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Analysis: UPLC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
CE (18:1)CE 18:1ME1181505283632C1464111.0525-
CE (20:4)CE 20:4ME11815153480459-10.3465-
CE (22:6)CE 22:6ME11815214274978C0253010.101719.574
Ceramide (d18:1/23:0)Cer 18:1;O2/23:0ME11815352931115-8.144-
Ceramide (d40:1)Cer 40:1;O2ME1181545283567-7.812333333-
Ceramide (d42:1)Cer 42:1;O2ME1181555283571-8.458-
Ceramide (d42:2)Cer 42:2;O2ME1181565283568-7.779666667-
CholesterolCholesterolME1181575997C001874.971369.3517
Gal-Gal-Cer(d18:1/16:0) or Lactosylceramide(d18:1/...LacCer 18:1;O2/16:0ME11815844260140-5.004884.6153
GlcCer (d40:1)GlcCer 40:1;O2ME118159--7.146666667-
GlcCer (d42:1)GlcCer 42:1;O2ME118160--7.791666667-
GlcCer (d42:2)GlcCer 42:2;O2ME118161--7.121-
LPC (16:0)LPC 16:0ME118162460602C042301.6496.3399
LPC (18:0)LPC 18:0ME118163--2.371524.3712
LPC (18:1)LPC 18:1ME118164--1.748522.3556
PC (28:0)PC 28:0ME118165--4.338678.5063
PC (30:0)PC 30:0ME118166--4.933-
PC (30:1)PC 30:1ME118167--4.48704.5224
PC (31:0)PC 31:0ME118168--5.255720.5549
PC (32:0)PC 32:0ME118169--5.5815-
PC (32:1)PC 32:1ME118170--5.003732.5539
PC (33:0)PC 33:0ME118171--5.975748.5903
PC (33:1)PC 33:1ME118172--5.328746.5687
PC (34:0)PC 34:0ME118173--6.2485-
PC (34:1)PC 34:1ME118174--5.64760.5848
PC (34:2)PC 34:2ME118175--5.156758.5686
PC (34:3)PC 34:3ME118176--4.779756.5531
PC (34:4)PC 34:4ME118177--4.456754.5376
PC (35:1)PC 35:1ME118178--5.965774.5971
PC (36:1)PC 36:1ME118179--6.311-
PC (36:2)PC 36:2ME118180--5.768786.6007
PC (36:3)PC 36:3ME118181--5.298784.5837
PC (36:4)PC 36:4ME118182--5.0535-
PC (36:5)PC 36:5ME118183--4.584780.5532
PC (38:2)PC 38:2ME118184--6.38814.6351
PC (38:3)PC 38:3ME118185--5.964812.6133
PC (38:4)PC 38:4ME118186--5.706-
PC (38:5)PC 38:5ME118187--5.108-
PC (38:6)PC 38:6ME118188--4.913-
PC (40:4)PC 40:4ME118189--6.118838.6243
PC (40:5)PC 40:5ME118190--5.7305-
PC (40:6)PC 40:6ME118191--5.515834.5972
PC (40:7)PC 40:7ME118192--4.9545-
PC (40:8)PC 40:8ME118193--4.537830.5691
PC (42:5)PC 42:5ME118194--6.311864.6465
PC (42:6)PC 42:6ME118195--5.691862.6262
PC (42:7)PC 42:7ME118196--5.336860.6059
PC (o-32:0)PC O-32:0ME118197--5.9955-
PC (o-34:0)PC O-34:0ME118198--6.689-
PC (p-34:0) or PC (o-34:1)PC P-34:0 or PC O-34:1ME118199--6.046746.605
PC (p-34:1) or PC (o-34:2)PC P-34:1 or PC O-34:2ME118200--5.534744.5893
PC (p-36:1) or PC (o-36:2)PC P-36:1 or PC O-36:2ME118201--6.142772.6199
PC (p-36:3) or PC (o-36:4)PC P-36:3 or PC O-36:4ME118202--5.439-
PC (p-36:4) or PC (o-36:5)PC P-36:4 or PC O-36:5ME118203--5.326766.5707
PC (p-38:3) or PC (o-38:4)PC P-38:3 or PC O-38:4ME118204--6.114796.6165
PC (p-38:4) or PC (o-38:5)PC P-38:4 or PC O-38:5ME118205--5.483-
PC (p-38:5) or PC (o-38:6)PC P-38:5 or PC O-38:6ME118206--5.268792.5881
PC (p-40:3) or PC (o-40:4)PC P-40:3 or PC O-40:4ME118207--6.546824.6514
PC (p-40:4) or PC (o-40:5)PC P-40:4 or PC O-40:5ME118208--5.972-
PC (p-40:6) or PC (o-40:7)PC P-40:6 or PC O-40:7ME118209--5.319-
PC (p-42:3) or PC (o-42:4)PC P-42:3 or PC O-42:4ME118210--7.459852.6833
PC (p-42:4) or PC (o-42:5)PC P-42:4 or PC O-42:5ME118211--6.506850.6669
PC (p-42:5) or PC (o-42:6)PC P-42:5 or PC O-42:6ME118212--6.111848.6503
PE (38:6)PE 38:6ME118213--5.014764.5276
PE (p-36:4) or PE (o-36:5)PE P-36:4 or PE O-36:5ME118214--5.51724.5278
PE (p-38:4) or PE (o-38:5)PE P-38:4 or PE O-38:5ME118215--6.179752.5587
PE (p-38:5) or PE (o-38:6)PE P-38:5 or PE O-38:6ME118216--5.55750.5438
PE (p-40:5) or PE (o-40:6)PE P-40:5 or PE O-40:6ME118217--6.195778.5739
SM (d32:1)SM 32:1;O2ME118218--4.245675.5429
SM (d33:1)SM 33:1;O2ME118219--4.543689.5588
SM (d34:1)SM 34:1;O2ME118220--4.8515-
SM (d34:2)SM 34:2;O2ME118221--4.341701.5585
SM (d36:1)SM 36:1;O2ME118222--5.516-
SM (d38:1)SM 38:1;O2ME118223--6.202-
SM (d39:1)SM 39:1;O2ME118224--6.571773.6494
SM (d40:1)SM 40:1;O2ME118225--6.9045-
SM (d41:1)SM 41:1;O2ME118226--7.253801.684
SM (d41:2)SM 41:2;O2ME118227--6.559799.6665
SM (d42:1)SM 42:1;O2ME118228--7.5885-
SM (d42:2)SM 42:2;O2ME118229--6.8805-
SM (d42:3)SM 42:3;O2ME118230--6.3075-
SM (d43:2)SM 43:2;O2ME118231--7.216827.6982
TG (14:0/14:0/14:0)TG 14:0/14:0/14:0ME11823211148-9.617740.675
TG (46:0)TG 46:0ME118233--10.576796.7383
TG (48:0)TG 48:0ME118234--10.9985-
TG (48:1)TG 48:1ME118235--10.597822.7543
TG (48:2)TG 48:2ME118236--10.183820.7382
TG (49:0)TG 49:0ME118237--11.174838.7849
TG (50:0)TG 50:0ME118238--11.3865-
TG (50:1)TG 50:1ME118239--11.002-
TG (50:2)TG 50:2ME118240--10.623848.7699
TG (51:1)TG 51:1ME118241--11.183864.7997
TG (52:0)TG 52:0ME118242--11.7225-
TG (52:1)TG 52:1ME118243--11.3835-
TG (52:2)TG 52:2ME118244--11.0165-
TG (52:3)TG 52:3ME118245--10.6625-
TG (52:4)TG 52:4ME118247--10.4565-
TG (54:1)TG 54:1ME118248--11.732906.8478
TG (54:2)TG 54:2ME118249--11.392904.8321
TG (54:3)TG 54:3ME118250--11.0435-
TG (54:4)TG 54:4ME118251--10.795900.8012
TG (54:6)TG 54:6ME118252--9.972896.7691
TG (56:1)TG 56:1ME118253--11.922934.8777
TG (56:2)TG 56:2ME118254--11.731932.8638
TG (56:4)TG 56:4ME118255--11.22-
TG (56:5)TG 56:5ME118256--10.931-
TG (56:6)TG 56:6ME118257--10.745924.7975
TG (58:1)TG 58:1ME118258--11.996962.9089
TG (58:2)TG 58:2ME118259--11.921960.8913
TG (58:4)TG 58:4ME118260--11.566956.8642
TG (58:6)TG 58:6ME118261--10.911952.8322
TG (58:8)TG 58:8ME118262--10.403948.8003
TG (60:2)TG 60:2ME118263--12.039988.9272


Analysis: UPLC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
Ceramide (d33:1)Cer 33:1;O2ME118283--5.368558.4651
Ceramide (d34:0)Cer 34:0;O2ME118284--6.01598.5379
Ceramide (d34:1)Cer 34:1;O2ME118285--5.7195-
Ceramide (d36:1)Cer 36:1;O2ME118286--6.4005-
Ceramide (d38:1)Cer 38:1;O2ME118287--7.107628.5425
Ceramide (d40:1)Cer 40:1;O2ME1182885283567-7.7885-
Ceramide (d41:1)Cer 41:1;O2ME118289--8.114670.5906
Ceramide (d42:1)Cer 42:1;O2ME1182905283571-8.425-
Ceramide (d42:2)Cer 42:2;O2ME1182915283568-7.736-
FA (20:1) (eicosenoic acid)Eicosenoic acidME118299--3.297309.28
FA (20:4) (arachidonic acid)Arachidonic acidME118300444899C002191.919303.233
FA (22:0) (behenic acid)Behenic acidME1183018215C082814.452339.3267
FA (22:6) (docosahexaenoic acid)Docosahexaenoic acidME118302445580C064291.719327.233
FA (24:0) (lignoceric acid)Lignoceric acidME11830311197C083205.184367.3578
FA (24:1) (nervonic acid)Nervonic acidME118304--4.469365.3423
GlcCer(d14:1(4E)/20:0(2OH))GlcCer 14:1;O2(4E)/20:0;OME11830970699246-4.941750.5237
GlcCer (d40:1)GlcCer 40:1;O2ME118305--7.0955-
GlcCer (d41:1)GlcCer 41:1;O2ME118306--7.455832.6429
GlcCer (d42:1)GlcCer 42:1;O2ME118307--7.7605-
GlcCer (d42:2)GlcCer 42:2;O2ME118308--7.077-
LPC (16:0)LPC 16:0ME118310460602C042301.568554.3459
LPC (18:0)LPC 18:0ME118311--2.322582.3771
PC (32:1)PC 32:1ME118312--4.988790.556
PC (34:0)PC 34:0ME118313--6.219820.6071
PC (34:1)PC 34:1ME118314--5.614818.591
PC (34:2)PC 34:2ME118315--5.132816.5742
PC (36:1)PC 36:1ME118316--6.284846.6227
PC (36:2)PC 36:2ME118317--5.735844.6057
PC (36:3)PC 36:3ME118318--5.297842.5903
PC (36:4)PC 36:4ME118319--5.038840.575
PC (38:3)PC 38:3ME118320--5.961870.6221
PC (38:4)PC 38:4ME118321--5.685868.607
PC (38:5)PC 38:5ME118322--5.081866.5909
PC (38:6)PC 38:6ME118323--4.888864.575
PC (40:4)PC 40:4ME118324--6.153896.6381
PC (p-34:0) or PC (o-34:1)PC P-34:0 or PC O-34:1ME118325--6.009804.6114
PC (p-36:3) or PC (o-36:4)PC P-36:3 or PC O-36:4ME118326--5.395826.596
PC (p-36:4) or PC (o-36:5)PC P-36:4 or PC O-36:5ME118327--5.301824.5804
PC (p-38:3) or PC (o-38:4)PC P-38:3 or PC O-38:4ME118328--6.07854.6273
PC (p-38:4) or PC (o-38:5)PC P-38:4 or PC O-38:5ME118329--5.461852.6116
PE (34:1)PE 34:1ME118330--5.746716.523
PE (36:2)PE 36:2ME118331--5.885742.5385
PE (36:4)PE 36:4ME118332--5.16738.5085
PE (38:4)PE 38:4ME118333--5.81766.5393
PE (p-34:1) or PE (o-34:2)PE P-34:1 or PE O-34:2ME118334--6.087700.5282
PE (p-34:2) or PE (o-34:3)PE P-34:2 or PE O-34:3ME118335--5.582698.5125
PE (p-36:1) or PE (o-36:2)PE P-36:1 or PE O-36:2ME118336--6.758728.5594
PE (p-36:2) or PE (o-36:3)PE P-36:2 or PE O-36:3ME118337--6.21726.5431
PE (p-36:4) or PE (o-36:5)PE P-36:4 or PE O-36:5ME118338--5.441722.5128
PE (p-36:5) or PE (o-36:6)PE P-36:5 or PE O-36:6ME118339--4.976720.4971
PE (p-38:4) or PE (o-38:5)PE P-38:4 or PE O-38:5ME118340--6.118750.5441
PE (p-38:5) or PE (o-38:6)PE P-38:5 or PE O-38:6ME118341--5.489748.5284
PE (p-40:4) or PE (o-40:5)PE P-40:4 or PE O-40:5ME118342--6.593778.5755
PE (p-40:5) or PE (o-40:6)PE P-40:5 or PE O-40:6ME118343--6.143776.5594
PE (p-40:6) or PE (o-40:7)PE P-40:6 or PE O-40:7ME118344--5.918774.5439
PE (p-40:7) or PE (o-40:8)PE P-40:7 or PE O-40:8ME118345--5.31772.5281
SM (d34:1)SM 34:1;O2ME118346--4.83761.5808
SM (d34:2)SM 34:2;O2ME118347--4.31759.5649
SM (d40:1)SM 40:1;O2ME118348--6.929845.6699
SM (d41:2)SM 41:2;O2ME118349--6.848857.6746
SM (d42:1)SM 42:1;O2ME118350--7.551873.7059
SM (d42:2)SM 42:2;O2ME118351--6.851871.6905
SM (d42:3)SM 42:3;O2ME118352--6.278869.6744


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