
-
14.669076
-
thyrotropin releasing hormone
Thyrotropin releasing hormone
ME142144
-
-
8.994382
-
Tryptophan
Tryptophan
ME142090
-
C00078
3.6429675
-
Tyr Arg Leu
Tyr-Arg-Leu
ME142344
-
-
10.03203
-
Uric acid
Uric acid
ME142068
-
C00366
1.229638
-
Uridine
Uridine
ME142066
-
C00299
1.2050902
-
Val Arg Phe
Val-Arg-Phe
ME142196
-
-
11.378499
-
17a-Ethynylestradiol 2-glucuronide
-
ME142131
-
-
7.009637
-
19-hydroxy-17-oxoandrost-5-en-3-beta-yl sulfate
-
ME142330
-
-
5.905695
-
1alpha,18-dihydroxyvitamin D_3 / 1alpha,18-dihydro...
-
ME142220
-
-
12.621854
-
1alpha,25-dihydroxy-11alpha-phenylvitamin D3 / 1al...
-
ME142288
-
-
14.155463
-
1alpha,25-dihydroxy-11alpha-phenylvitamin D3 / 1al...
-
ME142317
-
-
14.712189
-
1alpha,25-dihydroxy-24-oxovitamin D_3 / 1alpha,25-...
-
ME142356
-
-
10.758289
-
1alpha,25-dihydroxy-26,27-dimethyl-22-oxavitamin D...
-
ME142259
-
-
13.654648
-
1alpha,25-dihydroxy-26,27-dimethyl-22-oxavitamin D...
-
ME142381
-
-
13.704973
-
1alpha,25-dihydroxy-26,27-dimethyl-22-oxavitamin D...
-
ME142262
-
-
13.802342
-
1alpha,25-dihydroxy-2beta-(5-hydroxypentoxy)vitami...
-
ME142221
-
-
12.667334
-
1alpha,25-dihydroxy-2beta-(5-hydroxypentoxy)vitami...
-
ME142379
-
-
13.600336
-
20alpha-Dihydroprogesterone glucuronide
-
ME142064
-
-
1.1874703
-
(22S)-1alpha,22,25-trihydroxy-23,24-tetradehydro-2...
-
ME142378
-
-
13.655957
-
2-amino-4'-hydroxy-Propiophenone
-
ME142081
-
-
3.1699252
-
2-Hydroxy-3-(4-methoxyethylphenoxy)-propanoic acid
-
ME142135
-
-
7.7239304
-
2-ISOPRENYL-3-HYDROXY-5-METHYL-a-PYRONE
-
ME142139
-
-
8.324255
-
3a,7b,12a-Trihydroxyoxocholanyl-Glycine
-
ME142340
-
-
7.612149
-
4'-Apo-3,4-didehydrolycopene/ (4-Apo-3',4'-didehyd...
-
ME142370
-
-
12.782845
-
5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethyl-Pen...
-
ME142156
-
-
9.636348
-
6b,11b,16a,17a,21-Pentahydroxypregna-1,4-diene-3,2...
-
ME142346
-
-
10.10528
-
8R-hydroxy-9Z-octadecenoic acid
-
ME142368
-
-
12.159918
-
B-ureidoisobutyric acid
-
ME142403
-
-
0.8756419
-
D1-2-Hydroxymethylethisterone
-
ME142192
-
-
11.148835
-
D1-2-Hydroxymethylethisterone - 11.279384
-
ME142198
-
-
11.279384
-
D1-2-Hydroxymethylethisterone - 11.426857
-
ME142201
-
-
11.426857
-
D1-2-Hydroxymethylethisterone - 11.506317
-
ME142206
-
-
11.506317
-
gamma-Hydroxyphenylbutazone glucuronide
-
ME142152
-
-
9.575926
-
isoamyl nitrite
-
ME142063
-
-
1.179514
-
Isoquinoline N-oxide
-
ME142125
-
-
5.7576704
-
Monensin
-
ME142388
-
-
14.194487
-
N-gamma-Acetyl-N-2-formyl-5-methoxykynurenamine
-
ME142107
-
-
4.323464
-
O-BENZYL-l-SERINE
-
ME142155
-
-
9.631643
-
Pregnanolone sulfate
-
ME142339
-
-
7.2025857
-
Sodium tetradecyl sulfate
-
ME142185
-
-
10.853775
-
TRIDESACETOXYKHIVORIN
-
ME142364
-
-
11.214489
-
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