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Return to study ST000006 main page
Analysis: GCMS positive ion mode
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
1,2-anhydro-myo-inositol
1,2-Anhydro-myo-inositol
ME642547
2859
-
-
-
2-hydroxyglutaric acid
2-Hydroxyglutaric acid
ME642549
43
C02630
506359
129
2-isopropylmalic acid
2-Isopropylmalic acid
ME642550
77
-
-
-
alpha ketoglutaric acid
2-Oxoglutaric acid
ME642556
51
C00026
507734
198
3,6-anhydrogalactose
3,6-Anhydro-galactose
ME642552
16069996
C06474
589230
231
3-hydroxy-3-methylglutaric acid
3-Hydroxymethylglutaric acid
ME642553
1662
C03761
-
-
alanine
Alanine
ME642555
5950
C00041
243537
116
arabinose
Arabinose
ME642557
7044039
C00216
546892
217
arabitol
Arabitol
ME642558
827
C01904
566749
103
arachidic acid
Arachidic acid
ME642559
10467
C06425
856203
117
asparagine
Asparagine
ME642560
6267
C00152
553791
116
aspartic acid
Aspartic acid
ME642561
5960
C00049
480543
232
behenic acid
Behenic acid
ME642562
8215
C08281
919675
117
benzoic acid
Benzoic acid
ME642563
243
C00180
338043
179
beta alanine
beta-Alanine
ME642564
239
C00099
435138
174
butyl stearate
Butyl octadecanoate
ME642565
31278
-
-
-
caffeic acid
Caffeic acid
ME642566
1549111
C01481
748306
219
cis-caffeic acid
Caffeic acid
ME642568
1549111
C01481
-
-
cellobiose
Cellobiose
ME642567
439186
C00208
-
-
1-hexadecanol
Cetyl alcohol
ME642548
2682
C00823
-
-
4-hydroxyproline
cis-4-Hydroxyproline
ME642554
440015
C01015
-
-
citramalate
Citramalic acid
ME642569
1081
C00815
-
-
citric acid
Citric acid
ME642570
311
C00158
617288
273
citrulline
Citrulline
ME642571
9750
C00327
622791
256
conduritol-beta-epoxide
Conduritol epoxide
ME642572
9989541
-
-
-
cysteine
Cysteine
ME642573
594
C00097
501345
220
isothreonic acid
D-Threonic acid
ME642602
151152
C01620
489846
292
erythritol
Erythritol
ME642575
222285
C00503
471274
205
fructose
Fructose
ME642576
5984
C00095
638631
307
fucose
Fucose
ME642577
19466
C01018
-
-
galactinol
Galactinol
ME642579
11727586
C01235
1017113
204
isogalactinol
Galactinol
ME642600
11727586
C01235
1047512
204
galactonic acid
Galactonic acid
ME642580
12310779
C00880
692399
292
galactose
Galactose
ME642581
6036
C00124
647787
160
glycerol-3-galactoside NIST
Galactosylglycerol
ME642590
656504
C05401
803554
204
galacturonic acid
Galacturonic acid
ME642582
84740
C00333
670193
160
GABA
gamma-Aminobutyric acid
ME642578
119
C00334
488961
174
glucoheptulose
Glucoheptulose
ME642583
102926
-
828610
331
gluconic acid
Gluconic acid
ME642584
10690
C00257
693140
333
glucose
Glucose
ME642585
5793
C00031
649920
160
glucuronic acid
Glucuronic acid
ME642586
94715
C00191
666743
333
glutamic acid
Glutamic acid
ME642587
33032
C00025
529370
246
glyceric acid
Glyceric acid
ME642588
439194
C00258
377001
189
glycerol
Glycerol
ME642589
753
C00116
344223
205
glycine
Glycine
ME642592
750
C00037
368041
174
guanine
Guanine
ME642593
764
C00242
744497
352
homoserine
Homoserine
ME642595
12647
C00263
444264
128
indole-3-lactate
Indolelactic acid
ME642596
92904
C02043
764543
202
inulobiose
Inulobiose
ME642598
25201864
C01711
930708
204
isocitric acid
Isocitric acid
ME642599
1198
C00311
-
-
isoleucine
Isoleucine
ME642601
6306
C00407
358756
158
2-ketoisocaproic acid
Ketoleucine
ME642551
70
C00233
310629
200
lactic acid
Lactic acid
ME642603
107689
C00186
216442
117
lyxitol
L-Arabitol
ME642607
94154
C00532
575571
217
Lauric acid
Lauric acid
ME642604
3893
C02679
-
-
dehydroascorbate
L-Dehydroascorbic acid
ME642574
210328
C00425
633331
173
leucine
Leucine
ME642605
6106
C00123
345953
158
lysine
Lysine
ME642606
5962
C00047
663088
156
maleic acid
Maleic acid
ME642609
444266
C01384
365286
147
malate
Malic acid
ME642608
222656
C00149
462908
233
maltose
Maltose
ME642610
439186
C00208
946798
361
mannitol
Mannitol
ME642611
6251
C00392
-
-
heptadecanoic acid
Margaric acid
ME642594
10465
-
750645
117
melibiose
Melibiose
ME642612
440658
C05402
981832
204
methionine
Methionine
ME642613
6137
C00073
483425
176
inositol myo-
Myo-inositol
ME642597
892
C00137
729867
305
N-acetyl-D-hexosamine
N-Acetylhexosamine
ME642614
24139
C03136
746708
103
N-acetyl-D-mannosamine
N-Acetyl-mannosamine
ME642615
11096158
C00645
733793
205
Oleic acid
Oleic acid
ME642618
445639
C00712
-
-
ornithine
Ornithine
ME642619
6262
C00077
527822
142
oxoproline
Oxoproline
ME642620
7405
C01879
486399
156
palmitic acid
Palmitic acid
ME642621
985
C00249
713542
313
pelargonic acid
Pelargonic acid
ME642622
8158
C01601
399163
117
phenylalanine
Phenylalanine
ME642623
6140
C00079
537760
218
pipecolic acid
Pipecolic acid
ME642624
849
C00408
-
-
proline
Proline
ME642625
145742
C00148
364232
142
pseudo uridine
Pseudouridine
ME642626
15047
C02067
-
-
putrescine
Putrescine
ME642627
1045
C00134
587728
174
quinic acid
Quinic acid
ME642628
6508
C00296
-
-
ribonic acid
Ribonic acid
ME642629
5460677
C01685
598019
292
ribose
Ribose
ME642630
5779
C00121
553411
307
nicotianamine
(R,S,S)-Nicotianamine
ME642616
13892427
-
-
-
saccharopine
Saccharopine
ME642631
160556
C00449
-
-
serine
Serine
ME642632
5951
C00065
394656
204
shikimic acid
Shikimic acid
ME642633
8742
C00493
610984
204
glycerol-alpha-phosphate
sn-Glycero-3-phosphate
ME642591
754
C03189
591357
299
sophorose
Sophorose
ME642634
88719
C08250
953453
319
sorbitol
Sorbitol
ME642635
453
C00794
667682
103
spermidine
Spermidine
ME642636
1102
C00315
792258
144
Stearic acid
Stearic acid
ME642637
5281
C01530
-
-
octadecanol
Stearyl alcohol
ME642617
8221
D01924
755073
327
suberyl glycine
Suberylglycine
ME642638
6453952
-
532293
188
succinic acid
Succinic acid
ME642639
1110
C00042
370518
147
talose
Talose
ME642640
99459
-
-
-
tartaric acid
Tartaric acid
ME642641
444305
C00898
-
-
threitol
Threitol
ME642642
169019
C16884
467314
217
threonic acid
Threonic acid
ME642643
151152
C01620
497167
292
threonine
Threonine
ME642644
6288
C00188
409403
117
trehalose
Trehalose
ME642645
7427
C01083
947837
191
tryptophan
Tryptophan
ME642646
6305
C00078
779834
202
tyrosine
Tyrosine
ME642647
6057
C00082
671085
218
uracil
Uracil
ME642648
1174
C00106
385903
99
urea
Urea
ME642649
1176
C00086
328046
171
uridine
Uridine
ME642650
6029
C00299
856953
258
valine
Valine
ME642651
6287
C00183
313224
144
xanthine
Xanthine
ME642652
1188
C00385
702391
353
xylitol
Xylitol
ME642653
6912
C00379
563718
217
xylose
Xylose
ME642654
135191
C00181
542808
103
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