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Return to study ST003108 main page
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Choline
Choline
ME810086
-
-
0.623
104.107
L-serine
Serine
ME810039
-
-
0.628
106.050
Cytosine
Cytosine
ME810047
-
-
0.681
112.051
Creatinine
Creatinine
ME810075
-
-
0.644
114.066
L-proline
Proline
ME810038
-
-
0.657
116.071
Guanidinoacetate
Guanidoacetic acid
ME810078
-
-
0.669
118.061
L-valine
Valine
ME810043
-
-
0.693
118.086
L-threonine
Threonine
ME810040
-
-
0.627
120.066
L-cysteine
Cysteine
ME810031
-
-
1.711
122.027
Nicotinamide
Niacinamide
ME810057
-
-
0.754
123.056
Picolinic acid
Picolinic acid
ME810083
-
-
0.543
124.040
Thymine
Thymine
ME810048
-
-
0.659
127.050
5-6-Dihydrothymine
Dihydrothymine
ME810054
-
-
0.655
129.066
Creatine
Creatine
ME810074
-
-
0.639
132.077
L-leucine/isoluecine
-
ME810034
-
-
0.821
132.102
L-asparagine
Asparagine
ME810030
-
-
0.634
133.061
Ornithine
Ornithine
ME810067
-
-
0.626
133.097
Adenine
Adenine
ME810045
-
-
0.737
136.062
Hypoxanthine
Hypoxanthine
ME810049
-
-
0.688
137.046
4-Acetamidobutanoate
4-Acetamidobutanoic acid
ME810076
-
-
0.651
146.081
Acetylcholine
Acetylcholine
ME810087
-
-
0.652
146.117
Spermidine
Spermidine
ME810070
-
-
0.57
146.165
L-lysine
Lysine
ME810035
-
-
0.598
147.113
L-methionine
Methionine
ME810036
-
-
0.664
150.058
Guanine
Guanine
ME810046
-
-
0.707
152.057
Xanthine
Xanthine
ME810050
-
-
0.563
153.039
Dopamine
Dopamine
ME810085
-
-
0.666
154.085
L-histidine
Histidine
ME810033
-
-
0.605
156.077
g-Oxalo-crotonate
4-Oxalocrotonic acid
ME810084
-
-
0.677
159.028
L-Carnitine
Carnitine
ME810088
-
-
0.627
162.112
D-Rhamnose
Rhamnose
ME810060
-
-
0.634
165.077
L-phenylalanine
Phenylalanine
ME810037
-
-
1.062
166.086
Pyridoxal
Pyridoxal
ME810055
-
-
0.674
168.065
N-Acetyl-L-ornithine
N-Acetylornithine
ME810077
-
-
0.64
175.108
L-arginine
Arginine
ME810029
-
-
0.614
175.119
Indole-3-acetate
Indoleacetic acid
ME810079
-
-
1.884
176.071
L-Citrulline
Citrulline
ME810068
-
-
0.662
176.103
Allantoate
Allantoic acid
ME810052
-
-
0.586
177.061
Cys-Gly
Cys-Gly
ME810061
-
-
0.692
179.048
L-tyrosine
Tyrosine
ME810042
-
-
0.665
182.081
Mannitol/Sorbitol/Glucitol/Iditol
-
ME810059
-
-
0.673
183.085
5-Hydroxyisourate
5-Hydroxyisouric acid
ME810051
-
-
0.625
185.031
Spermine
Spermine
ME810071
-
-
0.575
203.223
Indolepyruvate
Indolepyruvate
ME810080
-
-
0.656
204.063
L-Tryptophanamide
Tryptophanamide
ME810082
-
-
0.549
204.111
AC(2:0)
CAR 2:0
ME810089
-
-
0.661
204.123
L-tryptophan
Tryptophan
ME810041
-
-
1.695
205.097
6-Hydroxykynurenic acid
6-Hydroxykynurenic acid
ME810081
-
-
1.712
206.045
AC(3:0)
CAR 3:0
ME810090
-
-
0.669
218.139
Carnosine
Carnosine
ME810073
-
-
0.593
227.114
AC(4:0)
CAR 4:0
ME810091
-
-
1.685
232.154
L-cystine
Cystine
ME810044
-
-
0.696
241.029
AC(5:0)
CAR 5:0
ME810094
-
-
1.715
246.170
AC(4-OH)
CAR 4:0;OH
ME810092
-
-
0.662
248.149
Pyridoxamine 5'-phosphate
Pyridoxamine 5'-phosphate
ME810056
-
-
1.711
249.061
gamma-L-Glutamyl-L-cysteine
gamma-Glutamylcysteine
ME810062
-
-
0.705
251.069
alpha-D-Glucosamine 1-phosphate
Glucosamine 1-phosphate
ME810072
-
-
0.648
260.053
AC(4-DC)
-
ME810093
-
-
0.666
262.129
AC(5-OH)
CAR 5:0;OH
ME810095
-
-
0.669
262.165
AC(8:0)
CAR 8:0
ME810096
-
-
1.838
288.217
Sphingosine
Sphingosine
ME810107
-
-
1.979
300.289
gamma-Glutamyl-Se-methylselenocysteine
gamma-Glutamyl-Se-methylselenocysteine
ME810063
-
-
0.624
313.031
AC(10:0)
CAR 10:0
ME810097
-
-
1.889
316.248
3',5'-Cyclic AMP
3',5' cyclic AMP
ME810053
-
-
0.761
330.058
AC(12:0)
CAR 12:0
ME810098
-
-
1.932
344.279
AC(14:1)
CAR 14:1
ME810100
-
-
1.96
370.295
AC(14:0)
CAR 14:0
ME810099
-
-
1.991
372.310
S-Adenosyl-L-homocysteine
S-Adenosylhomocysteine
ME810064
-
-
0.653
385.129
AC(16:1)
CAR 16:1
ME810102
-
-
1.994
398.327
S-Adenosyl-L-methionine
S-Adenosylmethionine
ME810065
-
-
0.617
399.144
AC(16:0)
CAR 16:0
ME810101
-
-
2.044
400.342
AC(18:2)
CAR 18:2
ME810105
-
-
2.017
424.342
AC(18:1)
CAR 18:1
ME810104
-
-
2.052
426.357
AC(18:0)
CAR 18:0
ME810103
-
-
2.112
428.373
AC(20:4)
CAR 20:4
ME810106
-
-
2.005
448.341
5-10-Methenyltetrahydrofolate
5,10-Methenyl-THF
ME810066
-
-
0.651
457.169
NAD+
NAD
ME810058
-
-
0.655
664.114
glycine
Glycine
ME810032
-
-
0.652
76.040
Putrescine
Putrescine
ME810069
-
-
0.559
89.108
L-alanine
Alanine
ME810028
-
-
0.621
90.056
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
Dimethylglycine
Dimethylglycine
ME810138
-
-
0.592
102.055
Uracil
Uracil
ME810113
-
-
0.603
111.019
5-6-Dihydrouracil
Dihydrouracil
ME810143
-
-
0.598
113.034
Fumarate
Fumaric acid
ME810129
-
-
0.567
115.002
Indole
Indole
ME810145
-
-
1.686
116.049
Succinate
Succinic acid
ME810128
-
-
0.582
117.018
5-Oxoproline
Pyroglutamic acid
ME810135
-
-
0.597
128.034
trans-4-Hydroxy-L-proline
trans-4-Hydroxyproline
ME810142
-
-
0.582
130.050
L-aspartate
Aspartic acid
ME810108
-
-
0.588
132.029
Malate
D-Malic acid
ME810130
-
-
0.569
133.013
L-glutamate
Glutamic acid
ME810109
-
-
0.586
146.045
2-Hydroxyglutarate
2-Hydroxyglutaric acid
ME810131
-
-
0.565
147.028
Ribose/Ribulose/Arabinose/Xylose/Xylulose
-
ME810126
-
-
0.585
149.045
3D-(3-5/4)-Trihydroxycyclohexane-1-2-dione
-
ME810146
-
-
0.6
159.029
Phosphoenolpyruvate
Phosphoenolpyruvic acid
ME810123
-
-
0.536
166.974
Glycerol 3-phosphate
sn-Glycero-3-phosphate
ME810147
-
-
0.585
171.005
Dehydroascorbate
Dehydroascorbic acid
ME810137
-
-
0.571
173.008
Diphosphate
Pyrophosphate
ME810120
-
-
0.57
176.935
D-Glucose
Glucose
ME810121
-
-
0.619
179.055
4-Pyridoxate
4-Pyridoxic acid
ME810117
-
-
0.634
182.043
Citrate
Citric acid
ME810127
-
-
0.573
191.019
L-Selenomethionine
Selenomethionine
ME810144
-
-
0.684
195.991
Cytidine
Cytidine
ME810111
-
-
0.611
242.078
FA(16:1)
Hexadecenoic acid
ME810149
-
-
2.613
253.217
D-Hexose-phosphate
-
ME810122
-
-
0.575
259.022
Inosine
Inosine
ME810116
-
-
0.586
267.072
6-Phospho-D-gluconate
6-Phosphogluconic acid
ME810132
-
-
0.557
275.017
FA(18:0)
Stearic acid
ME810148
-
-
3.461
283.264
FA(20:5)
Eicosapentaenoic acid
ME810151
-
-
2.419
301.217
FA(20:4)
Arachidonic acid
ME810150
-
-
2.557
303.233
FA(20:3)
Eicosatrienoic acid
ME810153
-
-
2.774
305.248
Glutathione
Glutathione
ME810133
-
-
0.609
306.078
N-Acetylneuraminate
N-Acetylneuraminic acid
ME810139
-
-
0.597
308.099
UMP
UMP
ME810112
-
-
0.588
323.028
FA(22:6)
DHA
ME810152
-
-
2.466
327.233
FA(22:5)
Docosapentaenoic acid
ME810154
-
-
2.593
329.250
IMP
IMP
ME810115
-
-
0.595
347.040
Sphinganine 1-phosphate
Sphinganine 1-phosphate
ME810155
-
-
3.812
380.257
S-Glutathionyl-L-cysteine
S-Glutathionyl-cysteine
ME810136
-
-
0.58
425.081
ATP
ATP
ME810110
-
-
0.554
505.989
ITP
ITP
ME810114
-
-
0.587
506.969
UDP-glucose
UDP-glucose
ME810118
-
-
0.547
565.048
UDP-N-acetyl-D-glucosamine
UDP-N-acetylglucosamine
ME810140
-
-
0.55
606.074
Glutathione disulfide
Oxidized glutathione
ME810134
-
-
0.55
611.143
CMP-N-acetylneuraminate
CMP-N-acetylneuraminic acid
ME810141
-
-
0.54
613.140
Pyruvate
Pyruvic acid
ME810124
-
-
0.609
87.007
Lactate
Lactic acid
ME810125
-
-
0.65
89.023
Phosphate
Phosphoric acid
ME810119
-
-
0.585
96.968
Analysis: Reversed phase POSITIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
TG(28:4_26:6_26:6)
TG 26:6_26:6_28:4*
ME810562
-
-
2.350
1223.994
AcCa(2:0)
CAR 2:0
ME810160
-
-
0.240
204.123
AcCa(4:0)
CAR 4:0
ME810169
-
-
0.259
232.154
SPH(d16:1)
-
ME810541
-
-
1.659
272.258
SPH(d16:0)
-
ME810545
-
-
0.924
274.274
SPH(d17:0)
-
ME810543
-
-
1.174
288.290
SPH(d18:1)
Sphingosine
ME810544
-
-
1.628
300.290
SPH(d19:0)
-
ME810542
-
-
1.595
316.321
SPH(d20:0)
-
ME810540
-
-
1.777
330.337
AcCa(12:0)
CAR 12:0
ME810168
-
-
0.762
344.280
Ch
Cholesterol
ME810184
-
-
2.630
369.352
AcCa(14:0)
CAR 14:0
ME810156
-
-
1.232
372.311
AcCa(15:0)
CAR 15:0
ME810167
-
-
1.445
386.326
AcCa(16:1)
CAR 16:1
ME810171
-
-
1.357
398.326
AcCa(16:0)
CAR 16:0
ME810161
-
-
1.618
400.342
AcCa(17:1)
CAR 17:1
ME810170
-
-
1.550
412.342
TG(19:2)
TG 19:2*
ME810561
-
-
0.758
414.285
AcCa(17:0)
CAR 17:0
ME810162
-
-
1.716
414.358
AcCa(18:2)
CAR 18:2
ME810166
-
-
1.480
424.342
AcCa(18:1)
CAR 18:1
ME810157
-
-
1.702
426.358
AcCa(18:0)
CAR 18:0
ME810158
-
-
1.929
428.373
TG(21:1)
TG 21:1*
ME810560
-
-
1.360
444.332
AcCa(20:3)
CAR 20:3
ME810163
-
-
1.611
450.358
LPE(16:1)
LPE 16:1
ME810225
-
-
1.486
452.277
AcCa(20:2)
CAR 20:2
ME810164
-
-
1.791
452.373
DG(O-26:4)
DG O-26:4*
ME810190
-
-
2.273
463.378
LPC(P-15:0)
LPC P-15:0
ME810207
-
-
1.594
466.329
LPC(14:0)
LPC 14:0
ME810216
-
-
1.345
468.308
AcCa(22:5)
CAR 22:5
ME810165
-
-
1.554
474.358
LPE(18:2)
LPE 18:2
ME810226
-
-
1.603
478.293
LPC(15:1)
LPC 15:1
ME810205
-
-
1.774
480.308
LPC(P-16:0)
LPC P-16:0
ME810206
-
-
1.806
480.345
PE(17:0)
PE 17:0
ME810430
-
-
1.750
482.288
LPC(15:0)
LPC 15:0
ME810217
-
-
1.533
482.324
LPC(O-16:0)
LPC O-16:0
ME810218
-
-
1.834
482.361
Cer(d16:1_16:0)
Cer 16:1;O2/16:0
ME810177
-
-
2.928
492.478
LPC(16:1)
LPC 16:1
ME810219
-
-
1.455
494.324
LPC(O-17:1)
LPC O-17:1
ME810198
-
-
1.924
494.361
LPC(P-17:0)
LPC P-17:0
ME810211
-
-
1.915
494.361
LPC(16:0)
LPC 16:0
ME810194
-
-
1.635
496.340
LPC(O-17:0)
LPC O-17:0
ME810197
-
-
1.930
496.376
LPE(20:5)
LPE 20:5
ME810227
-
-
1.337
500.277
LPC(P-18:1)
LPC P-18:1
ME810212
-
-
1.867
506.361
PE(19:1)
PE 19:1
ME810450
-
-
1.835
508.303
LPC(O-18:1)
LPC O-18:1
ME810213
-
-
2.105
508.376
LPC(P-18:0)
LPC P-18:0
ME810200
-
-
1.898
508.376
LPG(18:2)
LPG 18:2
ME810228
-
-
1.328
509.287
LPC(17:0)
LPC 17:0
ME810195
-
-
1.750
510.355
LPC(O-18:0)
LPC O-18:0
ME810220
-
-
2.114
510.392
PC(O-16:0)
PC O-16:0
ME810398
-
-
1.704
518.322
LPC(18:2)
LPC 18:2
ME810221
-
-
1.502
520.340
Cer(d18:1_16:0)
Cer 18:1;O2/16:0
ME810172
-
-
3.061
520.509
LPC(18:1)
LPC 18:1
ME810223
-
-
1.769
522.355
LPC(18:0)
LPC 18:0
ME810196
-
-
1.895
524.371
LPE(22:6)
LPE 22:6
ME810224
-
-
1.512
526.293
PE(21:4)
PE 21:4
ME810451
-
-
1.611
530.288
Cer(d18:2_16:0)
Cer 18:2;O2/16:0
ME810174
-
-
2.962
536.504
LPC(19:0)
LPC 19:0
ME810208
-
-
2.102
538.387
AcCa(26:0)
CAR 26:0
ME810159
-
-
2.799
540.499
LPC(20:4)
LPC 20:4
ME810222
-
-
1.496
544.340
LPS(20:4)
LPS 20:4
ME810229
-
-
1.234
546.283
LPC(20:3)
LPC 20:3
ME810199
-
-
1.623
546.355
Cer(d18:2_18:0)
Cer 18:2;O2/18:0
ME810175
-
-
3.080
546.524
PC(19:2)
PC 19:2
ME810399
-
-
1.569
548.335
LPC(20:2)
LPC 20:2
ME810214
-
-
1.857
548.371
LPC(20:0)
LPC 20:0
ME810202
-
-
2.046
552.402
PE(23:5)
PE 23:5*
ME810452
-
-
1.684
556.303
PE(23:4)
PE 23:4
ME810449
-
-
1.853
558.319
LPC(P-21:5)
-
ME810203
-
-
2.004
562.327
PA(21:2_4:0)
PA 4:0_21:2*
ME810243
-
-
1.913
564.366
PC(20:1)
PC 20:1
ME810336
-
-
2.133
564.366
PC(20:0)
PC 20:0
ME810355
-
-
1.987
566.382
LPC(O-22:0)
LPC O-22:0
ME810215
-
-
2.575
566.454
Cer(d18:1_18:0)
Cer 18:1;O2/18:0
ME810182
-
-
3.150
566.551
PC(21:4)
PC 21:4
ME810337
-
-
1.553
572.335
LPC(22:4)
LPC 22:4
ME810209
-
-
1.808
572.371
PE(16:1_8:0)
PE 8:0_16:1*
ME810436
-
-
2.251
578.382
PC(22:1)
PC 22:1
ME810365
-
-
2.170
592.397
PE(25:1)
PE 25:1
ME810437
-
-
2.378
592.397
LPC(23:1)
LPC 23:1*
ME810210
-
-
2.333
592.434
PC(22:0)
PC 22:0
ME810372
-
-
2.232
594.413
PS(4:0_18:0)
PS 4:0_18:0*
ME810502
-
-
1.771
596.356
LPC(24:1)
LPC 24:1
ME810204
-
-
2.465
606.449
PC(23:0)
PC 23:0
ME810366
-
-
2.281
608.429
DG(16:0_18:2)
DG 16:0_18:2
ME810191
-
-
3.196
610.541
DG(16:0_18:1)
DG 16:0_18:1
ME810188
-
-
3.263
612.556
DG(16:0_18:0)
DG 16:0_18:0
ME810185
-
-
3.337
614.572
Cer(d18:1_22:2)
Cer 18:1;O2/22:2
ME810176
-
-
3.206
618.582
Cer(d18:2_22:0)
Cer 18:2;O2/22:0
ME810178
-
-
3.284
620.598
PC(24:0)
PC 24:0
ME810338
-
-
2.381
622.444
Cer(d18:2_24:1)
Cer 18:2;O2/24:1
ME810173
-
-
3.297
628.603
DG(16:0_20:4)
DG 16:0_20:4
ME810192
-
-
3.166
634.541
Cer(d18:2_23:0)
Cer 18:2;O2/23:0
ME810179
-
-
3.307
634.613
Cer(d18:0_24:0)
Cer 18:0;O2/24:0
ME810180
-
-
3.424
634.650
PC(25:0)
PC 25:0
ME810339
-
-
2.484
636.460
DG(18:1_18:2)
DG 18:1_18:2
ME810186
-
-
3.206
636.556
DG(18:1_18:1)
DG 18:1_18:1
ME810187
-
-
3.282
638.572
PC(26:2)
PC 26:2
ME810400
-
-
2.269
646.444
SM(d30:1)
SM 30:1;O2
ME810518
-
-
2.527
647.512
PC(26:1)
PC 26:1
ME810374
-
-
2.420
648.460
Cer(d18:1_24:1)
Cer 18:1;O2/24:1
ME810181
-
-
3.346
648.629
PC(26:0)
PC 26:0
ME810340
-
-
2.568
650.476
Cer(d18:1_24:0)
Cer 18:1;O2/24:0
ME810183
-
-
3.121
650.645
SM(d31:1)
SM 31:1;O2
ME810505
-
-
2.613
661.528
DG(18:0_20:4)
DG 18:0_20:4
ME810189
-
-
3.269
662.572
SM(d32:1)
SM 32:1;O2
ME810506
-
-
2.697
675.544
SM(d32:0)
SM 32:0;O2
ME810531
-
-
2.760
677.559
PC(28:0)
PC 28:0
ME810254
-
-
2.700
678.507
PS(10:0_18:0)
PS 10:0_18:0
ME810503
-
-
1.883
680.450
SM(d33:2)
SM 33:2;O2
ME810530
-
-
2.657
687.544
SM(d33:1)
SM 33:1;O2
ME810519
-
-
2.779
689.559
PC(29:1)
PC 29:1
ME810391
-
-
2.941
690.507
PE(16:1_16:0)
PE 16:0_16:1
ME810453
-
-
2.937
690.507
PE(32:0)
PE 32:0
ME810408
-
-
3.011
692.522
LPC(30:0)
LPC 30:0
ME810201
-
-
2.960
692.559
PC(P-9:0_20:1)
PC P-9:0/20:1*
ME810392
-
-
2.891
696.494
SM(d34:4)
SM 34:4;O2
ME810539
-
-
2.723
697.528
PA(O-20:3_16:1)
PA O-20:3/16:1*
ME810244
-
-
3.027
700.528
PE(P-16:0_18:2)
PE P-16:0/18:2
ME810409
-
-
3.027
700.528
Hex1Cer(d18:1_16:0)
HexCer 18:1;O2/16:0
ME810193
-
-
3.026
700.572
SM(d34:2)
SM 34:2;O2
ME810520
-
-
2.733
701.559
PC(O-13:1_18:1)
PC O-13:1/18:1*
ME810406
-
-
3.105
702.543
PE(P-16:0_18:1)
PE P-16:0/18:1
ME810424
-
-
3.101
702.543
SM(d14:0_20:1)
SM 14:0;O2/20:1
ME810514
-
-
3.637
703.575
SM(d34:1)
SM 34:1;O2
ME810507
-
-
2.847
703.575
PC(30:1)
PC 30:1
ME810255
-
-
2.746
704.522
PC(30:0)
PC 30:0
ME810256
-
-
2.853
706.538
PE(P-15:0_20:4)
PE P-15:0/20:4
ME810445
-
-
2.941
710.512
PA(22:5_14:0)
PA 14:0_22:5
ME810232
-
-
2.815
712.491
PE(20:4_14:0)
PE 14:0_20:4
ME810410
-
-
2.817
712.491
PE(18:3_16:0)
PE 16:0_18:3
ME810439
-
-
2.893
714.507
PE(34:3)
PE 34:3
ME810438
-
-
2.552
714.507
SM(d35:2)
SM 35:2;O2
ME810508
-
-
2.814
715.575
PC(31:2)
PC 31:2
ME810393
-
-
2.959
716.522
PE(P-17:0_18:1)
PE P-17:0/18:1
ME810425
-
-
2.958
716.559
PC(31:1)
PC 31:1
ME810375
-
-
2.838
718.538
PE(34:1)
PE 34:1
ME810411
-
-
3.167
718.538
PC(O-32:1)
PC O-32:1
ME810303
-
-
2.860
718.575
PC(31:0)
PC 31:0
ME810257
-
-
2.913
720.554
PC(O-32:0)
PC O-32:0
ME810258
-
-
3.066
720.590
PA(O-18:2_20:5)
PA O-18:2/20:5
ME810234
-
-
2.721
722.512
PC(O-13:1_20:5)
PC O-13:1/20:5*
ME810304
-
-
2.940
722.512
PC(P-33:5)
PC P-33:5
ME810385
-
-
2.943
722.512
PE(P-16:0_20:5)
PE P-16:0/20:5
ME810412
-
-
2.664
722.512
PC(O-13:1_20:4)
PC O-13:1/20:4*
ME810341
-
-
3.013
724.528
PE(P-16:0_20:4)
PE P-16:0/20:4
ME810426
-
-
3.015
724.528
PA(O-20:3_18:2)
PA O-20:3/18:2*
ME810238
-
-
3.040
726.543
PE(P-16:0_20:3)
PE P-16:0/20:3
ME810443
-
-
3.027
726.543
SM(d36:3)
SM 36:3;O2
ME810521
-
-
2.789
727.575
PC(32:3)
PC 32:3
ME810342
-
-
2.754
728.522
PE(P-18:1_18:1)
PE P-18:1/18:1
ME810413
-
-
3.124
728.559
SM(d36:2)
SM 36:2;O2
ME810522
-
-
2.888
729.591
PC(32:2)
PC 32:2
ME810259
-
-
2.788
730.538
PC(O-15:1_18:1)
PC O-15:1/18:1
ME810260
-
-
3.202
730.575
PE(P-18:0_18:1)
PE P-18:0/18:1
ME810427
-
-
2.982
730.575
SM(d36:1)
SM 36:1;O2
ME810509
-
-
2.980
731.606
PC(32:1)
PC 32:1
ME810305
-
-
2.890
732.554
PE(18:1_17:0)
PE 17:0_18:1
ME810414
-
-
3.089
732.554
PC(O-33:1)
PC O-33:1
ME810376
-
-
3.034
732.590
SM(d36:0)
SM 36:0;O2
ME810523
-
-
3.035
733.622
PC(33:7)
PC 33:7*
ME810404
-
-
2.704
734.476
PC(32:0)
PC 32:0
ME810251
-
-
2.984
734.569
PA(22:6_16:0)
PA 16:0_22:6
ME810240
-
-
2.562
738.507
PE(20:5_16:0)
PE 16:0_20:5
ME810415
-
-
2.561
738.507
PA(O-19:2_20:4)
PA O-19:2/20:4*
ME810236
-
-
3.070
738.543
PE(P-17:0_20:4)
PE P-17:0/20:4
ME810416
-
-
3.066
738.543
PA(22:5_16:0)
PA 16:0_22:5
ME810233
-
-
3.033
740.522
PC(33:4)
PC 33:4
ME810377
-
-
2.898
740.522
PE(20:4_16:0)
PE 16:0_20:4
ME810418
-
-
3.035
740.522
PE(36:4)
PE 36:4
ME810417
-
-
2.886
740.522
PC(O-16:2_18:2)
PC O-16:2/18:2
ME810367
-
-
2.883
740.559
TG(14:0_14:0_14:0)
TG 14:0/14:0/14:0
ME810557
-
-
3.569
740.676
PC(17:3_16:0)
PC 16:0_17:3*
ME810262
-
-
2.973
742.538
PC(33:3)
PC 33:3
ME810261
-
-
2.421
742.538
PC(33:2)
PC 33:2
ME810306
-
-
2.352
744.554
PC(O-34:2)
PC O-34:2
ME810263
-
-
2.996
744.590
PC(33:1)
PC 33:1
ME810328
-
-
2.951
746.569
PC(O-34:1)
PC O-34:1
ME810264
-
-
3.082
746.606
PA(O-20:3_20:5)
PA O-20:3/20:5*
ME810241
-
-
2.680
748.528
PC(O-15:2_20:5)
PC O-15:2/20:5
ME810308
-
-
2.980
748.528
PC(O-35:7)
PC O-35:7
ME810307
-
-
2.655
748.528
PC(P-15:2_20:4)
PC P-15:2/20:4*
ME810265
-
-
2.975
748.528
PE(O-18:2_20:5)
PE O-18:2/20:5
ME810448
-
-
2.655
748.528
PE(P-16:0_22:6)
PE P-16:0/22:6
ME810447
-
-
2.971
748.528
PC(O-34:0)
PC O-34:0
ME810266
-
-
3.178
748.621
PA(O-18:2_22:5)
PA O-18:2/22:5
ME810242
-
-
3.035
750.543
PC(O-13:1_22:5)
PC O-13:1/22:5
ME810268
-
-
3.038
750.543
PC(O-35:6)
PC O-35:6
ME810267
-
-
2.860
750.543
PE(P-18:1_20:4)
PE P-18:1/20:4
ME810444
-
-
3.036
750.543
PC(34:5)
PC 34:5
ME810343
-
-
2.679
752.522
PA(O-20:2_20:4)
PA O-20:2/20:4
ME810230
-
-
3.781
752.559
PC(O-18:4_17:1)
PC O-18:4/17:1*
ME810378
-
-
2.889
752.559
PE(P-16:0_22:4)
PE P-16:0/22:4
ME810419
-
-
3.044
752.559
PE(P-18:0_20:4)
PE P-18:0/20:4
ME810420
-
-
3.247
752.559
PC(34:4)
PC 34:4
ME810269
-
-
2.778
754.538
PE(20:4_17:0)
PE 17:0_20:4
ME810431
-
-
3.005
754.538
PC(O-35:4)
PC O-35:4
ME810368
-
-
2.892
754.575
PE(O-18:1_20:3)
PE O-18:1/20:3
ME810446
-
-
3.120
754.575
PE(P-18:0_20:3)
PE P-18:0/20:3
ME810421
-
-
3.133
754.575
TG(13:0_15:0_15:0)
TG 13:0_15:0_15:0
ME810559
-
-
3.591
754.692
SM(d38:3)
SM 38:3;O2
ME810532
-
-
2.910
755.606
PC(18:3_16:0)
PC 16:0_18:3
ME810344
-
-
2.470
756.554
PC(34:3)
PC 34:3
ME810345
-
-
2.625
756.554
SM(d38:2)
SM 38:2;O2
ME810524
-
-
3.015
757.622
PC(34:2)
PC 34:2
ME810270
-
-
2.554
758.569
SM(d38:1)
SM 38:1;O2
ME810517
-
-
3.095
759.637
PS(34:2)
PS 34:2
ME810500
-
-
2.666
760.512
PC(34:1)
PC 34:1
ME810246
-
-
3.114
760.585
PC(O-35:1)
PC O-35:1
ME810386
-
-
3.129
760.621
PC(35:7)
PC 35:7
ME810369
-
-
2.805
762.507
PS(34:1)
PS 34:1
ME810488
-
-
2.765
762.528
PC(34:0)
PC 34:0
ME810247
-
-
3.093
762.601
PC(35:6)
PC 35:6
ME810271
-
-
2.571
764.522
PE(22:6_16:0)
PE 16:0_22:6
ME810440
-
-
2.923
764.522
PC(O-14:1_22:5)
PC O-14:1/22:5
ME810273
-
-
2.893
764.559
PC(O-36:6)
PC O-36:6
ME810272
-
-
2.710
764.559
PA(22:6_18:0)
PA 18:0_22:6
ME810237
-
-
2.700
766.538
PC(35:5)
PC 35:5
ME810274
-
-
2.754
766.538
PE(20:4_18:1)
PE 18:1_20:4
ME810428
-
-
3.068
766.538
PC(O-36:5)
PC O-36:5
ME810346
-
-
2.917
766.575
PC(19:4_16:0)
PC 16:0_19:4*
ME810276
-
-
3.063
768.554
PC(35:4)
PC 35:4
ME810275
-
-
2.848
768.554
PE(20:4_18:0)
PE 18:0_20:4
ME810422
-
-
3.147
768.554
PC(O-14:1_22:3)
PC O-14:1/22:3*
ME810278
-
-
3.129
768.590
PC(O-36:4)
PC O-36:4
ME810277
-
-
2.999
768.590
TG(14:0_14:0_16:0)
TG 14:0_14:0_16:0
ME810546
-
-
3.623
768.708
PC(35:3)
PC 35:3
ME810379
-
-
2.893
770.569
PC(O-36:3)
PC O-36:3
ME810332
-
-
3.034
770.606
PC(35:2)
PC 35:2
ME810279
-
-
2.976
772.585
PC(O-36:2)
PC O-36:2
ME810331
-
-
3.056
772.621
SM(d39:1)
SM 39:1;O2
ME810525
-
-
3.161
773.653
PC(O-15:2_22:6)
PC O-15:2/22:6
ME810280
-
-
2.893
774.543
PC(O-37:8)
PC O-37:8
ME810281
-
-
3.123
774.543
PC(P-17:3_20:4)
PC P-17:3/20:4*
ME810402
-
-
3.007
774.543
PE(P-18:1_22:6)
PE P-18:1/22:6
ME810432
-
-
3.014
774.543
PC(35:1)
PC 35:1
ME810309
-
-
3.059
774.601
PC(O-36:1)
PC O-36:1
ME810329
-
-
3.120
774.637
PC(O-15:1_22:6)
PC O-15:1/22:6
ME810317
-
-
3.076
776.559
PC(36:6)
PC 36:6
ME810282
-
-
2.691
778.538
PA(O-20:2_22:5)
PA O-20:2/22:5
ME810239
-
-
3.121
778.575
PC(O-37:6)
PC O-37:6
ME810356
-
-
3.055
778.575
PE(O-40:6)
PE O-40:6
ME810441
-
-
3.062
778.575
PE(P-18:0_22:5)
PE P-18:0/22:5
ME810423
-
-
3.138
778.575
PC(36:5)
PC 36:5
ME810380
-
-
2.756
780.554
PC(O-35:2)
PC O-35:2
ME810283
-
-
3.290
780.588
PA(O-20:2_22:4)
PA O-20:2/22:4
ME810231
-
-
3.327
780.590
PC(O-15:2_22:3)
PC O-15:2/22:3
ME810310
-
-
3.167
780.590
PE(O-18:1_22:4)
PE O-18:1/22:4
ME810429
-
-
3.251
780.590
PE(P-18:0_22:4)
PE P-18:0/22:4
ME810442
-
-
3.127
780.590
PC(18:1_16:0)
PC 16:0_18:1
ME810245
-
-
3.008
782.567
PC(14:1_22:3)
PC 14:1_22:3*
ME810249
-
-
3.144
782.569
PC(36:4)
PC 36:4
ME810248
-
-
2.844
782.569
PC(O-15:1_22:3)
PC O-15:1/22:3*
ME810285
-
-
3.202
782.606
PC(O-37:4)
PC O-37:4
ME810284
-
-
3.038
782.606
TG(14:0_15:0_16:0)
TG 14:0_15:0_16:0
ME810547
-
-
3.642
782.723
SM(d40:3)
SM 40:3;O2
ME810526
-
-
3.022
783.637
PG(20:6_16:0)
PG 16:0_20:6*
ME810465
-
-
2.664
784.512
PS(20:4_16:0)
PS 16:0_20:4
ME810489
-
-
2.665
784.512
PC(36:3)
PC 36:3
ME810286
-
-
2.591
784.585
SM(d40:2)
SM 40:2;O2
ME810527
-
-
3.119
785.653
PS(18:3_18:0)
PS 18:0_18:3
ME810497
-
-
2.730
786.528
PC(36:2)
PC 36:2
ME810250
-
-
3.040
786.601
SM(d40:1)
SM 40:1;O2
ME810510
-
-
3.208
787.669
PC(37:8)
PC 37:8
ME810311
-
-
2.866
788.522
PE(20:4_20:4)
PE 20:4/20:4
ME810407
-
-
2.864
788.522
PG(36:4)
PG 36:4
ME810467
-
-
2.630
788.544
PS(18:0_18:2)
PS 18:0_18:2
ME810479
-
-
2.346
788.544
PS(36:2)
PS 36:2
ME810490
-
-
2.803
788.544
PC(36:1)
PC 36:1
ME810253
-
-
3.121
788.616
PC(37:7)
PC 37:7
ME810347
-
-
2.941
790.538
PE(22:6_18:1)
PE 18:1_22:6
ME810433
-
-
2.913
790.538
PE(22:7_18:0)
PE 18:0_22:7
ME810434
-
-
3.062
790.538
PG(36:3)
PG 36:3
ME810456
-
-
2.709
790.559
PC(37:6)
PC 37:6
ME810312
-
-
2.801
792.554
PE(18:0_22:6)
PE 18:0_22:6
ME810435
-
-
3.011
792.554
PC(O-38:6)
PC O-38:6
ME810287
-
-
2.945
792.590
PC(19:4_18:1)
PC 18:1_19:4*
ME810314
-
-
3.073
794.569
PC(37:5)
PC 37:5
ME810313
-
-
2.886
794.569
PC(O-38:5)
PC O-38:5
ME810288
-
-
3.010
794.606
PC(37:4)
PC 37:4
ME810315
-
-
2.797
796.585
PC(O-38:4)
PC O-38:4
ME810316
-
-
3.104
796.621
TG(14:0_16:0_16:0)
TG 14:0_16:0_16:0
ME810548
-
-
3.665
796.739
PG(20:6_17:0)
PG 17:0_20:6*
ME810468
-
-
2.735
798.528
PS(20:4_17:0)
PS 17:0_20:4
ME810496
-
-
2.734
798.528
PS(O-38:4)
PS O-38:4
ME810494
-
-
2.594
798.564
PC(37:3)
PC 37:3
ME810318
-
-
3.205
798.601
PC(O-38:3)
PC O-38:3
ME810389
-
-
3.153
798.637
PC(O-39:9)
PC O-39:9
ME810390
-
-
3.126
800.559
PC(37:2)
PC 37:2
ME810289
-
-
3.089
800.616
SM(d41:1)
SM 41:1;O2
ME810533
-
-
3.267
801.684
PC(38:8)
PC 38:8
ME810383
-
-
2.834
802.538
PC(O-39:8)
PC O-39:8
ME810330
-
-
3.085
802.575
PC(37:1)
PC 37:1
ME810333
-
-
3.167
802.632
PC(22:6_16:1)
PC 16:1_22:6
ME810290
-
-
2.791
804.554
PC(O-39:7)
PC O-39:7
ME810291
-
-
3.133
804.590
PC(38:6)
PC 38:6
ME810293
-
-
2.963
806.569
SM(d42:5)
SM 42:5;O2
ME810536
-
-
3.148
807.637
PG(20:6_18:2)
PG 18:2_20:6*
ME810457
-
-
2.592
808.512
PS(20:4_18:2)
PS 18:2_20:4
ME810491
-
-
2.603
808.512
PC(38:5)
PC 38:5
ME810319
-
-
2.940
808.585
PC(O-17:1_22:4)
PC O-17:1/22:4
ME810294
-
-
3.069
808.621
SM(d42:4)
SM 42:4;O2
ME810516
-
-
3.073
809.653
PG(20:6_18:1)
PG 18:1_20:6*
ME810471
-
-
2.702
810.528
PS(18:1_20:4)
PS 18:1_20:4
ME810483
-
-
2.700
810.528
PS(20:5_18:0)
PS 18:0_20:5
ME810492
-
-
2.334
810.528
PC(38:4)
PC 38:4
ME810252
-
-
3.036
810.601
TG(15:0_16:0_16:0)
TG 15:0_16:0_16:0
ME810549
-
-
3.685
810.755
SM(d42:3)
SM 42:3;O2
ME810515
-
-
3.141
811.669
PG(20:6_18:0)
PG 18:0_20:6*
ME810454
-
-
2.793
812.544
PS(18:0_20:4)
PS 18:0_20:4
ME810481
-
-
2.796
812.544
PS(20:4_18:0)
PS 18:0_20:4
ME810486
-
-
2.886
812.544
PS(38:4)
PS 38:4
ME810487
-
-
3.125
812.544
PC(38:3)
PC 38:3
ME810370
-
-
3.067
812.616
SM(d42:2)
SM 42:2;O2
ME810512
-
-
3.215
813.684
PG(20:3_18:2)
PG 18:2_20:3
ME810470
-
-
2.643
814.559
PS(18:0_20:3)
PS 18:0_20:3
ME810480
-
-
2.858
814.559
PC(38:2)
PC 38:2
ME810295
-
-
3.144
814.632
SM(d42:1)
SM 42:1;O2
ME810511
-
-
3.313
815.700
PC(38:1)
PC 38:1
ME810381
-
-
3.140
816.648
PC(O-40:7)
PC O-40:7
ME810348
-
-
2.984
818.606
PC(O-39:10)
PC O-39:10
ME810357
-
-
2.914
820.525
PC(39:6)
PC 39:6
ME810320
-
-
3.104
820.585
PC(O-40:6)
PC O-40:6
ME810334
-
-
3.009
820.621
PC(39:5)
PC 39:5
ME810382
-
-
2.993
822.601
PC(O-40:5)
PC O-40:5
ME810371
-
-
3.115
822.637
PC(39:4)
PC 39:4
ME810394
-
-
3.070
824.616
PC(O-40:4)
PC O-40:4
ME810296
-
-
3.179
824.653
TG(16:0_16:0_16:0)
TG 16:0/16:0/16:0
ME810550
-
-
3.706
824.770
PG(21:6_18:0)
PG 18:0_21:6*
ME810455
-
-
2.816
826.559
PS(21:4_18:0)
PS 18:0_21:4*
ME810504
-
-
2.806
826.559
PC(O-40:3)
PC O-40:3
ME810358
-
-
3.249
826.668
SM(d43:2)
SM 43:2;O2
ME810513
-
-
3.266
827.700
PC(22:6_16:0)
PC 16:0_22:6
ME810292
-
-
2.889
828.551
PC(17:3_23:5)
PC 17:3_23:5*
ME810297
-
-
2.825
830.569
PC(40:8)
PC 40:8
ME810298
-
-
2.938
830.569
PS(20:4_20:4)
PS 20:4/20:4
ME810484
-
-
2.580
832.512
PC(22:7_18:0)
PC 18:0_22:7*
ME810322
-
-
3.031
832.585
PC(40:7)
PC 40:7
ME810321
-
-
2.887
832.585
SM(d44:6)
SM 44:6;O2
ME810538
-
-
3.142
833.653
PS(40:7)
PS 40:7
ME810501
-
-
2.803
834.528
PC(40:6)
PC 40:6
ME810349
-
-
3.014
834.601
SM(d44:5)
SM 44:5;O2
ME810534
-
-
3.111
835.669
PG(20:6_20:2)
PG 20:2_20:6*
ME810466
-
-
2.786
836.544
PS(20:4_20:2)
PS 20:2_20:4
ME810495
-
-
2.769
836.544
PC(40:5)
PC 40:5
ME810323
-
-
3.053
836.616
PS(18:0_22:5)
PS 18:0_22:5
ME810482
-
-
2.834
838.559
PC(40:4)
PC 40:4
ME810299
-
-
3.072
838.632
TG(17:0_16:0_16:0)
TG 16:0_16:0_17:0
ME810555
-
-
3.720
838.786
SM(d44:3)
SM 44:3;O2
ME810535
-
-
3.234
839.700
PG(22:4_18:2)
PG 18:2_22:4
ME810458
-
-
2.665
840.575
PG(22:6_18:0)
PG 18:0_22:6
ME810459
-
-
2.887
840.575
PS(22:4_18:0)
PS 18:0_22:4
ME810493
-
-
2.888
840.575
PC(40:3)
PC 40:3
ME810350
-
-
3.165
840.648
SM(d44:2)
SM 44:2;O2
ME810528
-
-
3.305
841.716
SM(d44:1)
SM 44:1;O2
ME810529
-
-
3.405
843.731
PC(40:1)
PC 40:1
ME810324
-
-
3.294
844.679
PC(O-42:7)
PC O-42:7
ME810403
-
-
3.077
846.637
PC(O-43:13)
PC O-43:13*
ME810405
-
-
3.031
848.559
PC(O-42:6)
PC O-42:6
ME810359
-
-
3.128
848.653
PC(42:12)
PC 42:12
ME810384
-
-
1.795
850.538
PC(O-43:12)
PC O-43:12
ME810360
-
-
1.861
850.575
PC(O-42:5)
PC O-42:5
ME810351
-
-
3.215
850.668
PI(34:2)
PI 34:2
ME810472
-
-
2.658
852.560
PC(O-42:4)
PC O-42:4
ME810325
-
-
3.285
852.684
TG(16:0_16:0_18:0)
TG 16:0_16:0_18:0
ME810551
-
-
3.740
852.801
PC(42:10)
PC 42:10
ME810361
-
-
2.801
854.569
PG(20:6_22:6)
PG 20:6_22:6*
ME810460
-
-
2.563
856.512
PS(20:4_22:6)
PS 20:4_22:6
ME810485
-
-
2.566
856.512
PC(42:9)
PC 42:9
ME810387
-
-
2.887
856.585
PC(O-42:2)
PC O-42:2
ME810300
-
-
3.377
856.715
PS(42:9)
PS 42:9
ME810499
-
-
2.643
858.528
PC(42:8)
PC 42:8
ME810352
-
-
2.924
858.601
PC(O-42:1)
PC O-42:1
ME810335
-
-
3.449
858.731
SM(d44:4)
SM 44:4;O2
ME810537
-
-
3.166
859.666
PG(20:6_22:4)
PG 20:6_22:4*
ME810461
-
-
2.677
860.544
PC(42:7)
PC 42:7
ME810395
-
-
2.984
860.616
PG(20:6_22:3)
PG 20:6_22:3*
ME810464
-
-
2.768
862.559
PS(20:4_22:3)
PS 20:4_22:3*
ME810498
-
-
2.772
862.559
PC(42:6)
PC 42:6
ME810353
-
-
3.055
862.632
PG(22:5_20:3)
PG 20:3_22:5
ME810462
-
-
2.660
864.575
PC(42:5)
PC 42:5
ME810396
-
-
3.134
864.648
PC(42:4)
PC 42:4
ME810362
-
-
3.179
866.663
PC(42:2)
PC 42:2
ME810301
-
-
3.296
870.695
PC(O-44:7)
PC O-44:7
ME810401
-
-
3.176
874.668
PI(20:4_16:0)
PI 16:0_20:4
ME810473
-
-
2.643
876.560
PC(O-45:13)
PC O-45:13*
ME810373
-
-
2.077
876.590
PC(O-44:6)
PC O-44:6
ME810326
-
-
3.229
876.684
TG(16:0_18:1_18:1)
TG 16:0_18:1_18:1
ME810556
-
-
3.706
876.801
PC(O-45:12)
PC O-45:12*
ME810388
-
-
2.194
878.606
PC(O-44:5)
PC O-44:5
ME810354
-
-
3.295
878.700
PC(O-44:4)
PC O-44:4
ME810327
-
-
3.382
880.715
TG(16:0_18:0_18:0)
TG 16:0_18:0_18:0
ME810552
-
-
3.781
880.833
PI(18:2_18:0)
PI 18:0_18:2
ME810477
-
-
2.474
885.546
PC(44:8)
PC 44:8
ME810363
-
-
3.016
886.632
PI(18:1_18:0)
PI 18:0_18:1
ME810476
-
-
2.786
887.562
PC(45:12)
PC 45:12*
ME810397
-
-
2.315
892.585
PA(30:1_19:3)
PA 19:3_30:1*
ME810235
-
-
3.318
896.710
PC(44:2)
PC 44:2
ME810302
-
-
3.401
898.726
PI(20:4_18:1)
PI 18:1_20:4
ME810475
-
-
2.479
902.575
TG(18:1_18:1_18:1)
TG 18:1/18:1/18:1
ME810563
-
-
3.714
902.817
PI(20:4_18:0)
PI 18:0_20:4
ME810474
-
-
2.788
904.591
TG(18:0_18:0_18:0)
TG 18:0/18:0/18:0
ME810558
-
-
3.803
908.864
PC(O-49:12)
PC O-49:12*
ME810364
-
-
2.516
934.668
PI(O-43:9)
PI O-43:9*
ME810478
-
-
2.649
955.567
PG(O-30:3_20:4)
PG O-30:3/20:4*
ME810469
-
-
3.642
964.736
TG(51:14_9:0)
TG 51:14_9:0*
ME810553
-
-
3.654
964.739
PG(O-30:1_20:4)
PG O-30:1/20:4*
ME810463
-
-
3.733
968.768
TG(20:4_20:4_20:4)
TG 20:4/20:4/20:4
ME810554
-
-
3.742
968.770
Analysis: Reversed phase NEGATIVE ION MODE
Select
Metabolite Name
RefMet Name/Standardized Name*
WorkBenchMetabolite_ID
PubChemCompound_ID
Kegg Id
Retentiontime/index
m/z ratio
FA(12:0)
Lauric acid
ME810599
-
-
2.103
199.170
FA(14:0)
Myristic acid
ME810598
-
-
2.427
227.202
FA(15:1)
Pentadecenoic acid
ME810586
-
-
2.359
239.202
FA(15:0)
Pentadecylic acid
ME810566
-
-
2.567
241.217
FA(16:3)
Hexadecatrienoic acid
ME810592
-
-
0.988
249.186
FA(16:1)
Hexadecenoic acid
ME810571
-
-
2.509
253.217
FA(17:1)
Heptadecenoic acid
ME810587
-
-
2.643
267.233
FA(17:0)
Margaric acid
ME810594
-
-
2.788
269.249
FA(18:3)
Octadecatrienoic acid
ME810573
-
-
2.432
277.217
FA(18:2)
Octadecadienoic acid
ME810574
-
-
2.201
279.233
FA(18:1)
Octadecenoic acid
ME810597
-
-
2.367
281.249
FA(18:0)
Stearic acid
ME810593
-
-
2.856
283.264
FA(19:0)
Nonadecylic acid
ME810572
-
-
2.997
297.280
FA(20:5)
Eicosapentaenoic acid
ME810575
-
-
2.616
301.217
FA(20:4)
Arachidonic acid
ME810576
-
-
2.203
303.233
FA(20:3)
Eicosatrienoic acid
ME810577
-
-
2.668
305.249
FA(20:2)
Eicosadienoic acid
ME810583
-
-
2.809
307.264
FA(20:1)
Eicosenoic acid
ME810585
-
-
2.940
309.280
FA(20:0)
Arachidic acid
ME810595
-
-
3.092
311.296
FA(21:0)
Heneicosylic acid
ME810600
-
-
2.980
325.311
FA(22:6)
DHA
ME810578
-
-
2.498
327.233
FA(22:5)
Docosapentaenoic acid
ME810579
-
-
2.633
329.249
FA(22:4)
Docosatetraenoic acid
ME810580
-
-
2.749
331.264
FA(22:3)
Docosatrienoic acid
ME810588
-
-
2.886
333.280
FA(22:1)
Docosenoic acid
ME810590
-
-
3.109
337.311
FA(23:0)
Tricosylic acid
ME810596
-
-
3.331
353.343
FA(24:2)
Tetracosadienoic acid
ME810591
-
-
3.150
363.327
FA(24:1)
Tetracosenoic acid
ME810589
-
-
3.257
365.343
FA(22:0)
Behenic acid
ME810584
-
-
2.800
369.301
FA(25:0)
Hyenic acid
ME810601
-
-
3.438
381.374
FA(24:0)
Lignoceric acid
ME810581
-
-
2.984
397.332
FA(28:7)
Octacosaheptaenoic acid
ME810582
-
-
3.175
409.311
FA(27:0)
Carboceric acid
ME810565
-
-
3.325
409.405
FA(26:0)
Cerotic acid
ME810567
-
-
3.108
425.364
FA(29:0)
Nonacosylic acid
ME810568
-
-
3.637
437.436
FA(30:0)
Melissic acid
ME810569
-
-
3.480
451.452
LPE(16:0)
LPE 16:0
ME810606
-
-
2.406
452.278
FA(28:0)
Montanic acid
ME810570
-
-
3.331
453.395
LPE(P-18:1)
LPE P-18:1
ME810614
-
-
2.556
462.299
LPE(P-18:0)
LPE P-18:0
ME810615
-
-
2.730
464.315
LPE(18:1)
LPE 18:1
ME810608
-
-
2.423
478.294
LPE(18:0)
LPE 18:0
ME810607
-
-
2.632
480.310
LPE(20:4)
LPE 20:4
ME810610
-
-
2.260
500.278
LPE(20:3)
LPE 20:3
ME810609
-
-
2.408
502.294
LPG(18:1)
LPG 18:1
ME810619
-
-
2.237
509.288
LPS(18:0)
LPS 18:0
ME810623
-
-
2.398
524.299
LPE(22:5)
LPE 22:5
ME810613
-
-
2.304
526.294
LPE(22:4)
LPE 22:4
ME810612
-
-
2.445
528.310
LPE(22:3)
LPE 22:3
ME810611
-
-
2.582
530.325
LPG(20:4)
LPG 20:4
ME810620
-
-
2.084
531.273
LPG(20:3)
LPG 20:3
ME810616
-
-
2.165
533.288
LPG(22:5)
LPG 22:5
ME810618
-
-
2.223
557.288
LPG(22:4)
LPG 22:4
ME810617
-
-
2.266
559.304
LPC(O-19:1)
LPC O-19:1*
ME810602
-
-
2.513
566.383
LPC(O-19:0)
LPC O-19:0*
ME810603
-
-
2.690
568.398
PC(6:0_16:1)
PC 6:0_16:1*
ME810669
-
-
2.791
576.367
PE(8:0_16:1)
PE 8:0_16:1*
ME810693
-
-
2.790
576.367
LPC(19:2)
LPC 19:2
ME810604
-
-
2.267
578.346
LPC(19:1)
LPC 19:1
ME810605
-
-
2.428
580.362
Cer(d18:2_17:0)
Cer 18:2;O2/17:0
ME810564
-
-
3.368
594.510
LPI(18:0)
LPI 18:0
ME810621
-
-
2.396
599.320
LPI(20:3)
LPI 20:3
ME810622
-
-
2.214
621.305
PA(16:0_18:2)
PA 16:0_18:2
ME810624
-
-
3.207
671.466
PE(16:0_16:1)
PE 16:0_16:1
ME810709
-
-
3.331
688.492
PE(16:0_16:0)
PE 16:0/16:0
ME810698
-
-
3.276
690.508
PA(16:0_20:4)
PA 16:0_20:4
ME810625
-
-
3.200
695.466
PC(O-14:1_18:2)
PC O-14:1/18:2
ME810636
-
-
3.416
698.513
PE(O-16:1_18:2)
PE O-16:1/18:2
ME810681
-
-
3.412
698.513
PC(O-14:1_18:1)
PC O-14:1/18:1
ME810637
-
-
3.472
700.529
PE(O-16:1_18:1)
PE O-16:1/18:1
ME810680
-
-
3.478
700.529
PE(15:0_18:1)
PE 15:0_18:1
ME810717
-
-
3.373
702.508
PC(9:0_18:0)
PC 9:0_18:0*
ME810643
-
-
3.043
708.482
PE(O-15:1_20:4)
PE O-15:1/20:4
ME810694
-
-
3.334
708.497
PE(14:0_20:4)
PE 14:0_20:4
ME810688
-
-
3.238
710.477
PE(16:0_18:3)
PE 16:0_18:3
ME810710
-
-
3.295
712.492
PE(16:0_18:2)
PE 16:0_18:2
ME810674
-
-
3.350
714.508
PE(O-17:1_18:1)
PE O-17:1/18:1
ME810695
-
-
3.506
714.544
PE(16:0_18:1)
PE 16:0_18:1
ME810673
-
-
3.424
716.524
PE(O-16:1_20:5)
PE O-16:1/20:5
ME810684
-
-
3.340
720.497
PC(O-14:1_20:4)
PC O-14:1/20:4
ME810644
-
-
3.404
722.513
PE(O-16:1_20:4)
PE O-16:1/20:4
ME810683
-
-
3.401
722.513
PE(15:0_20:4)
PE 15:0_20:4
ME810712
-
-
3.302
724.492
PE(O-16:1_20:3)
PE O-16:1/20:3
ME810682
-
-
3.425
724.529
PE(O-18:2_18:1)
PE O-18:2/18:1
ME810713
-
-
3.485
726.544
PE(17:0_18:2)
PE 17:0_18:2
ME810711
-
-
3.390
728.524
PC(O-16:1_18:1)
PC O-16:1/18:1
ME810638
-
-
3.546
728.560
PE(O-18:1_18:1)
PE O-18:1/18:1
ME810696
-
-
3.550
728.560
PE(16:2_20:4)
PE 16:2_20:4*
ME810720
-
-
3.231
734.477
SM(d33:0)
SM 33:0;O2
ME810761
-
-
3.191
735.566
PE(16:0_20:5)
PE 16:0_20:5
ME810697
-
-
3.275
736.492
PE(O-17:1_20:4)
PE O-17:1/20:4
ME810686
-
-
3.448
736.529
PE(16:0_20:4)
PE 16:0_20:4
ME810675
-
-
3.348
738.508
PE(18:1_18:2)
PE 18:1_18:2
ME810716
-
-
3.372
740.524
PC(16:0_18:2)
PC 16:0_18:2
ME810628
-
-
3.317
742.539
PE(18:1_18:1)
PE 18:1/18:1
ME810678
-
-
3.444
742.539
PC(16:0_18:1)
PC 16:0_18:1
ME810639
-
-
3.247
744.555
PE(18:0_18:1)
PE 18:0_18:1
ME810676
-
-
3.509
744.555
PE(O-18:3_20:4)
PE O-18:3/20:4
ME810719
-
-
3.375
746.513
PG(16:0_18:1)
PG 16:0_18:1
ME810725
-
-
3.211
747.518
PE(17:1_20:4)
PE 17:1_20:4
ME810714
-
-
3.310
750.508
PC(O-14:1_22:4)
PC O-14:1/22:4
ME810626
-
-
3.477
750.544
PE(O-16:1_22:4)
PE O-16:1/22:4
ME810685
-
-
3.415
750.544
PE(O-18:1_20:4)
PE O-18:1/20:4
ME810687
-
-
3.569
750.544
PE(17:0_20:4)
PE 17:0_20:4
ME810699
-
-
3.391
752.524
PC(13:1_18:1)
PC 13:1_18:1*
ME810672
-
-
3.211
760.513
PS(16:0_18:1)
PS 16:0_18:1
ME810750
-
-
3.207
760.513
PE(O-17:1_22:6)
PE O-17:1/22:6
ME810718
-
-
3.418
760.529
SM(d35:1)
SM 35:1;O2
ME810758
-
-
3.272
761.581
PE(18:2_20:4)
PE 18:2_20:4
ME810700
-
-
3.310
762.508
PE(18:1_20:4)
PE 18:1_20:4
ME810679
-
-
3.365
764.524
PE(O-17:1_22:4)
PE O-17:1/22:4
ME810701
-
-
3.502
764.560
PC(16:0_20:4)
PC 16:0_20:4
ME810634
-
-
3.317
766.539
PE(18:0_20:4)
PE 18:0_20:4
ME810677
-
-
3.437
766.539
PC(16:0_20:3)
PC 16:0_20:3
ME810657
-
-
3.355
768.555
PC(18:1_18:2)
PC 18:1_18:2
ME810658
-
-
3.494
768.555
PE(18:0_20:3)
PE 18:0_20:3
ME810702
-
-
3.479
768.555
PG(18:2_18:2)
PG 18:2/18:2
ME810722
-
-
3.103
769.503
PE(18:1_20:1)
PE 18:1_20:1
ME810703
-
-
3.422
770.571
PG(18:1_18:2)
PG 18:1_18:2
ME810733
-
-
3.124
771.518
PC(O-16:2_22:6)
PC O-16:2/22:6
ME810665
-
-
3.395
772.529
PE(O-18:2_22:6)
PE O-18:2/22:6
ME810721
-
-
3.398
772.529
PC(O-16:2_22:4)
PC O-16:2/22:4
ME810670
-
-
3.496
776.560
PE(O-18:2_22:4)
PE O-18:2/22:4
ME810715
-
-
3.496
776.560
PC(O-16:1_22:4)
PC O-16:1/22:4
ME810631
-
-
3.539
778.576
PE(O-18:0_22:5)
PE O-18:0/22:5
ME810704
-
-
3.543
778.576
PE(17:0_22:4)
PE 17:0_22:4
ME810705
-
-
3.360
780.555
PC(O-16:1_22:3)
PC O-16:1/22:3
ME810652
-
-
3.548
780.591
PE(O-18:1_22:3)
PE O-18:1/22:3
ME810689
-
-
3.594
780.591
PS(16:0_20:4)
PS 16:0_20:4
ME810746
-
-
3.117
782.498
SM(d37:2)
SM 37:2;O2
ME810764
-
-
3.306
787.597
PE(18:1_22:6)
PE 18:1_22:6
ME810706
-
-
3.326
788.524
PE(20:2_20:4)
PE 20:2_20:4
ME810707
-
-
3.394
790.539
PC(17:0_16:1)
PC 16:1_17:0
ME810645
-
-
3.300
790.560
PE(18:1_22:4)
PE 18:1_22:4
ME810708
-
-
3.435
792.555
PC(16:0_17:0)
PC 16:0_17:0
ME810629
-
-
3.378
792.576
PG(18:2_20:4)
PG 18:2_20:4
ME810729
-
-
3.029
793.503
PE(18:0_22:4)
PE 18:0_22:4
ME810692
-
-
3.494
794.571
PG(18:2_20:3)
PG 18:2_20:3
ME810726
-
-
3.096
795.518
PS(17:0_20:4)
PS 17:0_20:4
ME810757
-
-
3.170
796.513
PS(O-18:0_20:4)
PS O-18:0/20:4
ME810747
-
-
3.286
796.550
PE(18:0_22:3)
PE 18:0_22:3
ME810690
-
-
3.546
796.586
PG(18:1_20:3)
PG 18:1_20:3
ME810730
-
-
3.145
797.534
PC(O-17:1_18:2)
PC O-17:1/18:2
ME810664
-
-
3.373
800.581
PC(O-17:0_18:2)
PC O-17:0/18:2
ME810662
-
-
3.405
802.597
PC(O-17:0_18:1)
PC O-17:0/18:1*
ME810640
-
-
3.452
804.612
PS(18:2_20:4)
PS 18:2_20:4
ME810748
-
-
3.066
806.498
PC(17:1_18:2)
PC 17:1_18:2
ME810671
-
-
3.258
814.560
PE(22:3_20:4)
PE 20:4_22:3*
ME810691
-
-
3.164
816.555
PC(17:0_18:2)
PC 17:0_18:2
ME810630
-
-
3.331
816.576
PG(20:4_20:4)
PG 20:4/20:4
ME810724
-
-
3.018
817.503
PC(17:0_18:1)
PC 17:0_18:1
ME810641
-
-
3.389
818.592
PG(18:2_22:5)
PG 18:2_22:5
ME810723
-
-
3.078
819.518
PG(18:2_22:4)
PG 18:2_22:4
ME810731
-
-
3.146
821.534
PG(18:1_22:4)
PG 18:1_22:4
ME810727
-
-
3.174
823.549
PS(18:0_21:4)
PS 18:0_21:4*
ME810749
-
-
3.233
824.545
PC(O-17:1_20:4)
PC O-17:1/20:4
ME810666
-
-
3.361
824.581
PC(O-17:0_20:4)
PC O-17:0/20:4
ME810659
-
-
3.384
826.597
PC(O-19:2_18:1)
PC O-19:2/18:1*
ME810647
-
-
3.460
828.612
PC(18:0_18:2)
PC 18:0_18:2
ME810642
-
-
3.375
830.592
PC(O-19:1_18:1)
PC O-19:1/18:1*
ME810660
-
-
3.477
830.628
PS(20:3_20:4)
PS 20:3_20:4
ME810752
-
-
3.102
832.513
PC(18:0_18:1)
PC 18:0_18:1
ME810653
-
-
3.441
832.607
PC(O-19:0_18:1)
PC O-19:0/18:1*
ME810635
-
-
3.541
832.644
PI(16:0_18:2)
PI 16:0_18:2
ME810736
-
-
3.116
833.519
PS(18:0_22:6)
PS 18:0_22:6
ME810751
-
-
3.207
834.529
PI(16:0_18:0)
PI 16:0_18:0
ME810741
-
-
3.256
837.550
PC(17:0_20:5)
PC 17:0_20:5
ME810654
-
-
3.288
838.560
PS(18:0_22:4)
PS 18:0_22:4
ME810755
-
-
3.285
838.560
PC(18:2_19:2)
PC 18:2_19:2*
ME810646
-
-
3.310
840.576
SM(d41:3)
SM 41:3;O2
ME810760
-
-
3.425
841.644
PC(17:0_20:3)
PC 17:0_20:3
ME810648
-
-
3.361
842.592
SM(d41:2)
SM 41:2;O2
ME810759
-
-
3.488
843.660
PC(18:1_19:1)
PC 18:1_19:1
ME810667
-
-
3.420
844.607
PG(20:3_22:5)
PG 20:3_22:5
ME810735
-
-
3.107
845.534
PC(19:0_18:1)
PC 18:1_19:0
ME810655
-
-
3.485
846.623
PG(20:3_22:4)
PG 20:3_22:4
ME810732
-
-
3.165
847.549
PC(O-19:2_20:4)
PC O-19:2/20:4*
ME810627
-
-
3.378
850.597
PC(O-19:1_20:4)
PC O-19:1/20:4*
ME810632
-
-
3.403
852.612
PC(18:0_20:4)
PC 18:0_20:4
ME810649
-
-
3.372
854.592
PC(O-19:0_20:4)
PC O-19:0/20:4*
ME810663
-
-
3.481
854.628
PS(20:3_22:6)
PS 20:3_22:6
ME810756
-
-
3.198
856.513
PI(16:0_20:4)
PI 16:0_20:4
ME810737
-
-
3.110
857.519
PS(20:4_22:4)
PS 20:4_22:4
ME810745
-
-
3.133
858.529
PS(22:3_20:4)
PS 20:4_22:3*
ME810753
-
-
3.198
860.545
PI(18:0_18:2)
PI 18:0_18:2
ME810738
-
-
3.216
861.550
PC(19:2_20:4)
PC 19:2_20:4*
ME810650
-
-
3.262
864.576
PC(19:1_20:4)
PC 19:1_20:4
ME810668
-
-
3.340
866.592
SM(d43:4)
SM 43:4;O2
ME810762
-
-
3.444
867.660
PC(17:0_22:4)
PC 17:0_22:4
ME810661
-
-
3.413
868.607
PG(22:5_22:5)
PG 22:5/22:5
ME810728
-
-
2.852
869.534
SM(d43:3)
SM 43:3;O2
ME810763
-
-
3.501
869.675
PG(22:4_22:5)
PG 22:4_22:5
ME810734
-
-
3.150
871.549
PI(18:1_20:4)
PI 18:1_20:4
ME810740
-
-
3.135
883.534
PI(18:0_20:4)
PI 18:0_20:4
ME810743
-
-
3.215
885.550
PI(18:0_20:3)
PI 18:0_20:3
ME810739
-
-
3.252
887.566
PC(21:4_20:4)
PC 20:4_21:4*
ME810656
-
-
3.252
888.576
PS(24:3_20:4)
PS 20:4_24:3*
ME810754
-
-
3.261
888.576
PC(19:0_22:6)
PC 19:0_22:6
ME810633
-
-
3.364
892.607
PC(19:0_22:4)
PC 19:0_22:4
ME810651
-
-
3.482
896.639
PI(22:4_18:0)
PI 18:0_22:4
ME810744
-
-
3.278
913.581
PI(26:1_14:2)
PI 14:2_26:1*
ME810742
-
-
3.098
915.597
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