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Return to study ST003144 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
erucamide
13Z-Docosenamide
ME822834
-
-
5.554299478
-
1,4-beta-D-Glucan
1,4-beta-D-Glucan
ME822780
-
C00760_C00760
3.888954358
-
1H-Indole-3-acetamide
1H-Indole-3-acetamide
ME822591
-
C02693
7.824492624
-
1-Methylhistidine
1-Methylhistidine
ME823013
-
C01152
12.64478714
-
(S)C(S)S-S-Methylcysteine sulfoxide
2-amino-3-methanesulfinylpropanoic acid
ME822960
-
-
11.8462689
-
2-Aminoacrylic acid
2-Aminoacrylic acid
ME822898
-
C02218
14.81962534
-
DL-2-Aminooctanoic acid
2-Aminocaprylic acid
ME823042
-
-
13.32876401
-
2-Aminoheptanoate
2-Aminoheptanoic acid
ME823022
-
-
13.34662425
-
2-Aminonaphthalene
2-Aminonaphthalene
ME822629
-
C02227
11.59754945
-
2-Hydroxyacetaminophen sulfate
2-Hydroxyacetaminophen sulfate
ME823048
-
-
17.3560628
-
2-Oxoarginine
2-Oxoarginine
ME822985
-
C03771
14.1505134
-
(2R,3S)-Piscidic acid
(2R,3S)-Piscidic acid
ME822634
-
-
12.70538839
-
3-Amino-2-piperidone
3-Amino-2-piperidone
ME822961
-
-
11.10256996
-
3-Butynoate
3-Butynoic acid
ME822955
-
C06144
13.70880316
-
3-deoxy-D-galactose
3-Deoxygalactose
ME823002
-
-
12.31310131
-
3-Deoxyvitamin D3
3-Deoxyvitamin D3
ME822868
-
-
5.423342306
-
3-(Dimethylamino)propyl benzoate
3-(Dimethylamino)propyl benzoate
ME822670
-
C14168
8.136739323
-
3-Hydroxyanthranilic acid
3-Hydroxyanthranilic acid
ME823026
-
C00632
8.725290708
-
Prenol
3-Methyl-2-buten-1-ol
ME822963
-
C01390
20.21218846
-
Dihydrobiopterin
4a-Carbinolamine tetrahydrobiopterin
ME823057
-
C02953_C00268
9.829220371
-
4alpha-Hydroxymethyl-4beta-methyl-5alpha-cholesta-...
4alpha-Hydroxymethyl-4beta-methyl-5alpha-cholesta-8,24-dien-3beta-ol
ME822877
-
-
3.995123287
-
4-Guanidinobutanoic acid
4-Guanidinobutanoic acid
ME822965
-
C01035
15.08198408
-
4-Heptyloxyphenol
4-Heptyloxyphenol
ME822699
-
C14236
27.90823677
-
4-Imidazolone-5-propionic acid
4-Imidazolone-5-propionic acid
ME823009
-
C03680
10.78341466
-
4-Methoxyglucobrassicin
4-Methoxyglucobrassicin
ME822763
-
C08423
15.19461649
-
4-Oxoproline
4-Oxo-proline
ME822976
-
C01877
14.55440069
-
5-Acetamidovalerate
5-Acetamidovaleric acid
ME823017
-
C03087
12.31214691
-
5-Aminolevulinic acid
5-Amino-levulinic acid
ME822979
-
C00430
14.32778166
-
5-Hydroxy-L-tryptophan
5-Hydroxy-tryptophan
ME822632
-
C00643_C01017
10.82068408
-
5'-Methylthioadenosine
5'-Methylthioadenosine
ME822637
-
C00170
7.833537112
-
6-Hydroxyl-1,6-dihydropurine ribonucleoside
6-Hydroxyl-1,6-dihydropurine ribonucleoside
ME822599
-
C04583
14.46696075
-
8-Amino-7-oxononanoate
8-Amino-7-oxononanoic acid
ME823077
-
C01092
11.82986088
-
Adenine
Adenine
ME822974
-
C00147
9.678808465
-
Ala/Ala/Ala
Ala-Ala-Ala
ME823074
-
-
10.12350922
-
Ala/Ala/Ser
Ala-Ala-Ser
ME823075
-
-
11.7955891
-
Ala/Arg
Ala-Arg
ME823088
-
-
16.40239913
-
Ala/Asn
Ala-Asn
ME823015
-
-
11.68484405
-
Ala/Asn/Asp
Ala-Asn-Asp
ME822641
-
-
15.16218866
-
Ala/Asn/Pro
Ala-Asn-Pro
ME822676
-
-
12.20830052
-
Ala/Asp/Pro
Ala-Asp-Pro
ME822672
-
-
14.39838813
-
Ala/Asp/Ser
Ala-Asp-Ser
ME822611
-
-
15.37216292
-
Ala/Gly/Pro
Ala-Gly-Pro
ME822607
-
-
12.42549411
-
Ala/Gly/Tyr
Ala-Gly-Tyr
ME822720
-
-
9.915649137
-
Ala/His
Ala-His
ME823061
-
-
11.19832295
-
Ala/Lys
Ala-Lys
ME823086
-
-
16.46834806
-
Alanine
Alanine
ME822900
-
C00041_C00133
14.69460336
-
Ala/Pro
Ala-Pro
ME823031
-
-
11.33094165
-
Ala/Ser/Ser
Ala-Ser-Ser
ME823076
-
-
15.23850277
-
Allysine
Allysine
ME822987
-
C01475_C04076
12.44999807
-
Aloesin
Aloesin
ME822787
-
C08994
13.90479519
-
N1-(alpha-D-ribosyl)-5,6-dimethyl-benzimidazole
alpha-Ribazole
ME822718
-
C05775
11.24967391
-
Amidosulfuron
Amidosulfuron
ME823068
-
C10933
13.07669487
-
Aminoadipic acid
Aminoadipic acid
ME822989
-
C00956
11.13283355
-
Adenosine monophosphate
AMP
ME822600
-
D06299_C00020
13.46291326
-
N-(L-Arginino)succinate
Argininosuccinic acid
ME822617
-
C03406
16.51340777
-
Arg/Tyr
Arg-Tyr
ME822746
-
-
14.12832938
-
Asn/Arg
Asn-Arg
ME822624
-
-
16.41370943
-
Asn/Asn
Asn-Asn
ME823033
-
-
13.51940069
-
Asn/Asp
Asn-Asp
ME823029
-
-
15.3639368
-
Asn/His
Asn-His
ME822601
-
-
12.96199721
-
Asn/Pro
Asn-Pro
ME823066
-
-
13.13664946
-
Aspartylglycosamine
Aspartylglycosamine
ME822679
-
C04540
15.83342631
-
Asp/Gly/Arg
Asp-Gly-Arg
ME822683
-
-
17.66892208
-
Asp/Gly/His
Asp-Gly-His
ME822669
-
-
14.30625256
-
Asp/Pro
Asp-Pro
ME823060
-
-
15.03100909
-
Asp/Pro/Ser
Asp-Pro-Ser
ME822673
-
-
13.68534307
-
2,4-pentadienoic acid
beta-Vinyl acrylic acid
ME822975
-
-
13.92909436
-
Biotin
Biotin
ME822603
-
C00120
8.612773403
-
Biotin amide
Biotin amide
ME822606
-
C01893
10.58241664
-
Brassicanal A
Brassicanal A
ME822630
-
C11048
22.84108993
-
Cancentrine
Cancentrine
ME822886
-
C09370
10.40952422
-
Palmitoylcarnitine
CAR 16:0
ME822839
-
C02990
7.793585492
-
Heptadecanoyl carnitine
CAR 17:0
ME822845
-
-
4.710527061
-
Stearoylcarnitine
CAR 18:0
ME822855
-
-
7.780069634
-
Oleoylcarnitine
CAR 18:1
ME822854
-
-
7.784283617
-
Linoleyl carnitine
CAR 18:2
ME822853
-
-
4.647848379
-
Acetylcarnitine
CAR 2:0
ME823078
-
C02571
17.94015867
-
Propionylcarnitine
CAR 3:0
ME822621
-
C03017
9.828275164
-
Butyrylcarnitine
CAR 4:0
ME822656
-
C02862
8.903245375
-
2-Methylbutyroylcarnitine
CAR 4:0;2Me
ME822686
-
-
8.232476785
-
Hydroxybutyrylcarnitine
CAR 4:0;OH
ME822657
-
-
11.42315506
-
hydroxyisovaleroyl carnitine
CAR 4:0;OH,Me
ME822687
-
-
10.66776813
-
Hydroxyhexanoycarnitine
CAR 6:0;OH
ME822706
-
-
9.223297355
-
Carnitine
Carnitine
ME823023
-
C00318_C00487
13.26306821
-
CDP-glucose
CDP-glucose
ME822747
-
C00501
13.4712416
-
CDP-ribitol
CDP-ribitol
ME822727
-
C00789
16.16235752
-
N-Palmitoylsphingosine
Cer 18:1;O2/16:0
ME822885
-
C00195
3.917991938
-
Cer(d40:1)
Cer 40:1;O2
ME822906
-
-
5.158623548
-
Cer(d40:2)
Cer 40:2;O2
ME822902
-
-
3.997840602
-
Cer(d42:2)
Cer 42:2;O2
ME822915
-
C00195
3.906830956
-
Cerulenin
Cerulenin
ME822671
-
C12058
10.28101448
-
Chlorambucil
Chlorambucil
ME822719
-
C06900
13.87796641
-
Chorismate
Chorismic acid
ME822592
-
C00251
7.955508907
-
cis-1,2-Dihydroxy-1,2-dihydrodibenzothiophene
cis-1,2-dihydroxy-1,2-dihydrodibenzothiophene
ME822662
-
C06721
13.11404287
-
Citrulline
Citrulline
ME822993
-
C00327
15.84241763
-
Creatine
Creatine
ME822957
-
C00300
14.59756327
-
Creatinine
Creatinine
ME822956
-
C00791
9.787907125
-
Cys/Gly/Pro
Cys-Gly-Pro
ME822608
-
-
10.54258899
-
Deoxyguanidinoproclavaminic acid
Deoxyamidinoproclavaminic acid
ME823073
-
C06656
14.8812462
-
Deoxycytidine
Deoxycytidine
ME823056
-
C00881
13.37837896
-
DG(36:2)
DG 36:2
ME822895
-
C00165
3.868847033
-
DG(44:4)
DG 44:4
ME822941
-
-
27.52082284
-
Diaminopimelic acid
Diaminopimelic acid
ME823019
-
C00666
14.13761424
-
Diethanolamine
Diethanolamine
ME822954
-
C06772
14.72358774
-
Dihydrozeatin-O-glucoside
Dihydrozeatin-O-glucoside
ME822757
-
C16448
10.81867051
-
Dimethylethanolamine
Dimethylethanolamine
ME822953
-
C04308
17.26578741
-
Maleic acid homopolymer
Dimethyl maleate
ME823010
-
C00922
13.55812032
-
dIMP
dIMP
ME822598
-
C06196
14.37025314
-
diuron
Diuron
ME823049
-
-
12.98369873
-
N2-(D-1-Carboxyethyl)-L-arginine
D-Octopine
ME823084
-
C04137
17.10234396
-
Dopa
DOPA
ME823052
-
C00355
7.854020835
-
4-(Trimethylammonio)but-2-enoate
(E)-4-(Trimethylammonio)but-2-enoate
ME823016
-
C04114
10.74992633
-
Ectoine
Ectoine
ME822983
-
C06231
12.94267533
-
Epinephrine
Epinephrine
ME823058
-
C00788
13.33111504
-
Fagomine
Fagomine
ME822995
-
C10144
12.12772463
-
Ferulic acid 4-sulfate
Ferulic acid 4-sulfate
ME822593
-
-
14.51163005
-
gamma-Aminobutyric acid
gamma-Aminobutyric acid
ME822958
-
C00334
12.20486985
-
N2-gamma-Glutamylglutamine
gamma-Glutamylglutamine
ME822610
-
C05283
14.25152064
-
Gamma glutamyl ornithine
gamma-Glutamylornithine
ME822619
-
-
13.20335157
-
Gamma-Glutamyl-Se-methylselenocysteine
gamma-Glutamyl-Se-methylselenocysteine
ME823072
-
C05695
15.83070887
-
Gentisin
Gentisin
ME822711
-
C10066
14.67877772
-
Glu/Ala/Pro
Glu-Ala-Pro
ME822700
-
-
14.24399177
-
Glu/Ala/Ser
Glu-Ala-Ser
ME822645
-
-
14.50973818
-
Glu/Ala/Thr
Glu-Ala-Thr
ME822678
-
-
13.22123329
-
Glu/Ala/Val
Glu-Ala-Val
ME822704
-
-
10.77604575
-
Glu/Arg
Glu-Arg
ME822654
-
-
16.44854309
-
Glu/Asp/Val
Glu-Asp-Val
ME822722
-
-
15.4892334
-
2-Amino-2-deoxy-D-gluconate
Glucosaminic acid
ME822997
-
C03752
12.17722442
-
Glu/Glu/Pro
Glu-Glu-Pro
ME822744
-
-
16.41950427
-
Glu/Lys
Glu-Lys
ME822653
-
C04700
16.6871123
-
Glu/Met/Thr
Glu-Met-Thr
ME822728
-
-
11.96158326
-
Glutamic acid
Glutamic acid
ME822980
-
C00217_C00025_C00302
14.38103499
-
Glutamine
Glutamine
ME822962
-
C00064_C00819
14.96214101
-
Gly/Arg
Gly-Arg
ME823041
-
-
16.95478172
-
Gly/His
Gly-His
ME823028
-
-
5.143929213
-
Gly/Leu
Gly-Leu
ME823038
-
C02155
5.402618306
-
Guanidoacetic acid
Guanidoacetic acid
ME822899
-
C00581
15.69795097
-
Histidine trimethylbetaine
Hercynine
ME823064
-
C05575
12.26811593
-
Heterodendrin
Heterodendrin
ME822646
-
C08332
12.72973264
-
His/His
His-His
ME822668
-
-
11.21816501
-
His/Leu
His-Leu
ME822675
-
C05010
5.162017131
-
Histidine
Histidine
ME823011
-
C06419_C00135
15.72048934
-
Homocitrulline
Homocitrulline
ME823021
-
C02427
15.11630377
-
Homoglutathione
Homoglutathione
ME822644
-
C04544
12.63944056
-
Hypoxanthine
Hypoxanthine
ME822972
-
C00262
10.18234316
-
Ile/Ala
Ile-Ala
ME823082
-
-
12.77143629
-
Ile/Ala/Ser
Ile-Ala-Ser
ME822685
-
-
13.78978267
-
Ile/Arg
Ile-Arg
ME822691
-
-
12.37619907
-
Ile/Cys/Gly
Ile-Cys-Gly
ME822652
-
-
10.96336181
-
Ile/Cys/Phe
Ile-Cys-Phe
ME822776
-
-
8.793594163
-
Ile/Gly/Lys
Ile-Gly-Lys
ME822733
-
-
13.05296258
-
Ile/Lys
Ile-Lys
ME822690
-
-
12.48286489
-
Ile/Lys/Pro
Ile-Lys-Pro
ME822768
-
-
21.35076346
-
Ile/Pro
Ile-Pro
ME822648
-
-
10.21655475
-
Ile/Ser
Ile-Ser
ME823083
-
-
7.9117345
-
Ile/Thr
Ile-Thr
ME822622
-
-
7.853337479
-
Ile/Tyr
Ile-Tyr
ME822741
-
-
8.442244057
-
Ile/Val
Ile-Val
ME822659
-
-
4.821680341
-
Indole
Indole
ME823047
-
C00463
11.60625689
-
Inosine
Inosine
ME822595
-
C00294
10.87860603
-
Inositol cyclic phosphate
Inositol cyclic phosphate
ME822991
-
C04299
15.63793333
-
Isoquinoline
Isoquinoline
ME823091
-
C06323
8.804155896
-
Kievitone hydrate
Kievitone hydrate
ME822809
-
C02549
10.21604419
-
Kynurenic acid
Kynurenic acid
ME822628
-
C01717
8.205644246
-
Kynurenine
Kynurenine
ME822594
-
C00328
10.90574619
-
Lacto-N-tetraose
Lacto-N-tetraose
ME822861
-
C06371
16.53134562
-
Lenticin
Lenticin
ME822717
-
C09213
8.804277416
-
Leucine
Leucine
ME822994
-
C16439_C00123_C01570
10.89089994
-
Leu/Leu
Leu-Leu
ME822688
-
C11332
4.781818531
-
Linatine
Linatine
ME822609
-
C05939
11.00862802
-
Longifolonine
Longifolonine
ME822760
-
C09569
7.813983016
-
LysoPC(16:0)
LPC 16:0
ME822849
-
C04102_C04230
7.808993877
-
LysoPC(16:1)
LPC 16:1
ME822846
-
C04230
4.773389275
-
LysoPC(18:0)
LPC 18:0
ME822866
-
C04230
4.658540599
-
LysoPC(18:1)
LPC 18:1
ME822864
-
C03916_C04230
7.804374065
-
LysoPC(18:2)
LPC 18:2
ME822863
-
C04100_C04230
4.730816173
-
LysoPC(18:3)
LPC 18:3
ME822862
-
C04230
4.774164811
-
LysoPC(20:0)
LPC 20:0
ME822876
-
C04230
4.558170223
-
LysoPC(20:3)
LPC 20:3
ME822875
-
C04230
3.917133886
-
LysoPC(O-16:1)
LPC O-16:1
ME822848
-
-
4.709605908
-
LysoPC(O-18:0)
LPC O-18:0
ME822867
-
C04317
4.702245962
-
LysoPC(O-18:1)
LPC O-18:1
ME822865
-
-
4.714836742
-
LysoPE(18:0)
LPE 18:0
ME822841
-
-
4.751943655
-
LysoPE(18:1)
LPE 18:1
ME822840
-
-
7.803727689
-
LysoPE(20:0)
LPE 20:0
ME822857
-
-
4.71491289
-
LysoPE(20:4)
LPE 20:4
ME822852
-
-
7.802761283
-
LysoPE(22:4)
LPE 22:4
ME822871
-
-
4.559039874
-
LysoPE(22:5)
LPE 22:5
ME822870
-
-
4.579546435
-
LysoPE(22:6)
LPE 22:6
ME822869
-
-
4.600075418
-
1-Stearoylglycerophosphoserine
LPS 18:0
ME822847
-
-
4.248315907
-
Lys/Ala/Gly
Lys-Ala-Gly
ME822660
-
-
16.2620243
-
Lys/Asn
Lys-Asn
ME822623
-
-
16.46386151
-
Lys/Gly
Lys-Gly
ME823040
-
-
16.70350258
-
Lys/His
Lys-His
ME822680
-
-
16.1931183
-
Lysine
Lysine
ME822999
-
C00739_C00047
22.84977293
-
Lys/Phe
Lys-Phe
ME822743
-
-
11.8510833
-
Lys/Pro
Lys-Pro
ME822651
-
-
15.22917185
-
Lys/Ser
Lys-Ser
ME823087
-
-
16.5697906
-
Lys/Thr
Lys-Thr
ME822625
-
-
15.82586175
-
Lys/Thr/Ser
Lys-Thr-Ser
ME822708
-
-
15.31507499
-
Lys/Trp/Gly
Lys-Trp-Gly
ME822791
-
-
12.99241791
-
Lys/Val/Gly
Lys-Val-Gly
ME822707
-
-
13.81819748
-
Mannitol
Mannitol
ME823003
-
C00392_C01489
13.89425338
-
Met/Ala/Gly
Met-Ala-Gly
ME822618
-
-
12.63559492
-
Methionine
Methionine
ME822967
-
C00073_C01733
11.55083151
-
Methyl 2-diazoacetamidohexonate
Methyl 2-diazoacetamidohexonate
ME823065
-
C01223
14.14419789
-
Met/Phe/Gly
Met-Phe-Gly
ME822756
-
-
11.58723305
-
Muramic acid
Muramic acid
ME823080
-
C06470
14.19292934
-
Murrayanine
Murrayanine
ME822713
-
C09228
22.83991008
-
N(6)-Methyllysine
N(6)-Methyllysine
ME823025
-
C02728
22.32658606
-
Ne,Ne dimethyllysine
N(6),N(6)-Dimethyl-lysine
ME823044
-
C05545 _C05545
21.3086264
-
N6,N6,N6-Trimethyl-L-lysine
N-6-Trimethyllysine
ME823090
-
C03793
21.61856437
-
N-acetyl-L-2-aminoadipate(2-)
N-Acetyl-2-aminoadipic acid
ME823030
-
C12986
12.13286625
-
N-Acetyl-b-glucosaminylamine
N-Acetyl-beta-glucosaminylamine
ME823039
-
C01239
13.04143739
-
N-Acetyl-D-fucosamine
N-Acetyl-D-fucosamine
ME823035
-
C15480
11.48940459
-
N-Acetyl-D-glucosamine
N-Acetylglucosamine
ME823036
-
C02711_C03878_C00140_C03136
12.01479104
-
N-Acetyllactosamine
N-Acetyllactosamine
ME822730
-
C00611
13.74773359
-
N-Acetylvanilalanine
N-Acetylvanilalanine
ME822667
-
-
4.567790633
-
Neohesperidose
Neohesperidose
ME822684
-
C08244
15.97862382
-
Neuraminic acid
Neuraminic acid
ME823081
-
C06469
16.75978228
-
N'-Formylkynurenine
N-Formylkynurenine
ME822633
-
C02406_C02700_C15605
12.06287776
-
N-Formyl-L-methionine
N-Formylmethionine
ME822988
-
C03145
14.61651532
-
Niacinamide
Niacinamide
ME823007
-
C00153
7.86431716
-
N-Ribosylhistidine
N-Ribosylhistidine
ME822639
-
-
15.27023811
-
N-Sulfo-D-glucosamine
N-Sulfo-glucosamine
ME822998
-
C01075
16.99040227
-
Octylamine
Octylamine
ME823046
-
C01740
14.70912607
-
Ophthalmic acid
Ophthalmic acid
ME822643
-
-
13.11896715
-
Ornithine
Ornithine
ME822970
-
C00077_C01602_C00515
22.07321008
-
Otonecine
Otonecine
ME823069
-
C10356
11.88681136
-
Oxidized glutathione
Oxidized glutathione
ME822816
-
C00127
17.00306283
-
Palmitoylethanolamide
Palmitoyl-EA
ME822782
-
C16512
4.596925111
-
Pantothenic acid
Pantothenic acid
ME823079
-
C00864
8.432436721
-
PC(29:0)
PC 29:0
ME822889
-
C00157
3.748359955
-
PC(29:1)
PC 29:1
ME822888
-
C00157
3.758719623
-
PC(32:1)
PC 32:1
ME822904
-
C00157
4.122120821
-
PC(34:2)
PC 34:2
ME822914
-
C00157
5.61235675
-
PC(35:6)
PC 35:6
ME822919
-
-
3.957650273
-
PC(36:2)
PC 36:2
ME822927
-
C00157
4.060112234
-
PC(36:3)
PC 36:3
ME822926
-
C00157
4.572065065
-
PC(36:4)
PC 36:4
ME822925
-
C00157
4.061969014
-
PC(38:4)
PC 38:4
ME822938
-
C00157
4.017985932
-
PC(38:5)
PC 38:5
ME822936
-
C00157
4.024632045
-
PC(38:6)
PC 38:6
ME822935
-
C00157
4.032408603
-
PC(40:5)
PC 40:5
ME822948
-
C00157
4.007979911
-
PC(40:6)
PC 40:6
ME822947
-
C00157
3.999924626
-
PC(40:7)
PC 40:7
ME822946
-
C00157
4.021564529
-
PC(O-16:0)
PC O-16:0
ME822850
-
C13903
4.784040586
-
PC(P-38:4)
PC P-38:4
ME822937
-
C00157
4.027336621
-
PE(34:3)
PE 34:3
ME822894
-
C00350
3.803807411
-
PE(35:0)
PE 35:0
ME822907
-
C00350
5.098462111
-
PE(36:4)
PE 36:4
ME822910
-
C00350
3.977478584
-
PE(37:1)
PE 37:1
ME822916
-
C00350
4.105135021
-
PE(38:1)
PE 38:1
ME822922
-
C00350
4.098829687
-
PE(42:2)
PE 42:2
ME822942
-
C00350
13.93832342
-
PE(43:4)
PE 43:4
ME822949
-
-
4.002547853
-
Pencycuron
Pencycuron
ME822786
-
C11012
11.25486481
-
PE(P-20:0)
PE P-20:0
ME822856
-
-
4.670256293
-
PE(P-36:2)
PE P-36:2
ME822912
-
C00350
4.068503962
-
PE(P-36:4)
PE P-36:4
ME822909
-
C00350
3.978176222
-
PE(P-38:3)
PE P-38:3
ME822921
-
C00350
3.953666396
-
PE(P-38:5)
PE P-38:5
ME822920
-
C00350
3.952610942
-
PE(P-38:6)
PE P-38:6
ME822918
-
C00350
3.946484962
-
PE(P-40:5)
PE P-40:5
ME822931
-
C00350
3.93141008
-
Phe/Arg
Phe-Arg
ME822745
-
-
13.07238495
-
Phe/Asn
Phe-Asn
ME822697
-
-
8.064674397
-
Phe/Cys/Arg
Phe-Cys-Arg
ME822777
-
-
14.27833716
-
Phe/Gly/His
Phe-Gly-His
ME822762
-
-
7.887631508
-
Phenylalanine
Phenylalanine
ME823050
-
C00079_C02265
10.21736573
-
Phosphocreatine
Phosphocreatine
ME822952
-
C02305
14.79474628
-
Phosphophosphinate
Phosphophosphinate
ME823004
-
C12022
13.13572071
-
PI(32:1)
PI 32:1
ME822911
-
C00626
3.771431441
-
Pipecolic acid
Pipecolic acid
ME822986
-
C00408
11.19056277
-
Pro/His
Pro-His
ME822638
-
-
12.0064337
-
Proline
Proline
ME822977
-
C00148_C00763
12.77393817
-
Pro/Ser
Pro-Ser
ME823032
-
-
12.62905866
-
Prosopinine
Prosopinine
ME822759
-
-
5.890477063
-
Prosulfuron
Prosulfuron
ME822737
-
C10950
11.58827066
-
PS(34:0)
PS 34:0
ME822903
-
-
3.766129574
-
PS(42:10)
PS 42:10
ME822945
-
-
3.723973391
-
Pyridoxine
Pyridoxine
ME823027
-
C00314
8.253588152
-
Quinaldic acid
Quinaldic acid
ME822627
-
C06325
7.796246652
-
Resistomycin
Resistomycin
ME822827
-
C12080
12.11504415
-
Ribitol
Ribitol
ME822971
-
C01904_C00474_C00379
12.95138597
-
Rugosinone
Rugosinone
ME822783
-
C09634
13.18397666
-
Salicyluric beta-D-glucuronide
Salicyluric glucuronide
ME822739
-
-
14.74219007
-
Ser/Arg
Ser-Arg
ME823089
-
-
16.50959856
-
Ser/His
Ser-His
ME823062
-
-
12.16102948
-
Serine
Serine
ME822901
-
C00740_C00065_C00716
15.65441573
-
Cysteineglutathione disulfide
S-Glutathionyl-cysteine
ME822702
-
C05526
16.66547981
-
Lactoylglutathione
S-Lactoylglutathione
ME822701
-
C03451
15.65676306
-
Slaframine
Slaframine
ME822674
-
C06185
10.13801344
-
SM(d32:1)
SM 32:1;O2
ME822890
-
-
7.759378257
-
SM(d33:1)
SM 33:1;O2
ME822892
-
-
7.753974349
-
SM(d34:1)
SM 34:1;O2
ME822897
-
C00550
7.742891306
-
SM(d34:2)
SM 34:2;O2
ME822896
-
-
7.750412972
-
SM(d35:1)
SM 35:1;O2
ME822908
-
-
7.735309954
-
SM(d36:1)
SM 36:1;O2
ME822913
-
C00550
4.333962095
-
SM(d37:1)
SM 37:1;O2
ME822917
-
-
7.691254031
-
SM(d38:1)
SM 38:1;O2
ME822924
-
C00550
7.67665398
-
SM(d38:2)
SM 38:2;O2
ME822923
-
C00550
4.283061288
-
SM(d39:1)
SM 39:1;O2
ME822930
-
-
7.644224466
-
SM(d39:2)
SM 39:2;O2
ME822928
-
-
7.675059099
-
SM(d40:1)
SM 40:1;O2
ME822934
-
C00550
4.384676829
-
SM(d40:2)
SM 40:2;O2
ME822933
-
-
4.286871218
-
SM(d40:3)
SM 40:3;O2
ME822932
-
C00550
7.662213184
-
SM(d41:2)
SM 41:2;O2
ME822940
-
-
4.305146834
-
SM(d42:1)
SM 42:1;O2
ME822944
-
-
7.609314024
-
SM(d42:3)
SM 42:3;O2
ME822943
-
-
4.739869652
-
SM(d43:1)
SM 43:1;O2
ME822951
-
-
7.541891127
-
SM(d43:2)
SM 43:2;O2
ME822950
-
C00550
7.575283625
-
Tecostanine
Tecostanine
ME822655
-
C09989
19.92718552
-
Temurin
Temurin
ME823055
-
-
9.471622076
-
Thiomorpholine 3-carboxylate
Thiomorpholine-3-carboxylic acid
ME822978
-
C03901
8.189969918
-
Thr/Ala/Pro
Thr-Ala-Pro
ME822677
-
-
15.24929734
-
Threonine
Threonine
ME822959
-
C00188_C00820
14.39229784
-
Thr/His
Thr-His
ME822604
-
-
11.25833274
-
Thr/Pro
Thr-Pro
ME823070
-
-
11.36159284
-
Thr/Ser
Thr-Ser
ME823020
-
-
11.88904184
-
Thr/Trp/Cys
Thr-Trp-Cys
ME822775
-
-
15.34237202
-
Thr/Trp/Pro
Thr-Trp-Pro
ME822811
-
-
7.972368927
-
Triacetin
Triacetin
ME823063
-
-
12.60834373
-
Triadimenol
Triadimenol
ME822716
-
C11127
15.53714329
-
tridecadienoic acid
Tridecadienoic acid
ME822703
-
-
6.236812517
-
Trp/Asn
Trp-Asn
ME822740
-
-
9.762293617
-
Trp/Cys/Arg
Trp-Cys-Arg
ME822812
-
-
8.604139414
-
Trp/Cys/Gly
Trp-Cys-Gly
ME822755
-
-
9.284314818
-
Tryptophan
Tryptophan
ME822631
-
C00525_C00806_C00078
11.61407393
-
Neotussilagine
Tussilagine
ME822613
-
C10411
10.46596493
-
Tyrosine
Tyrosine
ME823051
-
C01536_C00082_C06420
12.93450822
-
Val/Arg
Val-Arg
ME822661
-
-
13.63113819
-
Val/Asp
Val-Asp
ME823071
-
-
13.18788493
-
Val/Gly
Val-Gly
ME823018
-
-
9.019876037
-
Val/His
Val-His
ME822640
-
-
9.243653341
-
Valine
Valine
ME822966
-
C00183_C16436_C06417
11.32165868
-
Val/Pro
Val-Pro
ME822615
-
-
5.710655228
-
Serotinose
Vicianose
ME822650
-
C08245_C11535_C01625
14.39857504
-
Vulgaxanthin-II
Vulgaxanthin-II
ME822715
-
C08569
15.19512738
-
Xestoaminol C
Xestoaminol C
ME822734
-
-
11.49294423
-
(1,3-diphenylpropoxy)sulfonic acid
-
ME822738
-
-
16.55607685
-
1,6-Digalloyl-beta-D-glucopyranose
-
ME822805
-
C04101
14.65652603
-
19-hydroxy-1,1,1-trifluoro-10(Z)-nonadecen-2-one
-
ME822796
-
-
14.4848386
-
1-Deoxynojirimycin
-
ME822996
-
C16843_C10141
15.79800029
-
1-deoxyxylonojirimycin
-
ME822968
-
-
16.22162655
-
1-dimethylarsinoyl-octadecane
-
ME822819
-
-
4.252841806
-
1-(hexadecanoyl)-2-(8-[3]-ladderane-octanyl)-sn-gl...
-
ME822893
-
-
3.748488424
-
1-(Methylthio)-5-phenyl-1-penten-3-yne
-
ME822664
-
-
12.01256291
-
1-O-malyl-beta-D-glucose
-
ME822605
-
-
14.71244403
-
2-(4-sulfophenyl)butyrate
-
ME822597
-
-
13.78001758
-
2-Acetyl-1,5,6,7-tetrahydro-6-hydroxy-7-(hydroxyme...
-
ME823059
-
-
8.342768269
-
2-amino-2-deoxy-D-gluconate 6-phosphate
-
ME823000
-
-
11.96352867
-
2-amino-2-deoxyglucitol-6-phosphate
-
ME823005
-
-
14.66706263
-
2-amino-4-({1-[(carboxymethyl)-C-hydroxycarbonimid...
-
ME822851
-
-
12.93637531
-
2'-Deoxy-5-hydroxymethylcytidine-5'-triphosphate
-
ME822616
-
C11039
17.56392929
-
2-Hydroxy-6-ketononatrienedioate
-
ME823092
-
C12624
13.57589651
-
2-O-methyl cyclic 3-deoxy-D-arabino-heptulosonate ...
-
ME823037
-
-
16.10255352
-
2-p-Tolyl-5,6,7,8-tetrahydrobenzo[d]imidazo[2,1-b]...
-
ME822754
-
C11571
11.4273677
-
2-thiouridine
-
ME823054
-
-
14.93984112
-
3,3',7-Trihydroxy-4'-methoxyflavone
-
ME822752
-
C05902_C04293_C10038_C10098_C17059_C10058
16.99205743
-
3,4,5-trihydroxy-6-({4-hydroxy-2-methyl-6-[(3,4,5,...
-
ME822844
-
-
15.68719384
-
{[3,4,5-trihydroxy-6-(5-hydroxy-7-methoxy-4-oxo-2-...
-
ME822829
-
-
13.92614625
-
3,5-dibromocatechol
-
ME823006
-
-
27.47092748
-
3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-hydrox...
-
ME822666
-
-
13.13843183
-
3alpha,7alpha,12alpha-trihydroxy-27-carboxymethyl-...
-
ME822878
-
-
7.830212793
-
3-Amino-6H-dibenzo[b,d]pyran-6-one
-
ME822709
-
C14952
22.0675634
-
3-Oxo-carbofuran
-
ME822665
-
-
7.926884213
-
4-amino-4-deoxy-L-arabinose
-
ME822969
-
-
15.60217964
-
4-coumaroyl-3-hydroxyagmatine
-
ME822721
-
-
20.93035522
-
5-[5-(Methylthio)-4-penten-2-ynyl]-2-furanacrolein
-
ME822694
-
-
13.31481965
-
5-caC
-
ME822973
-
-
8.529110017
-
5-isobutylthioribose
-
ME823085
-
-
12.17539061
-
6-{4-[-3-[(3-carboxy-5,6-dihydroxycyclohex-3-en-1-...
-
ME822831
-
-
14.33135029
-
6-diazo-5-oxonorleucine
-
ME823012
-
-
14.79297252
-
6-Hydroxy-R-acenocoumarol
-
ME822784
-
-
12.6322982
-
7-(4-Hydroxy-3-methoxyphenyl)-5-methoxy-1-phenyl-3...
-
ME822821
-
-
10.88647299
-
7,8-H2pterin-6-ylmethyl-l-(4-aminophenyl)-1-deoxy-...
-
ME822837
-
-
8.536288477
-
7-chloro-2-(3,4-dimethoxyphenyl)-8-hydroxy-3,5,6-t...
-
ME822804
-
-
12.95668866
-
8-(3,3-Dimethylallyl)spatheliachromene
-
ME822808
-
C09002
12.78131963
-
8-methylthiooctylhydroximoyl-L-cysteine
-
ME822689
-
-
15.71052172
-
(9xi,10xi,12xi)-9,10-Dihydroxy-12-octadecenoic aci...
-
ME822781
-
C14828
5.73599684
-
aeruginosin A
-
ME822712
-
-
23.89226462
-
Aklanonic acid methyl ester
-
ME822828
-
C12422
13.89240735
-
Ala/Ala/Ala/Pro
-
ME822723
-
-
9.946774534
-
Ala/Ala/Ala/Ser
-
ME822682
-
-
15.96840996
-
Ala/Asn/Pro/Pro
-
ME822765
-
-
10.96158927
-
Ala/Asp/Asp/Asn/Pro
-
ME822814
-
-
14.3686028
-
Ala/Asp/Cys/Tyr
-
ME822788
-
-
8.19925988
-
Ala/Cys/Cys/Asn/Thr
-
ME822766
-
-
16.4167287
-
Ala/Cys/Cys/Cys/Asn
-
ME822758
-
-
13.15593254
-
Ala/Glu/Asn/Ile
-
ME822779
-
-
11.39708337
-
Ala/Glu/Glu/His
-
ME822792
-
-
15.08268829
-
Ala/Ile/Arg/Ile
-
ME822826
-
-
28.56630927
-
Ala/Ile/Pro/Pro/Ser
-
ME822833
-
-
18.0926533
-
Ala/Leu/Ala/Ala
-
ME822750
-
-
4.828546651
-
Ala/Leu/Gly/Arg
-
ME822769
-
-
11.25085259
-
Ala/Leu/Gly/Tyr
-
ME822813
-
-
13.10960693
-
Ala/Lys/Ala/Ala
-
ME822751
-
-
14.18296216
-
Ala/Lys/Asp/Pro
-
ME822778
-
-
14.65502916
-
Ala/Lys/Lys/Asp
-
ME822798
-
-
14.19367142
-
Ala/Lys/Thr/Arg
-
ME822800
-
-
3.696634505
-
Ala/Met/Cys/Cys
-
ME822731
-
-
11.6033627
-
Ala/Met/Trp/Asp
-
ME822836
-
-
16.83089154
-
alanyl-L-alpha-thiophenylglycine
-
ME822636
-
-
11.09804002
-
Ala/Phe/Thr/Pro
-
ME822823
-
-
22.06463275
-
Ala/Pro/His/His
-
ME822602
-
-
13.3702578
-
Ala/Pro/Ser/Ser
-
ME822724
-
-
14.20232498
-
Ala/Thr/Ala/Asp
-
ME822725
-
-
15.01103246
-
Ala/Thr/Ala/Ser
-
ME822705
-
-
16.31668358
-
Ala/Val/Asp/Ser
-
ME822749
-
-
12.12701119
-
Ala/Val/Gly/Pro
-
ME822748
-
-
5.381316086
-
alpha-D-desosamine
-
ME823043
-
-
12.6337341
-
Aminohydroquinone
-
ME823008
-
C14604
12.18659983
-
Anthemis glycoside B
-
ME822884
-
C08327
4.317429743
-
Apetalolide
-
ME822858
-
C09158
7.839585627
-
Arg/Phe/Cys/Gly
-
ME822815
-
-
11.10022801
-
Arg/Pro/Tyr/Arg
-
ME822698
-
-
14.93304194
-
Arsenobetaine
-
ME822964
-
C19331
11.14853031
-
Asn/Leu/Lys/Asp
-
ME822818
-
-
13.26425622
-
Asn/Leu/Pro/Pro
-
ME822817
-
-
10.89416489
-
Asn/Lys/Gly/Gly
-
ME822732
-
-
15.62938825
-
Asn/Lys/Met/Thr
-
ME822799
-
-
9.392644359
-
Asn/Phe/Asn/Gly
-
ME822790
-
-
12.89666673
-
Asn/Thr/Cys/Ser
-
ME822729
-
-
14.96132853
-
Asparaginyl-Hydroxyproline
-
ME823067
-
-
13.49769059
-
Asp/Cys/Ser/Tyr
-
ME822789
-
-
16.29617661
-
Asp/His/His/Met/Trp
-
ME822881
-
-
16.5186527
-
Asp/Phe/Pro/His
-
ME822843
-
-
11.1769091
-
Asp/Thr/Cys/Cys
-
ME822726
-
-
16.39919793
-
Avicularin
-
ME822802
-
-
10.82108332
-
bathophenanthroline sulfonate
-
ME822842
-
-
17.53460918
-
BPH-674
-
ME822753
-
-
15.61445685
-
Brusatol
-
ME822859
-
C08754
14.13740913
-
Canadine
-
ME822807
-
C11818_C03329
4.721168462
-
Capryloylglycine
-
ME822620
-
-
10.59533676
-
Chlordane
-
ME822626
-
C14176
27.46000001
-
Chlorosesamone
-
ME822736
-
-
11.71256059
-
cis-Resveratrol 3-sulfate
-
ME822714
-
-
13.81556334
-
Coalpha-[alpha-(2-methyladenin-9-yl)]-Cobeta-adeno...
-
ME822982
-
-
26.89088361
-
coelenterazine v
-
ME822873
-
-
15.78115769
-
Compound VII
-
ME822771
-
C06489
22.06201352
-
CTAB
-
ME822801
-
C11275
8.561599238
-
cycloguanil
-
ME822635
-
-
11.21664924
-
Cys/Asp/Asp/Pro/Ser
-
ME822793
-
-
3.887789622
-
Cys/Cys/Asn/Gln/Thr
-
ME822797
-
-
15.24919079
-
Cys/Cys/Asn/Ser/Thr
-
ME822767
-
-
16.8495397
-
Cys/Cys/Asp/Asn/Pro
-
ME822794
-
-
16.83180378
-
Cys/Gly/Ser/Tyr
-
ME822764
-
-
11.09054828
-
Cys/Gly/Trp/Trp/Trp
-
ME822891
-
-
10.10343068
-
Cys/Lys/Thr/Thr
-
ME822860
-
-
9.49182979
-
Cys/Lys/Thr/Thr/Thr
-
ME822825
-
-
13.8579492
-
cytidine 5'-{[hydroxy(2-hydroxyethyl)phosphonoyl]p...
-
ME822642
-
-
13.82289271
-
dibenzothiophene-5-oxide
-
ME822692
-
-
11.43725858
-
Diethyl tartrate
-
ME823034
-
-
13.73702787
-
erythro-D-galacto-octitol
-
ME823045
-
-
15.46170914
-
Erythro-imidazole-glycerol-phosphate
-
ME822984
-
C04666
13.78069024
-
Galipine
-
ME822806
-
C10683
4.715914336
-
Gallagic acid
-
ME822872
-
-
15.87111124
-
gamma-Fagarine
-
ME822693
-
C10676
22.07120642
-
gamma-thiomethyl glutamate
-
ME822990
-
-
10.80490347
-
Glu/Glu/Glu/Lys/Trp
-
ME822882
-
-
11.72320728
-
Glu/Glu/Lys/Pro
-
ME822824
-
-
16.11177568
-
glutathione sulfinate
-
ME822612
-
-
16.65440367
-
Gravacridonolchlorine
-
ME822785
-
-
11.35177683
-
Halosulfuron-methyl
-
ME822695
-
C18442
17.57086444
-
His/Asn/Arg/Ser/Ser
-
ME822832
-
-
15.21367726
-
Ile/Arg/Arg/Arg/Tyr
-
ME822883
-
-
3.688842992
-
(indolylmethylthiohydroximoyl)-L-cysteine
-
ME822696
-
C16518
12.89061609
-
Kaempferol 3-sulfate-7-alpha-arabinopyranoside
-
ME822803
-
-
12.57005743
-
Labriformin
-
ME822879
-
C08871
10.30117333
-
Lactosylceramide (d18:1/16:0)
-
ME822939
-
C01290
7.769365845
-
Lys/Met/Thr/Thr/Thr
-
ME822838
-
-
9.534393443
-
malyl alpha-D-glucosaminide
-
ME822614
-
-
15.20537419
-
meleagrin
-
ME822835
-
-
15.31474131
-
MK-129
-
ME822820
-
C11034
14.1642813
-
Montecristin
-
ME822887
-
-
3.7530027
-
MOPS
-
ME823024
-
-
11.28936584
-
N-(1-Deoxy-1-fructosyl)proline
-
ME822647
-
-
17.48333856
-
N-(3-oxooctanoyl)-L-homoserine
-
ME822681
-
-
13.53184972
-
N-(4,5-Dihydro-1-methyl-4-oxo-1H-imidazol-2-yl)ala...
-
ME823014
-
-
15.49306127
-
N-Acetylneuraminic acid 9-phosphate
-
ME822649
-
C06241
14.89834687
-
N-(docosenoyl)-hexadecasphing-4-enine-1-phosphoeth...
-
ME822905
-
-
7.726145093
-
N-(eicosanoyl)-sphinganine-1-phospho-(1'-myo-inosi...
-
ME822929
-
-
27.80123013
-
Ngaione (-)
-
ME822742
-
C09689
27.09616422
-
nicotinamide guanine dinucleotide
-
ME822822
-
-
12.80464577
-
Nigakinone
-
ME822735
-
C16996
15.21485793
-
Nitisinone
-
ME822710
-
-
12.10328781
-
N,N'-Bis(g-glutamyl)-3,3'-(1,2-propylenedithio)dia...
-
ME822795
-
-
3.906964115
-
P-DPD
-
ME822981
-
-
15.40394592
-
penem CGP31608
-
ME823053
-
-
13.84195164
-
Phe/Arg/Arg/Arg/Thr
-
ME822880
-
-
3.662834519
-
phe-FMDP
-
ME822761
-
-
11.26332751
-
phenyl sulfoxide
-
ME822663
-
-
16.94950405
-
Quercetagetin 3'-methylether 7-glucoside
-
ME822830
-
-
13.91502218
-
quinocarcin
-
ME822773
-
-
22.84209792
-
(R) 2,3-Dihydroxy-3-methylvalerate
-
ME822992
-
C04104_C06007
12.21041285
-
Selenium Sulfide
-
ME823093
-
-
27.86927254
-
tetrahydrocolumbamine
-
ME822810
-
C04118
11.11434583
-
Thiazinamium
-
ME822772
-
-
12.49902039
-
thioacetazone
-
ME822596
-
-
23.8991562
-
trametinib
-
ME822874
-
-
17.02224221
-
triethylene glycol
-
ME823001
-
-
4.257219089
-
tunicamine
-
ME822658
-
-
14.35471315
-
versicolorin A
-
ME822770
-
-
17.55419371
-
Zearalenone 4-sulfate
-
ME822774
-
-
13.28511272
-
Analysis: HILIC NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
(2R*,3R*)-1,2,3-Butanetriol
1,2,3-Butanetriol
ME823335
-
-
4.241616673
-
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone
ME823179
-
C10482
4.025837741
-
1-Pyrroline-5-carboxylic acid
1-Pyrroline-5-carboxylic acid
ME823364
-
C04322_C03912
14.52893482
-
2,3,5-Trihydroxytoluene
2,3,5-Trihydroxytoluene
ME823407
-
C03338
12.62618581
-
2-Amino-9,10-epoxy-8-oxodecanoic acid
2-Amino-9,10-epoxy-8-oxodecanoic acid
ME823099
-
C12027
12.70206852
-
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid
2-Deoxy-2,3-dehydro-N-acetylneuraminic acid
ME823117
-
C04580
12.76780052
-
2-Hydroxyethanesulfonate
2-Hydroxyethanesulfonate
ME823260
-
C05123
10.22201416
-
2-Hydroxy-2,4-pentadienoate
2-Hydroxypenta-2,4-dienoic acid
ME823362
-
C00596
14.71332341
-
2-methyl-tridecanedioic acid
2-Methyl-tridecanedioic acid
ME823156
-
-
4.214963922
-
3,3'-Thiobispropanoic acid
3,3'-Thiobispropanoic acid
ME823377
-
-
7.81768582
-
3-Methyleneoxindole
3-Methyleneoxindole
ME823439
-
C02796
5.604528009
-
2-Ketobutyric acid
3-Methyl pyruvic acid
ME823340
-
C00109
14.74059032
-
2-Dehydro-D-xylonate
(3S,4R)-3,4,5-Trihydroxy-2-keto-valeric acid
ME823369
-
C02928
12.32397117
-
3-Sulfinoalanine
3-Sulfino-alanine
ME823288
-
C00606
14.12378978
-
4,5-Dihydroorotic acid
4,5-Dihydroorotic acid
ME823360
-
C00337
10.68314944
-
4-Amino-4-deoxychorismate
4-Amino-4-deoxychorismic acid
ME823095
-
C11355
12.73070659
-
4-Hydroxyhexan-3-one
4-Hydroxyhexan-3-one
ME823382
-
C02948
4.805317869
-
4-Hydroxy-L-glutamic acid
4-Hydroxy-L-glutamic acid
ME823370
-
C05947
14.85359665
-
4-(L-Alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-sem...
4-(L-alanin-3-yl)-2-hydroxy-cis,cis-muconate 6-semialdehyde
ME823428
-
C04796
14.38153038
-
4-Pyridoxic acid
4-Pyridoxic acid
ME823425
-
C00847
7.814677962
-
4-Pyridoxolactone
4-Pyridoxolactone
ME823423
-
C00971
13.75879228
-
5-Aminoimidazole-4-carboxamide
5-Aminoimidazole-4-carboxamide
ME823338
-
C04051
8.531921682
-
9,10-dibromo-stearic acid
9,10-Dibromo-stearic acid
ME823189
-
-
15.91989205
-
Acetyl-N-formyl-5-methoxykynurenamine
Acetyl-N-formyl-5-methoxykynurenamine
ME823144
-
C05642
4.846627623
-
Adenosine diphosphate ribose
ADP-ribose
ME823161
-
C00301
14.40713361
-
AICAR
AICAR
ME823432
-
C04677
15.33056833
-
Ala/Ala
Ala-Ala
ME823380
-
C00993
10.94561662
-
Ala/Ala/Tyr
Ala-Ala-Tyr
ME823159
-
-
7.917592545
-
Ala/Asp/Gly
Ala-Asp-Gly
ME823431
-
-
14.72208541
-
Ala/Glu
Ala-Glu
ME823412
-
-
14.70014596
-
Ala/Gly/Ser
Ala-Gly-Ser
ME823414
-
-
12.50575923
-
Allantoin
Allantoin
ME823339
-
C01551_C02348_C02350
13.60198441
-
A-Ketoglutaric acid oxime
alpha-Ketoglutaric acid oxime
ME823366
-
-
7.847050296
-
ancymidol
Ancymidol
ME823158
-
-
4.76263016
-
Angustine
Angustine
ME823207
-
C09032
11.04282307
-
Arabinonate
Arabinonic acid
ME823353
-
C05411_C00545_C00878_C01685_C05412_C00502
13.18293619
-
Arabinose
Arabinose
ME823352
-
C02479_C02604_C00216_C00259
14.18995024
-
Arachidic acid
Arachidic acid
ME823214
-
C06425
3.867625619
-
Asn/Cys/Cys
Asn-Cys-Cys
ME823101
-
-
14.3541957
-
Asn/Cys/Tyr
Asn-Cys-Tyr
ME823171
-
-
11.48199391
-
Asn/Ser
Asn-Ser
ME823400
-
-
13.32528934
-
Asparagine
Asparagine
ME823346
-
C00152_C01905
15.14533137
-
Aspartic acid
Aspartic acid
ME823345
-
C00402_C00049
14.65549999
-
Asp/Asp/Pro
Asp-Asp-Pro
ME823148
-
-
16.30556667
-
Asp/Gly
Asp-Gly
ME823375
-
-
16.11000713
-
Asp/Ser
Asp-Ser
ME823399
-
-
15.29350888
-
Bendiocarb
Bendiocarb
ME823112
-
C14433
4.595297738
-
Bergaptol
Bergaptol
ME823123
-
C00758
14.98185987
-
dodecyl sulfate
Blasticidin S
ME823141
-
-
3.803439611
-
Chelirubine
Chelirubine
ME823215
-
C06327
12.28589535
-
Cholesterol sulfate
Cholesterol sulfate
ME823247
-
C18043
3.750434351
-
cis-Aconitic acid
cis-Aconitic acid
ME823393
-
C00417
17.23097621
-
Clavulanate
Clavulanate
ME823426
-
C06662
7.811061213
-
CMP-2-aminoethylphosphonate
CMPciliatine
ME823119
-
C05673
15.02401315
-
Cysteic acid
Cysteic acid
ME823289
-
C00506
15.05899051
-
Deoxyribose 5-phosphate
Deoxyribose 5-phosphate
ME823354
-
C00673
14.40386572
-
DGCC(40:10)
DGCC 40:10
ME823350
-
-
5.579866184
-
Dihydroxyacetone phosphate
Dihydroxyacetone phosphate
ME823290
-
C00111
14.96187247
-
FA (22:5)
Docosapentaenoic acid
ME823223
-
-
3.874702906
-
Erythronic acid
Erythronic acid
ME823347
-
C01620
12.1333538
-
Erythrose 4-phosphate
Erythrose 4-phosphate
ME823348
-
C03109_C00279
12.44468417
-
Fructose
Fructose
ME823385
-
C00095_C00795_C02336
16.99541785
-
beta-D-Fructose 1,6-bisphosphate
Fructose 1,6-bisphosphate
ME823390
-
C00354_C05378
15.07930997
-
Fucose 1-phosphate
Fucose 1-phosphate
ME823388
-
C01099_C02985
13.44798528
-
Fumaric acid
Fumaric acid
ME823337
-
C00122
14.76769058
-
Galactinoldihydrate
Galactinol
ME823140
-
-
14.02576962
-
Galactosylglycerol
Galactosylglycerol
ME823436
-
C05401
14.52175051
-
gamma-Glutamylglycine
gamma-Glutamylglycine
ME823398
-
-
14.24839839
-
Garcinia acid
Garcinia acid
ME823395
-
-
15.83322851
-
Gluconic acid
Gluconic acid
ME823386
-
C00257_C00880_C15930_C00800_C00817_C00770_C00514
13.95625118
-
Gluconolactone
Gluconolactone
ME823378
-
C02692_C00198
11.63154735
-
Glucosamine
Glucosamine
ME823387
-
C00329_C08349
16.30136405
-
Glucuronic acid
Glucuronic acid
ME823379
-
C00191
14.08604443
-
Glu/Gly/Val
Glu-Gly-Val
ME823134
-
-
12.34765215
-
Glu/Met/Pro
Glu-Met-Pro
ME823162
-
-
11.58606814
-
Glu/Ser
Glu-Ser
ME823413
-
-
15.15875505
-
Glu/Ser/Val
Glu-Ser-Val
ME823150
-
-
11.11554605
-
Glu/Val
Glu-Val
ME823100
-
-
11.19860561
-
Glyceric acid
Glyceric acid
ME823287
-
C00258
11.42923698
-
Trihexosylceramide (d18:1/16:0)
Hex3Cer 18:1;O2/16:0
ME823351
-
C04737
7.853337596
-
Trihexosylceramide (d18:1/24:1)
Hex3Cer 18:1;O2/24:1
ME823372
-
C04737
7.857713767
-
Hydantoin-5-propionic acid
Hydantoin-5-propionic acid
ME823394
-
C05565
15.00640059
-
Hydroxymethylphosphonate
Hydroxymethylphosphonic acid
ME823441
-
C06455
14.1491016
-
Hydroxyphenylacetylglycine
Hydroxyphenylacetylglycine
ME823094
-
C05596
7.807023391
-
Ile/Asn
Ile-Asn
ME823103
-
-
8.862699505
-
Ile/Gly/Val
Ile-Gly-Val
ME823151
-
-
7.849777655
-
Imidazole-4-acetaldehyde
Imidazole-4-acetaldehyde
ME823358
-
C05130
12.21214968
-
Imidazoleacetic acid
Imidazoleacetic acid
ME823359
-
C02835
14.96419215
-
Indoleacrylic acid
Indoleacrylic acid
ME823124
-
-
8.799807296
-
Indolepyruvate
Indolepyruvate
ME823125
-
C00331
8.948229588
-
Lactosamine
Lactosamine
ME823138
-
C00203
14.29299464
-
Alpha-Lactose
Lactose
ME823136
-
C06373_C00243_C00760
15.22634612
-
Lomustine
Lomustine
ME823433
-
C07079
12.30504321
-
LysoPA(16:0)
LPA 16:0
ME823206
-
C00416_C04036
7.811689092
-
LysoPE(18:2)
LPE 18:2
ME823228
-
-
7.811784196
-
LysoPE(20:5)
LPE 20:5
ME823236
-
-
4.679512833
-
1-Oleoylglycerophosphoserine
LPS 18:1/0:0
ME823233
-
-
4.266993525
-
LysoPS(20:4)
LPS 20:4
ME823242
-
-
7.812919653
-
Lys/Val
Lys-Val
ME823122
-
-
13.7705255
-
Malic acid
Malic acid
ME823343
-
C00149_C03668_C00497
15.49606569
-
Malonic semialdehyde
Malonic semialdehyde
ME823285
-
C00222
11.53406085
-
Heptadecanoic acid
Margaric acid
ME823185
-
-
3.922623679
-
Margaroyl-EA
Margaroyl-EA
ME823205
-
-
3.864629886
-
Met/Cys/Cys
Met-Cys-Cys
ME823120
-
-
17.5602394
-
Methocarbamol
Methocarbamol
ME823116
-
-
7.822224827
-
Monomethyl sulfate
Methyl sulfate
ME823440
-
C02704
12.40359722
-
N5-(L-1-Carboxyethyl)-L-ornithine
N(6)-Acetyl-N(6)-hydroxy-lysine
ME823418
-
C04210
14.21801799
-
N-Acetyl-L-aspartic acid
N-Acetylaspartic acid
ME823396
-
C01042
14.17847154
-
N-Acetyl-D-glucosaminate
N-acetyl-glucosaminic acid
ME823417
-
C01133
12.05976983
-
N-acetyl -D- glucosaminitol
N-Acetyl-glucosaminitol
ME823421
-
-
13.26418685
-
N-Acetylleucine
N-Acetylleucine
ME823415
-
C02710
11.76414422
-
N-Acetylneuraminic acid
N-Acetylneuraminic acid
ME823118
-
C00270_C19910
13.01561558
-
Ureidosuccinic acid
N-Carbamoylaspartic acid
ME823367
-
C00438
16.20061907
-
N-D-Glucosylarylamine
N-D-Glucosylarylamine
ME823133
-
C03142
7.801110758
-
N-Ethylglycocyamine
N-Ethylglycocyamine
ME823420
-
C02852
13.32361424
-
N-Gluconyl ethanolamine phosphate
N-Gluconyl ethanolamine phosphate
ME823422
-
-
11.03759515
-
Nitrendipine
Nitrendipine
ME823154
-
C07713
4.629748332
-
N,N-Dihydroxy-L-tyrosine
N,N-Dihydroxy-tyrosine
ME823427
-
C15503
12.45182012
-
Nalpha,Nalpha-Dimethyl-L-histidine
N,N-Dimethylhistidine
ME823411
-
C04259
12.31543496
-
FA (18:2)
Octadecadienoic acid
ME823187
-
-
3.921173685
-
octadecenoic acid
Octadecenoic acid
ME823191
-
-
3.911340339
-
Orotidine
Orotidine
ME823096
-
C01103
11.8593
-
Oxidized Photinus luciferin
Oxidized Photinus luciferin
ME823108
-
C03797
12.55626799
-
Oxmetidine
Oxmetidine
ME823199
-
C11803
12.1980747
-
PA(32:0)
PA 32:0
ME823270
-
C00416
3.799156481
-
PA(34:1)
PA 34:1
ME823275
-
C00416_C13889
3.766568547
-
PA(34:2)
PA 34:2
ME823274
-
C00416
3.771345692
-
PA(36:1)
PA 36:1
ME823281
-
-
3.758837624
-
PA(36:2)
PA 36:2
ME823279
-
C00416
3.747149449
-
PA(36:3)
PA 36:3
ME823278
-
-
3.763391938
-
PA(38:5)
PA 38:5
ME823294
-
-
3.739727677
-
PA(38:6)
PA 38:6
ME823293
-
-
3.746560648
-
Palmitic acid
Palmitic acid
ME823174
-
C00249
7.746856056
-
Palmitoleic acid
Palmitoleic acid
ME823173
-
C08362
3.956707248
-
PA(O-38:5)
PA O-38:5
ME823295
-
-
3.729486289
-
PC(33:2)
PC 33:2
ME823297
-
C00157
4.571283878
-
PC(35:5)
PC 35:5
ME823308
-
C00157
3.944496034
-
PC(P-36:3)
PC P-36:3
ME823317
-
C00157
7.731610756
-
PE(34:1)
PE 34:1
ME823283
-
C13877_C00350
5.565303236
-
PE(34:2)
PE 34:2
ME823280
-
C00350
4.021381463
-
PE(36:1)
PE 36:1
ME823299
-
C00350
4.002138801
-
PE(36:3)
PE 36:3
ME823296
-
C00350
3.99483225
-
PE(38:4)
PE 38:4
ME823310
-
C00350
3.950888631
-
PE(P-34:1)
PE P-34:1
ME823282
-
C00350
4.696376087
-
PE(P-36:1)
PE P-36:1
ME823298
-
C00350
3.995105743
-
PE(P-38:4)
PE P-38:4
ME823309
-
C00350
5.399157264
-
PE(P-40:4)
PE P-40:4
ME823322
-
C00350
3.948808613
-
PE(P-40:6)
PE P-40:6
ME823319
-
C00350
3.908119632
-
PE(P-40:7)
PE P-40:7
ME823318
-
C00350
3.908158871
-
PG(34:1)
PG 34:1
ME823292
-
C13883
3.705088974
-
PG(36:0)
PG 36:0
ME823307
-
-
3.964988975
-
PG(36:1)
PG 36:1
ME823305
-
-
3.795363707
-
PG(36:2)
PG 36:2
ME823303
-
-
3.686721498
-
PG(38:5)
PG 38:5
ME823315
-
-
3.68033654
-
PG(40:10)
PG 40:10
ME823326
-
-
7.816264769
-
Phe/Ala
Phe-Ala
ME823131
-
-
7.832114834
-
Phe/Asp
Phe-Asp
ME823146
-
-
10.75494145
-
Phe/Gly
Phe-Gly
ME823114
-
-
7.827710732
-
Phenolsulfonphthalein
Phenolsulfonphthalein
ME823196
-
C12600
7.795346279
-
Phe/Thr
Phe-Thr
ME823147
-
-
7.837548293
-
Hydrogen phosphate
Phosphoric acid
ME823442
-
C00009
12.56075556
-
Phytuberin
Phytuberin
ME823180
-
C09709
4.060245658
-
PI(34:2)
PI 34:2
ME823311
-
C00626
3.769841935
-
PI(36:1)
PI 36:1
ME823324
-
-
3.791295968
-
PI(36:2)
PI 36:2
ME823323
-
C00626
3.783281708
-
PI(36:4)
PI 36:4
ME823320
-
C00626
3.776106988
-
PI(38:4)
PI 38:4
ME823331
-
C00626
3.767027779
-
PI(38:5)
PI 38:5
ME823330
-
C00626
3.764445692
-
PI(O-34:0)
PI O-34:0
ME823312
-
-
14.96977458
-
PIP(38:4)
PIP 38:4*
ME823332
-
C00626
7.830447397
-
Proteacin
Proteacin
ME823212
-
C08339
14.17747937
-
PS(34:1)
PS 34:1
ME823291
-
C13880
3.789002691
-
PS(36:1)
PS 36:1
ME823304
-
C02737
3.78400151
-
PS(36:2)
PS 36:2
ME823302
-
-
3.774847622
-
PS(36:3)
PS 36:3
ME823301
-
-
3.774869357
-
PS(36:4)
PS 36:4
ME823300
-
-
3.776584145
-
PS(38:4)
PS 38:4
ME823316
-
C02737
3.758610201
-
PS(38:5)
PS 38:5
ME823314
-
-
3.755180371
-
PS(38:6)
PS 38:6
ME823313
-
-
3.758915579
-
PS(39:4)
PS 39:4
ME823321
-
-
3.749336009
-
PS(40:4)
PS 40:4
ME823329
-
-
3.756413175
-
PS(40:5)
PS 40:5
ME823328
-
C02737
3.74969021
-
PS(40:8)
PS 40:8
ME823327
-
-
3.756455641
-
Pseudouridine
Pseudouridine
ME823429
-
C02067
16.51933787
-
PS(O-36:1)
PS O-36:1
ME823306
-
-
5.396487306
-
PS(O-42:6)
PS O-42:6
ME823334
-
-
4.008903282
-
Glucosylsphingosine
Psychosine
ME823234
-
C03108
7.798901664
-
Pyridoxine 5'-phosphate
Pyridoxine 5'-phosphate
ME823410
-
C00627
13.48203712
-
Quinalphos
Quinalphos
ME823129
-
C11030
4.104281649
-
Rhamnose
Rhamnose
ME823383
-
C00507_C02338_C02476_C02522
11.34151011
-
Ribose 5-phosphate
Ribose 5-phosphate
ME823355
-
C03736_C00117
15.19444096
-
Cysteinosuccinic acid
S-Cysteinosuccinic acid
ME823397
-
-
12.99720475
-
Glycerophosphoglycerol
sn-Glycero-3-phosphoglycerol
ME823391
-
C03274
14.20891446
-
glycerophosphoserine
sn-Glycero-3-phosphoserine
ME823389
-
-
14.27817823
-
Sphinganine 1-phosphate
Sphinganine 1-phosphate
ME823194
-
C01120
7.829331486
-
Sphingosine 1-phosphate
Sphingosine 1-phosphate
ME823193
-
C06124
4.833965884
-
Stearic acid
Stearic acid
ME823192
-
C01530
3.900071514
-
Succinic acid
Succinic acid
ME823342
-
C00042
14.66348457
-
Sulfoacetate
Sulfoacetic acid
ME823258
-
C14179
15.46815867
-
Tartaric acid
Tartaric acid
ME823344
-
C00552_C00898_C02107
16.93044442
-
Taurine
Taurine
ME823261
-
C00245
14.7244617
-
Tetrahydropalmatine
Tetrahydropalmatine
ME823217
-
C02890
11.23177667
-
4-Hydroxy-2-oxopentanoate
Tetramethylammonium
ME823368
-
C03589
7.825334543
-
Thr/Gly
Thr-Gly
ME823381
-
-
11.52539248
-
Tiotropium
Tiotropium
ME823197
-
-
4.030644379
-
Trp/Pro
Trp-Pro
ME823169
-
-
8.361438075
-
Tuberculostearic acid
Tuberculostearic acid
ME823204
-
C16794
3.894181164
-
Uridine diphosphate-N-acetylgalactosamine
UDP-N-acetylgalactosamine
ME823181
-
C00203_C01170
14.68167528
-
Uracil
Uracil
ME823336
-
C00106
11.86768744
-
Urocanic acid
Urocanic acid
ME823392
-
C00785
12.28522097
-
Val/Val
Val-Val
ME823107
-
-
7.80893037
-
Xylobiose
Xylobiose
ME823102
-
C01630
13.73042742
-
12-Hydroxy-12-octadecanoylcarnitine
-
ME823238
-
-
7.778796526
-
1-(2-methoxy-eicosanyl)-sn-glycero-3-phosphoserine
-
ME823248
-
-
4.677459963
-
1-(2-methoxy-nonadecanyl)-sn-glycero-3-phosphoseri...
-
ME823243
-
-
4.676090851
-
1-(2-methoxy-octadecanyl)-sn-glycero-3-phosphoseri...
-
ME823239
-
-
4.720070427
-
1-[(3-Carboxypropyl)amino]-1-deoxyfructose
-
ME823105
-
-
11.04278466
-
[1-(4-methoxyphenyl)-3-phenylpropoxy]sulfonic acid
-
ME823168
-
-
14.98943436
-
19-dimethylarsinoyl-nonadecanoic acid
-
ME823221
-
-
21.35222575
-
1-deoxy-1-morpholino-D-fructose
-
ME823104
-
-
11.82078282
-
1-Methoxyspirobrassinin
-
ME823127
-
-
14.6894079
-
1-thio-beta-D-glucose
-
ME823384
-
-
11.611832
-
2-{[1-(R)-Carboxyethyl]amino}pentanoate
-
ME823416
-
C06326
12.27249165
-
2,3,4,5,6,7-Hexahydroxyheptanoic acid
-
ME823406
-
-
13.84714226
-
2-{[(3,5-dimethoxyphenyl)(hydroxy)methylidene]amin...
-
ME823113
-
-
7.800100806
-
2,3-Dihydro-5,5',7,7'-tetrahydroxy-2-(4-hydroxyphe...
-
ME823229
-
-
14.79550699
-
2-(4-sulfophenyl)decane
-
ME823172
-
-
3.824165204
-
{2-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-...
-
ME823222
-
-
16.67878573
-
2,5-Dioxopentanoate
-
ME823363
-
C00433
11.64916662
-
2-Aceto-2-hydroxybutanoic acid
-
ME823376
-
C00659_C06006
12.68370221
-
2-amino-3-(4-hydroxy-3-methoxyphenyl)-2-methylprop...
-
ME823115
-
-
4.487076044
-
2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate
-
ME823401
-
C16850
11.94402013
-
2-C-Methyl-D-erythritol 4-phosphate
-
ME823356
-
C11434
13.43758075
-
2-(glutathion-S-yl)-2-methylbut-3-enoate
-
ME823160
-
-
14.89097761
-
[2-hydroxy-1-(1-oxo-1H-isochromen-3-yl)butoxy]sulf...
-
ME823143
-
-
14.34558126
-
2-{[hydroxy(2,3,4-trimethoxyphenyl)methylidene]ami...
-
ME823130
-
-
4.719422855
-
{2-hydroxy-5-[-3-phenylprop-2-enoyl]phenyl}oxidane...
-
ME823157
-
-
14.99645268
-
2'-hydroxypyridoxol
-
ME823409
-
-
7.917991306
-
{[-2-(phenylmethylidene)heptyl]oxy}sulfonic acid
-
ME823152
-
-
11.54470664
-
2-phosphono-3-sulfoproprionate
-
ME823259
-
-
15.72439486
-
(2S,3R,-2-amino-4-dodecene-1,3-diol
-
ME823139
-
-
4.767701391
-
3,4-Dehydrothiomorpholine-3-carboxylate
-
ME823365
-
C04445
14.60101554
-
3-O-alpha-L-rhamnopyranosyl-3-hydroxynonanoyl-3-hy...
-
ME823237
-
-
7.834300261
-
3-Phospho-D-erythronate
-
ME823349
-
C03356
11.52782069
-
3-Phosphonopyruvate
-
ME823286
-
C02798
15.47671886
-
5beta-Cholane-3alpha,24-diol
-
ME823232
-
-
3.881527092
-
5'-Hydroxylornoxicam
-
ME823142
-
-
8.786093226
-
5-methoxycarbonylmethyluridine
-
ME823132
-
-
7.83976682
-
5-ureidoimidazole-4-carboxylate
-
ME823361
-
C05515
12.93380655
-
6,11-dihydroxy-3-methyl-7-(3,4,5-trihydroxyphenyl)...
-
ME823186
-
-
9.10110317
-
6,7,8,11,12,13,21,22,23-nonahydroxy-2,17,20-trioxa...
-
ME823209
-
-
15.05377061
-
6-Heptenyl glucosinolate
-
ME823155
-
-
14.78194088
-
6-Methoxy-3-(2-thiazolyl)-1H-indole
-
ME823126
-
-
15.00217679
-
7-Hydroxymethyl-12-methylbenz[a]anthracene sulfate
-
ME823208
-
C19562
14.68028101
-
Ala/Ala/Asp/Ser
-
ME823149
-
-
14.15735368
-
Ala/Asp/Asn/Asn/Pro
-
ME823213
-
-
14.9126222
-
Ala/Asp/Asp/Phe/Trp
-
ME823264
-
-
28.5490756
-
Ala/Asp/Gln/Tyr
-
ME823219
-
-
12.45826057
-
Ala/Cys/Cys/Cys/Glu
-
ME823183
-
-
13.91515342
-
Ala/Cys/Cys/His/Thr
-
ME823203
-
-
14.13197949
-
Ala/Leu/Trp/Ser
-
ME823226
-
-
7.829238383
-
Ala/Lys/Lys/Val/Trp
-
ME823265
-
-
11.57569838
-
Ala/Phe/Tyr/Tyr
-
ME823262
-
-
14.5230602
-
alpha-(2,6-anhydro-3-deoxy-D-arabino-heptulopyrano...
-
ME823402
-
-
22.06213757
-
alpha-D-Man-(1->3)-[alpha-D-GlcNAc-(1->2)]-a...
-
ME823268
-
C04923
17.38996776
-
altro-D-manno-Heptose
-
ME823405
-
C06397
11.76397612
-
aminopyrrolnitrin
-
ME823110
-
-
13.25180134
-
arabino-1,4-lactone 5-phosphate
-
ME823371
-
-
12.16955369
-
Arg/Leu/Lys/Thr
-
ME823224
-
-
14.94488139
-
Arg/Val/Gly/Pro
-
ME823188
-
-
13.81991949
-
Asn/Asn/Asp/Pro
-
ME823178
-
-
14.90206832
-
Asn/Asp/Asp/Pro
-
ME823176
-
-
14.37056525
-
Asn/Lys/Met/Cys
-
ME823190
-
-
14.75409922
-
Asp/Asp/Lys/Arg/Ser
-
ME823227
-
-
10.63955704
-
Asp/Glu/Ile/Lys/Trp
-
ME823267
-
-
4.819107165
-
Asp/Glu/Phe/Met/Arg
-
ME823253
-
-
14.59847417
-
Asp/Ile/Ile/Ile/Ile
-
ME823250
-
-
14.62988546
-
Avenic acid A
-
ME823135
-
-
15.03466562
-
beta-D-galactopyranosyl trimethylammonium bromide
-
ME823438
-
-
13.33905246
-
Bis(4-isothiocyanatobutyl) disulfide
-
ME823097
-
-
15.37617286
-
Bornesitol
-
ME823404
-
C03659_C03660
12.42783208
-
celesticetin
-
ME823230
-
-
14.62181668
-
coptisine
-
ME823195
-
-
12.91434544
-
Cupreine
-
ME823200
-
C06530
6.390936584
-
Cys/Asp/Asp/Glu/Trp
-
ME823244
-
-
14.95878729
-
Cys/Asp/Asp/Gly/Asn
-
ME823177
-
-
12.93695246
-
Cys/Cys/Glu/Met/Met
-
ME823220
-
-
17.00492737
-
Cys/Cys/Ser/Ser/Ser
-
ME823163
-
-
14.35120076
-
Cys/Gly/His/Ser/Ser
-
ME823182
-
-
13.9628964
-
deacetylcolchicine
-
ME823211
-
C16712
14.97197745
-
Dide-O-methylsimmondsin
-
ME823153
-
-
13.88624084
-
dithiolgliotoxin
-
ME823145
-
-
13.79151117
-
Dulcoside A
-
ME823276
-
-
14.61189616
-
erythro-L-galacto-Nonulose
-
ME823437
-
-
16.55284084
-
FA methyl(16:1)
-
ME823184
-
-
3.963447353
-
FA methyl(8:0)
-
ME823435
-
-
4.351837217
-
Flunitrazepam
-
ME823166
-
-
12.61019033
-
Formylfusarochromanone
-
ME823170
-
-
22.06493553
-
Ganglioside GA1 (d18:1/22:0)
-
ME823373
-
C06136 _C06136
7.823180161
-
Ganglioside GA1 (d18:1/24:1)
-
ME823374
-
C06136 _C06136
4.801970445
-
Gln/Leu/Lys/Tyr
-
ME823241
-
-
16.05198093
-
glucosylglycerate
-
ME823434
-
C11544
14.56127017
-
Glu/Gln/Gln/Arg/Tyr
-
ME823263
-
-
8.877452117
-
Glu/Ile/Ile/Ile/Ile
-
ME823254
-
-
14.32141122
-
glycero-L-galacto-Octulose
-
ME823419
-
-
14.78115328
-
His/His/Lys/Asn/Ser
-
ME823235
-
-
4.271015144
-
His/His/Pro/Pro/Gln
-
ME823245
-
-
28.58871982
-
His/Lys/Met/Pro/Val
-
ME823246
-
-
10.12409342
-
hydrogen trioxo[3-(1-chromen-1-ylium-2-yl)phenoxy]...
-
ME823165
-
-
12.15175837
-
Hydroxyethylpromethazine
-
ME823201
-
-
14.78374358
-
Ile/Arg/Val/Val/Tyr
-
ME823266
-
-
13.14531394
-
Ile/Ile/Ile/Gln/Val
-
ME823251
-
-
15.16502535
-
Ile/Ile/Ile/Ile/Gln
-
ME823255
-
-
14.9702034
-
Ile/Ile/Ile/Ile/Met
-
ME823257
-
-
11.5438386
-
Ile/Met/Thr/Tyr
-
ME823231
-
-
14.61452026
-
Isradipine
-
ME823198
-
-
13.92592087
-
Longicaudatin
-
ME823240
-
-
11.60774124
-
Melatonin glucuronide
-
ME823202
-
-
23.90156628
-
melibionate
-
ME823137
-
-
12.35105023
-
Methylselenopyruvate
-
ME823341
-
C18904
15.95903186
-
Miroestrol
-
ME823210
-
C08831
14.34926606
-
N-(1-Deoxy-1-fructosyl)threonine
-
ME823106
-
-
14.31792412
-
N-(2-hydroxy-docosanoyl)-pentadecasphing-4-enine-1...
-
ME823284
-
-
7.738409667
-
N-acetyldemethylphosphinothricyl-L-alanyl-L-leucin...
-
ME823164
-
-
13.84357754
-
N-Butyl-beta-carboline-3-carboxylate
-
ME823167
-
C13805
4.816384121
-
nicotine blue leuco form
-
ME823111
-
-
22.0638544
-
N-Nonanoylglycine
-
ME823121
-
-
7.809836457
-
O-mannopyranosyl-alpha-1,3-[O-mannopyranosyl-alpha...
-
ME823277
-
-
18.72845971
-
Oxopurpureine
-
ME823216
-
-
14.84038463
-
PE
-
ME823403
-
-
8.792116726
-
PGP(a-29:0)
-
ME823271
-
-
12.10931644
-
Phe/Gly/Tyr/Tyr
-
ME823252
-
-
14.61057229
-
Phe/Phe/Phe/Pro/Thr
-
ME823272
-
-
14.61114382
-
Phe/Phe/Pro/Val/Tyr
-
ME823273
-
-
14.53553456
-
PHODiA-PE
-
ME823256
-
-
4.012871769
-
Phosphoramidate
-
ME823443
-
C02306
27.84862565
-
prebassianin A
-
ME823225
-
-
10.69419657
-
Pyrimidine 5'-deoxynucleotide
-
ME823430
-
C08249
14.71137152
-
Pyrogallol-2-O-glucuronide
-
ME823128
-
-
15.05672086
-
Ribitol 5-phosphate
-
ME823357
-
C02895_C01068_C02883_C03509
15.33274338
-
Sambutoxin
-
ME823249
-
-
4.775718828
-
selenium dioxide
-
ME823444
-
-
12.51660374
-
Ser/Ser/Tyr/Tyr/Tyr
-
ME823269
-
-
14.62597851
-
SM(d40:1(OH))
-
ME823325
-
C00550
7.612795422
-
SM(d42:1(OH))
-
ME823333
-
C00550
4.464380185
-
sulfoglutathione
-
ME823098
-
-
18.41208867
-
Tetrahydrodipicolinate
-
ME823408
-
C03972
7.820636815
-
Thiolutin
-
ME823424
-
-
13.13466757
-
Thioridazine
-
ME823218
-
-
4.786258443
-
Triazolam
-
ME823175
-
-
15.82099684
-
xanthurenic acid 8-O-sulfate
-
ME823109
-
-
12.14775566
-
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