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Analysis: ESI/QTOF positive ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
CholineCholineME655957305C001140.443104.109
PC (16:0/16:0)PC 16:0/16:0ME655975452110C001575.516734.569
CholesterolCholesterolME6559565997C001874.89369.351
Acylcarnitine C16:0CAR 16:0ME65595211953816C029901.57400.348
LPC (16:0)LPC 16:0ME655968460602C042301.453496.34
HydromorphoneHydromorphoneME6559675284570C070420.682286.147
1-hexadecyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glyce...PC O-16:0/20:5ME65594916759365-6.008770.602
1-Octadecanoyl-sn-glycero-3-phosphoethanolamineLPE 18:0/0:0ME6559509547068-2.315482.319
1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolami...PE 18:0/18:1ME6559519546742-6.258728.565
Acylcarnitine C18:1CAR 18:1ME6559536441392-1.721426.356
Ceramide (d40:1)Cer 40:1;O2ME6559545283567-7.747622.613
Ceramide (d42:2)Cer 42:2;O2ME6559555283568-7.788648.628
DG (30:0)DG 30:0ME655958--6.222558.511
DG (32:0)DG 32:0ME655959--6.919586.54
DG (34:1)DG 34:1ME655960--6.975617.512
DG (34:2)DG 34:2ME655961--6.433610.542
DG (36:2)DG 36:2ME655962--7.03643.528
DG (36:3)DG 36:3ME655963--6.488641.513
DG (38:4)DG 38:4ME655964--6.975662.566
DG (38:5)DG 38:5ME655965--6.323660.554
Gal-Gal-Cer(d18:1/16:0) or Lactosylceramide(d18:1/...LacCer 18:1;O2/16:0ME65596644260140-4.82862.624
LPC (18:0)LPC 18:0ME65596924779527-2.252524.37
LPC (18:1)LPC 18:1ME65597053480465-1.571522.353
LPC (18:2)LPC 18:2ME65597156955896-1.146520.335
LPC (20:4)LPC 20:4ME65597253480469-1.109544.34
N-Tetracosenoyl-4-sphingenyl-1-O-phosphorylcholineSM 18:1;O2/24:1ME655973--6.818813.683
Oleoyl ethylamideOleoyl-EAME655974--3.19310.31
PC (30:0)PC 30:0ME655976--4.867706.541
PC (30:1)PC 30:1ME655977--4.367704.519
PC (31:0)PC 31:0ME655978--5.184720.557
PC (32:0)PC 32:0ME655979--5.524756.562
PC (32:2)PC 32:2ME655980--4.481730.538
PC (33:1)PC 33:1ME655981--5.269746.568
PC (33:2)PC 33:2ME655982--4.805744.558
PC (34:0)PC 34:0ME655983--6.198762.6
PC (34:1)PC 34:1ME655984--5.594760.585
PC (34:2)PC 34:2ME655985--5.091758.57
PC (34:3)PC 34:3ME655986--4.638756.552
PC (34:4)PC 34:4ME655987--4.4754.527
PC (35:1)PC 35:1ME655988--5.927774.598
PC (35:2)PC 35:2ME655989--5.422772.593
PC (36:1)PC 36:1ME655990--6.266788.616
PC (36:2)PC 36:2ME655991--5.74786.601
PC (36:3) APC 36:3ME655992--5.181784.582
PC (36:4)PC 36:4ME655993--5782.568
PC (36:5)PC 36:5ME655994--4.595780.552
PC (37:4)PC 37:4ME655995--5.329796.585
PC (38:2)PC 38:2ME655996--6.317814.634
PC (38:3)PC 38:3ME655997--5.883812.613
PC (38:4) APC 38:4ME655998--5.644810.598
PC (38:5) APC 38:5ME655999--5.055808.583
PC (38:6) APC 38:6ME656000--4.851806.567
PC (40:4)PC 40:4ME656001--6.109838.624
PC (40:5) BPC 40:5ME656002--5.664836.612
PC (40:6) APC 40:6ME656003--5.132834.599
PC (40:6) BPC 40:6ME656004--5.485834.598
PC (40:8)PC 40:8ME656005--4.471830.566
PC (o-32:0)PC O-32:0ME656006--5.945720.586
PC (p-32:0) or PC (o-32:1)PC P-32:0 or PC O-32:1ME656007--5.821718.568
PC (p-34:1) or PC (o-34:2) APC P-34:1 or PC O-34:2ME656008--5.482744.584
PC (p-34:1) or PC (o-34:2) BPC P-34:1 or PC O-34:2ME656009--5.922744.585
PC (p-34:2) or PC (o-34:3)PC P-34:2 or PC O-34:3ME656010--5.377742.572
PC (p-36:4) or PC (o-36:5)PC P-36:4 or PC O-36:5ME656011--5.26766.57
PC (p-38:4) A or PC (o-38:5) APC P-38:4 or PC O-38:5ME656012--5.511794.6
PC (p-38:5) or PC (o-38:6)PC P-38:5 or PC O-38:6ME656013--5.331792.586
PE (36:1)PE 36:1ME656014--6.439746.571
PE (p-36:4) or PE (o-36:5)PE P-36:4 or PE O-36:5ME656015--5.455724.526
PE (p-38:4) or PE (o-38:5)PE P-38:4 or PE O-38:5ME656016--6.099752.557
PE (p-40:5) or PE (o-40:6)PE P-40:5 or PE O-40:6ME656017--6.134778.569
plasmenyl-PC (36:3)PC P-36:3ME656018--5.101790.573
plasmenyl-PE (34:1)PE P-34:1ME656019--6.095702.541
plasmenyl-PE (34:2)PE P-34:2ME656020--5.574700.53
plasmenyl-PE (36:1)PE P-36:1ME656021--6.782730.574
plasmenyl-PE (38:3)PE P-38:3ME656022--6.417754.571
plasmenyl-PE (38:5)PE P-38:5ME656023--5.499750.543
plasmenyl-PE (40:4)PE P-40:4ME656024--6.609780.589
SM (33:1)SM 33:1;O2ME656025--4.475689.557
SM (34:0)SM 34:0;O2ME656026--5.023705.588
SM (d16:1/20:0)SM 16:1;O2/20:0ME65602752931165-5.46731.605
SM (d16:1/20:1)SM 16:1;O2/20:1ME65602852931157-4.895729.587
SM (d18:1/14:0)SM 18:1;O2/14:0ME65602911433862-4.177675.541
SM (d18:1/16:0)SM 18:1;O2/16:0ME6560309939941-4.817703.573
SM (d18:1/16:1)SM 18:1;O2/16:1ME65603152931145-4.274701.557
SM (d18:2/23:0)SM 18:2;O2/23:0ME65603252931209-6.598799.665
SM (d18:2/24:1)SM 18:2;O2/24:1ME65603352931215-6.246811.662
SM (d38:1)SM 38:1;O2ME656034--6.156759.635
SM (d40:1)SM 40:1;O2ME656035--6.849787.667
SM (d40:2) BSM 40:2;O2ME656036--6.256785.651
SM (d41:1)SM 41:1;O2ME656037--7.197801.684
TG (42:0)TG 42:0ME656038--9.383740.676
TG (42:1)TG 42:1ME656039--8.884738.661
TG (44:1)TG 44:1ME656040--9.411766.692
TG (44:2)TG 44:2ME656041--8.964764.676
TG (46:0)TG 46:0ME656042--10.342796.739
TG (46:1)TG 46:1ME656043--9.903794.723
TG (46:2)TG 46:2ME656044--9.471792.707
TG (46:3)TG 46:3ME656045--9.012790.69
TG (48:0)TG 48:0ME656046--10.757824.768
TG (48:1)TG 48:1ME656047--10.355822.755
TG (48:2)TG 48:2ME656048--9.944820.74
TG (48:3)TG 48:3ME656049--9.513818.723
TG (49:0)TG 49:0ME656050--10.888838.785
TG (49:1)TG 49:1ME656051--10.564836.77
TG (49:2)TG 49:2ME656052--10.157834.754
TG (49:3)TG 49:3ME656053--9.758832.737
TG (50:0)TG 50:0ME656054--11.16852.801
TG (50:1)TG 50:1ME656055--10.748855.738
TG (50:2)TG 50:2ME656056--10.377848.768
TG (50:3)TG 50:3ME656057--9.985846.754
TG (50:4)TG 50:4ME656058--9.596844.738
TG (50:5)TG 50:5ME656059--9.194842.72
TG (51:0)TG 51:0ME656060--11.277866.813
TG (51:1)TG 51:1ME656061--10.924864.802
TG (51:2)TG 51:2ME656062--10.579862.787
TG (51:3)TG 51:3ME656063--10.207860.769
TG (51:4)TG 51:4ME656064--9.84858.753
TG (52:0)TG 52:0ME656065--11.522880.831
TG (52:1)TG 52:1ME656066--11.163878.817
TG (52:4)TG 52:4ME656067--10.054872.765
TG (52:5)TG 52:5ME656068--9.684870.753
TG (52:6)TG 52:6ME656069--9.367868.736
TG (53:1)TG 53:1ME656070--11.334892.832
TG (53:2)TG 53:2ME656071--10.971890.818
TG (53:3)TG 53:3ME656072--10.603888.802
TG (53:4)TG 53:4ME656073--10.24886.785
TG (54:1)TG 54:1ME656074--11.523906.848
TG (54:2)TG 54:2ME656075--11.169904.833
TG (54:5)TG 54:5ME656076--10.196898.783
TG (54:6)TG 54:6ME656077--9.751896.769
TG (54:7) BTG 54:7ME656078--9.579894.752
TG (55:1)TG 55:1ME656079--11.689920.863
TG (55:2)TG 55:2ME656080--11.341918.847
TG (55:3)TG 55:3ME656081--10.984916.832
TG (55:4)TG 55:4ME656082--10.656914.814
TG (56:1)TG 56:1ME656083--11.807934.88
TG (56:2)TG 56:2ME656084--11.519932.865
TG (56:3)TG 56:3ME656085--11.166930.849
TG (56:5)TG 56:5ME656086--10.594926.812
TG (56:6)TG 56:6ME656087--10.306924.801
TG (56:7)TG 56:7ME656088--10.012922.783
TG (56:8)TG 56:8ME656089--9.728920.761
TG (57:2)TG 57:2ME656090--11.689946.878
TG (57:3)TG 57:3ME656091--11.351944.862
TG (58:1)TG 58:1ME656092--11.952962.911
TG (58:2)TG 58:2ME656093--11.803960.895
TG (58:3)TG 58:3ME656094--11.516958.88
TG (58:4) ATG 58:4ME656095--11.196956.864
TG (58:6)TG 58:6ME656096--10.623952.831
TG (58:7)TG 58:7ME656097--10.317950.816
TG (58:8)TG 58:8ME656098--10.132953.757
TG (58:9)TG 58:9ME656099--9.76946.781
TG (60:2)TG 60:2ME656100--11.95988.928
TG (60:3)TG 60:3ME656101--11.797986.911
TG (60:4)TG 60:4ME656102--11.535984.895
TG (62:2)TG 62:2ME656103--12.041016.96
TG (62:3)TG 62:3ME656104--11.9441014.943


Analysis: ESI/QTOF negative ion mode

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
Cer (d34:1)Cer 34:1;O2ME656105--5.663572.481
Cer (d38:1)Cer 38:1;O2ME656106--7.079628.544
Cer (d39:1)Cer 39:1;O2ME656107--7.429652.585
Cer (d40:1)Cer 40:1;O2ME656108--7.757666.599
Cer (d40:2)Cer 40:2;O2ME656109--7.172664.586
Cer (d41:1)Cer 41:1;O2ME656110--8.072680.618
FA (18:1)Octadecenoic acidME656111--3.24281.249
PC (32:0)PC 32:0ME656112--5.529778.56
PC (32:1)PC 32:1ME656113--4.972776.544
PC (34:1)PC 34:1ME656114--5.6804.575
PC (34:2)PC 34:2ME656115--5.103802.56
PC (36:1)PC 36:1ME656116--6.274832.607
PC (36:2)PC 36:2ME656117--5.75830.591
PC (36:3)PC 36:3ME656118--5.183828.575
PC (36:4) BPC 36:4ME656119--5.005826.56
PC (38:4)PC 38:4ME656120--5.647854.591
PE (34:1) BPE 34:1ME656121--5.772716.523
PE (36:2) BPE 36:2ME656122--5.917742.538
PE (38:4) BPE 38:4ME656123--5.814766.539
PI (38:4)PI 38:4ME656124--4.982885.549
plasmenyl-PC (34:2)PC P-34:2ME656125--5.391786.562
plasmenyl-PC (36:4)PC P-36:4ME656126--5.273810.563
plasmenyl-PE (34:1)PE P-34:1ME656127--6.107700.525
plasmenyl-PE (34:2)PE P-34:2ME656128--5.579698.512
plasmenyl-PE (36:1)PE P-36:1ME656129--6.791728.559
plasmenyl-PE (36:2)PE P-36:2ME656130--6.254726.543
plasmenyl-PE (36:4)PE P-36:4ME656131--5.455722.512
plasmenyl-PE (38:4)PE P-38:4ME656132--6.12750.543
plasmenyl-PE (38:5)PE P-38:5ME656133--5.515748.528
SM (d34:1)SM 34:1;O2ME656134--4.799747.565
SM (d36:1)SM 36:1;O2ME656135--5.471775.595
SM (d38:1)SM 38:1;O2ME656136--6.164803.627
SM (d40:1)SM 40:1;O2ME656137--6.857831.659
SM (d42:1)SM 42:1;O2ME656138--7.531859.691
SM (d42:2)SM 42:2;O2ME656139--6.826857.674


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