#METABOLOMICS WORKBENCH kanamori_20170131_005611 DATATRACK_ID:834 STUDY_ID:ST000550 ANALYSIS_ID:AN000840 PROJECT_ID:PR000403 VERSION 1 CREATED_ON February 9, 2017, 9:54 am #PROJECT PR:PROJECT_TITLE Metabolomics marker of brown adipose tissue in men PR:PROJECT_SUMMARY We assessed a MS platform of 163 marker (Biocrates p150 kit) to find markers for PR:PROJECT_SUMMARY brown adipose tissue. PR:INSTITUTE Leiden University Medical Center PR:LAST_NAME Mook-Kanamori PR:FIRST_NAME Dennis PR:ADDRESS PO Box 9600, 2300 RC, Leiden, the Netherlands PR:EMAIL d.o.mook@lumc.nl PR:PHONE +31 71 5265623 #STUDY ST:STUDY_TITLE Metabolomics marker of brown adipose tissue in men ST:STUDY_SUMMARY Objective: We aimed to identify metabolites in serum that are associated with ST:STUDY_SUMMARY BAT volume and activity in men. Methods: We assessed 163 metabolites in fasted ST:STUDY_SUMMARY serum of a cohort of twenty two healthy lean men (age 24.1 (21.7 – 26.6) ST:STUDY_SUMMARY years, BMI 22.1 (20.5 – 23.4) kg/m2) who subsequently underwent a cold-induced ST:STUDY_SUMMARY [18F]FDG PET-CT scan to assess BAT volume and activity. In addition, we included ST:STUDY_SUMMARY three replication cohorts consisting of in total thirty-seven healthy lean men ST:STUDY_SUMMARY that were similar with respect to age and BMI compared to the discovery cohort. ST:INSTITUTE Leiden University Medical Center ST:LAST_NAME Mook-Kanamori ST:FIRST_NAME Dennis ST:ADDRESS PO Box 9600, 2300 RC, Leiden, the Netherlands ST:EMAIL d.o.mook@lumc.nl ST:PHONE +31715265623 ST:NUM_GROUPS 5 ST:TOTAL_SUBJECTS 59 ST:NUM_MALES 59 #SUBJECT SU:SUBJECT_TYPE Healthy males SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:AGE_OR_AGE_RANGE 20-30 SU:GENDER Men SU:HUMAN_ETHNICITY Caucasian and south asian #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS - 1 SampleType:Serum BAT_Volume=266,246; BAT_SUV_mean=4,488 SUBJECT_SAMPLE_FACTORS - 2 SampleType:Serum BAT_Volume=503,68; BAT_SUV_mean=4,677 SUBJECT_SAMPLE_FACTORS - 3 SampleType:Serum BAT_Volume=58,69; BAT_SUV_mean=3,778 SUBJECT_SAMPLE_FACTORS - 4 SampleType:Serum BAT_Volume=206,084; BAT_SUV_mean=4,203 SUBJECT_SAMPLE_FACTORS - 5 SampleType:Serum BAT_Volume=545,014; BAT_SUV_mean=4,562 SUBJECT_SAMPLE_FACTORS - 6 SampleType:Serum BAT_Volume=176,22; BAT_SUV_mean=4,024 SUBJECT_SAMPLE_FACTORS - 8 SampleType:Serum BAT_Volume=239,486; BAT_SUV_mean=4,243 SUBJECT_SAMPLE_FACTORS - 9 SampleType:Serum BAT_Volume=245,05; BAT_SUV_mean=4,127 SUBJECT_SAMPLE_FACTORS - 10 SampleType:Serum BAT_Volume=412,422; BAT_SUV_mean=4,329 SUBJECT_SAMPLE_FACTORS - 11 SampleType:Serum BAT_Volume=54,662; BAT_SUV_mean=3,88 SUBJECT_SAMPLE_FACTORS - 13 SampleType:Serum BAT_Volume=235,784; BAT_SUV_mean=4,111 SUBJECT_SAMPLE_FACTORS - 14 SampleType:Serum BAT_Volume=125,448; BAT_SUV_mean=3,681 SUBJECT_SAMPLE_FACTORS - 15 SampleType:Serum BAT_Volume=288,132; BAT_SUV_mean=4,178 SUBJECT_SAMPLE_FACTORS - 16 SampleType:Serum BAT_Volume=178,408; BAT_SUV_mean=4,161 SUBJECT_SAMPLE_FACTORS - 17 SampleType:Serum BAT_Volume=224,76; BAT_SUV_mean=3,983 SUBJECT_SAMPLE_FACTORS - 18 SampleType:Serum BAT_Volume=267,71; BAT_SUV_mean=4,245 SUBJECT_SAMPLE_FACTORS - 19 SampleType:Serum BAT_Volume=155,132; BAT_SUV_mean=4,022 SUBJECT_SAMPLE_FACTORS - 20 SampleType:Serum BAT_Volume=179,134; BAT_SUV_mean=3,939 SUBJECT_SAMPLE_FACTORS - 21 SampleType:Serum BAT_Volume=132,576; BAT_SUV_mean=4,039 SUBJECT_SAMPLE_FACTORS - 22 SampleType:Serum BAT_Volume=422,71; BAT_SUV_mean=4,445 SUBJECT_SAMPLE_FACTORS - 23 SampleType:Serum BAT_Volume=330,116; BAT_SUV_mean=4,44 SUBJECT_SAMPLE_FACTORS - 24 SampleType:Serum BAT_Volume=158,972; BAT_SUV_mean=4,198 SUBJECT_SAMPLE_FACTORS - 52 SampleType:Serum BAT_Volume=8,838,576,401; BAT_SUV_mean=1,756,218,022 SUBJECT_SAMPLE_FACTORS - 53 SampleType:Serum BAT_Volume=1,131,216,929; BAT_SUV_mean=2,092,581,575 SUBJECT_SAMPLE_FACTORS - 54 SampleType:Serum BAT_Volume=1,964,701,825; BAT_SUV_mean=2,097,582,417 SUBJECT_SAMPLE_FACTORS - 56 SampleType:Serum BAT_Volume=3,063,893,333; BAT_SUV_mean=208,377,651 SUBJECT_SAMPLE_FACTORS - 58 SampleType:Serum BAT_Volume=4,097,825,495; BAT_SUV_mean=2,317,946,406 SUBJECT_SAMPLE_FACTORS - 59 SampleType:Serum BAT_Volume=1,450,207,688; BAT_SUV_mean=1,707,358,105 SUBJECT_SAMPLE_FACTORS - 111 SampleType:Serum BAT_Volume=8,917,458,908; BAT_SUV_mean=2,796,071,592 SUBJECT_SAMPLE_FACTORS - 112 SampleType:Serum BAT_Volume=9,695,901,855; BAT_SUV_mean=2,862,846,855 SUBJECT_SAMPLE_FACTORS - 121 SampleType:Serum BAT_Volume=473,624,647; BAT_SUV_mean=1,680,619,884 SUBJECT_SAMPLE_FACTORS - 131 SampleType:Serum BAT_Volume=1,551,227,837; BAT_SUV_mean=1,977,701,491 SUBJECT_SAMPLE_FACTORS - 141 SampleType:Serum BAT_Volume=8,637,524,878; BAT_SUV_mean=2,124,273,725 SUBJECT_SAMPLE_FACTORS - 151 SampleType:Serum BAT_Volume=8,504,039,864; BAT_SUV_mean=2,198,745,225 SUBJECT_SAMPLE_FACTORS - 152 SampleType:Serum BAT_Volume=2,412,728,108; BAT_SUV_mean=2,355,601,863 SUBJECT_SAMPLE_FACTORS - 162 SampleType:Serum BAT_Volume=8,670,868,671; BAT_SUV_mean=3,026,336,563 SUBJECT_SAMPLE_FACTORS - 171 SampleType:Serum BAT_Volume=1,643,129,256; BAT_SUV_mean=1,784,298,939 SUBJECT_SAMPLE_FACTORS - 172 SampleType:Serum BAT_Volume=7,254,828,721; BAT_SUV_mean=24,831,201 SUBJECT_SAMPLE_FACTORS - 181 SampleType:Serum BAT_Volume=8,525,463,375; BAT_SUV_mean=2,024,068,194 SUBJECT_SAMPLE_FACTORS - 182 SampleType:Serum BAT_Volume=7,821,178,801; BAT_SUV_mean=2,559,823,181 SUBJECT_SAMPLE_FACTORS - 192 SampleType:Serum BAT_Volume=5,996,608,753; BAT_SUV_mean=2,260,494,483 SUBJECT_SAMPLE_FACTORS - 510 SampleType:Serum BAT_Volume=9,888,823,398; BAT_SUV_mean=3,167,435,172 SUBJECT_SAMPLE_FACTORS - 511 SampleType:Serum BAT_Volume=3,982,907,522; BAT_SUV_mean=2,364,085,482 SUBJECT_SAMPLE_FACTORS - 512 SampleType:Serum BAT_Volume=1,571,937,243; BAT_SUV_mean=1,896,698,088 SUBJECT_SAMPLE_FACTORS - 513 SampleType:Serum BAT_Volume=7,957,300,568; BAT_SUV_mean=2,836,559,436 SUBJECT_SAMPLE_FACTORS - 514 SampleType:Serum BAT_Volume=5,548,527,572; BAT_SUV_mean=2,569,951,671 SUBJECT_SAMPLE_FACTORS - 515 SampleType:Serum BAT_Volume=7,156,884,802; BAT_SUV_mean=2,661,525,352 SUBJECT_SAMPLE_FACTORS - 516 SampleType:Serum BAT_Volume=5,242,995,179; BAT_SUV_mean=2,478,654,803 SUBJECT_SAMPLE_FACTORS - 517 SampleType:Serum BAT_Volume=1,280,011,533; BAT_SUV_mean=3,028,138,993 SUBJECT_SAMPLE_FACTORS - 518 SampleType:Serum BAT_Volume=7,832,000,429; BAT_SUV_mean=2,474,635,055 SUBJECT_SAMPLE_FACTORS - 519 SampleType:Serum BAT_Volume=4,325,244,428; BAT_SUV_mean=2,342,512,471 SUBJECT_SAMPLE_FACTORS - 1111 SampleType:Serum BAT_Volume=7,271,912,639; BAT_SUV_mean=1,794,481,421 SUBJECT_SAMPLE_FACTORS - 1112 SampleType:Serum BAT_Volume=10,792,127; BAT_SUV_mean=2,782,210,726 SUBJECT_SAMPLE_FACTORS - 1122 SampleType:Serum BAT_Volume=9,874,376,253; BAT_SUV_mean=2,400,085,708 SUBJECT_SAMPLE_FACTORS - 1141 SampleType:Serum BAT_Volume=4,800,791,699; BAT_SUV_mean=233,755,045 SUBJECT_SAMPLE_FACTORS - 1142 SampleType:Serum BAT_Volume=4,031,467,507; BAT_SUV_mean=2,229,139,773 SUBJECT_SAMPLE_FACTORS - 1151 SampleType:Serum BAT_Volume=1,645,491,339; BAT_SUV_mean=2,226,188,721 SUBJECT_SAMPLE_FACTORS - 1192 SampleType:Serum BAT_Volume=1,367,606,275; BAT_SUV_mean=3,257,150,365 SUBJECT_SAMPLE_FACTORS - 1201 SampleType:Serum BAT_Volume=2,488,864,012; BAT_SUV_mean=242,954,041 #COLLECTION CO:COLLECTION_SUMMARY METHODS Study population discovery cohort Our discovery cohort consisted of CO:COLLECTION_SUMMARY twenty-four healthy male Caucasian (n=12) and South Asian (n=12) participants CO:COLLECTION_SUMMARY from a study that was performed previously in the Alrijne hospital (Leiderdorp, CO:COLLECTION_SUMMARY the Netherlands) between March and June 2013 (Bakker et al. 2014). This study CO:COLLECTION_SUMMARY was powered on the identification of a difference in BAT volume, resulting in CO:COLLECTION_SUMMARY inclusion of twelve subjects per group. Subjects were lean (BMI <25 kg/m2) and CO:COLLECTION_SUMMARY healthy males aged 18-30 years that were enrolled via local advertisements. CO:COLLECTION_SUMMARY Subjects underwent a medical screening including their medical history, a CO:COLLECTION_SUMMARY physical examination, blood chemistry tests, and an oral glucose tolerance test CO:COLLECTION_SUMMARY (OGTT) to exclude individuals with T2DM according to the American Diabetes CO:COLLECTION_SUMMARY Association (ADA) 2010 criteria. Other exclusion criteria were rigorous CO:COLLECTION_SUMMARY exercise, smoking, and recent body weight change. Data from two individuals were CO:COLLECTION_SUMMARY removed from the analyses due to virtually absent BAT volume (0-1 cm3) as CO:COLLECTION_SUMMARY assessed by [18F]FDG PET-CT, leaving twenty-two participants. The present study CO:COLLECTION_SUMMARY was approved by the Medical Ethical Committee of the Leiden University Medical CO:COLLECTION_SUMMARY Center and performed in accordance with the principles of the revised CO:COLLECTION_SUMMARY Declaration of Helsinki. All volunteers gave written informed consent before CO:COLLECTION_SUMMARY participation. Study population replication cohorts To verify whether the CO:COLLECTION_SUMMARY associations were sufficiently robust, we included three replication cohorts CO:COLLECTION_SUMMARY consisting of in total forty-two healthy Caucasian men. These participants were CO:COLLECTION_SUMMARY derived from three studies performed at the Maastricht University Medical Centre CO:COLLECTION_SUMMARY (Maastricht, the Netherlands) between 2011 and 2014 (Vosselman et al. 2012; CO:COLLECTION_SUMMARY Vosselman et al. 2013; Vosselman et al. 2015). In the first study (Vosselman et CO:COLLECTION_SUMMARY al. 2015), aimed at studying the effect of exercise on BAT volume and activity, CO:COLLECTION_SUMMARY twelve healthy lean endurance-trained and twelve lean sedentary male Caucasian CO:COLLECTION_SUMMARY men aged 18–35 years were included. Endurance-trained athletes were included CO:COLLECTION_SUMMARY in the trained group when they performed endurance exercise at least three times CO:COLLECTION_SUMMARY a week for the last 2 years, and had a maximal oxygen consumption (VO2max) of CO:COLLECTION_SUMMARY >55 ml/min/kg. The sedentary males were included in the untrained group if they CO:COLLECTION_SUMMARY did not perform more than 1 h of exercise per week for the last 2 years and had CO:COLLECTION_SUMMARY a VO2max of <45 ml/min/kg. General exclusion criteria were use of medication, CO:COLLECTION_SUMMARY smoking, weight gain/loss of >3 kg in the last 6 months, hypertension and CO:COLLECTION_SUMMARY (family history of) diabetes. The trained men were included in replication CO:COLLECTION_SUMMARY cohort 1 and the untrained men in replication cohort 2. Replication cohort 3 CO:COLLECTION_SUMMARY consisted of subjects derived from two studies (Vosselman et al. 2012; Vosselman CO:COLLECTION_SUMMARY et al. 2013) that had the same inclusion criteria and cooling protocol. These CO:COLLECTION_SUMMARY studies aimed at studying the effect of β-adrenergic stimulation on BAT CO:COLLECTION_SUMMARY (Vosselman et al. 2012) and the effect of a high-calorie meal on BAT (Vosselman CO:COLLECTION_SUMMARY et al. 2013). In these studies, in total 19 healthy male Caucasian subjects aged CO:COLLECTION_SUMMARY between 18-35 years were enrolled. All subjects were screened for medical CO:COLLECTION_SUMMARY history. Cardiovascular status was screened by means of an electrocardiogram and CO:COLLECTION_SUMMARY blood pressure measurement. All subjects had normal blood glucose levels. In the CO:COLLECTION_SUMMARY replication cohorts, data from five participants were removed due to absence of CO:COLLECTION_SUMMARY [18F]FDG uptake in the BAT region, leaving thirty-seven participants in the CO:COLLECTION_SUMMARY replication set. For the pooled analyses, fifty-nine participants were included CO:COLLECTION_SUMMARY in the analyses. All replication studies were approved by the medical ethical CO:COLLECTION_SUMMARY committee of the Maastricht University Medical Center and all subjects were CO:COLLECTION_SUMMARY treated according to the principles of the revised declaration of Helsinki. CO:COLLECTION_SUMMARY Study set-up discovery cohort Individuals were studied in the morning after a CO:COLLECTION_SUMMARY 10-h overnight fast and after 24h without exercise. Subsequently, they were CO:COLLECTION_SUMMARY exposed to a thermoneutral temperature (32 C) for 60 min, after which a basal CO:COLLECTION_SUMMARY blood serum sample was taken in which also metabolomics measurements were CO:COLLECTION_SUMMARY performed (see below). To activate BAT an individualized cooling protocol was CO:COLLECTION_SUMMARY applied. In short, subjects lay on a bed sandwiched between two water-perfused CO:COLLECTION_SUMMARY cooling mattresses (Blanketrol III, Cincinnati Sub-Zero Products, Cincinnati, CO:COLLECTION_SUMMARY OH, USA). Cooling started at 32°C and temperature was gradually decreased until CO:COLLECTION_SUMMARY shivering occurred (approximately after 50-60 min). Temperature was then raised CO:COLLECTION_SUMMARY by 3–4°C and the cooling period of 2 h was started (defined as tcold = 0 CO:COLLECTION_SUMMARY min). If shivering occurred, the temperature was raised by 1°C until shivering CO:COLLECTION_SUMMARY stopped. We detected shivering visually or it was reported by participants. CO:COLLECTION_SUMMARY After 1 h of cooling (tcold=60 min), 2 MBq/kg [¹ F]FDG was injected CO:COLLECTION_SUMMARY intravenously and subjects were instructed to lay still in order to prevent CO:COLLECTION_SUMMARY artifact by muscle activity. At tcold = 110 min, a cold-induced blood sample was CO:COLLECTION_SUMMARY taken in which metabolomics measurements were performed as well. After 2 h of CO:COLLECTION_SUMMARY cooling (tcold=120 min) the PET-CT scan (Gemini TF PET-CT, Philips, The CO:COLLECTION_SUMMARY Netherlands) was performed to assess BAT volume and activity, as described CO:COLLECTION_SUMMARY previously (Bakker et al. 2014). We quantified BAT activity and detectable CO:COLLECTION_SUMMARY volume in the region of interest by autocontouring the BAT areas with a set CO:COLLECTION_SUMMARY threshold (SUV) of 2.0 g/mL using Hermes software (Hermes Hybrid Viewer, Hermes CO:COLLECTION_SUMMARY Medical Solutions, Sweden). Study set-up replication cohorts In all replication CO:COLLECTION_SUMMARY cohorts, subjects were studied in the morning after an overnight fast and after CO:COLLECTION_SUMMARY 24 h without exercise. All experiments started with 1-h baseline measurements CO:COLLECTION_SUMMARY during thermoneutral conditions (24 to 25 C), after which a basal blood serum CO:COLLECTION_SUMMARY sample was taken in which also metabolomics measurements were performed (see CO:COLLECTION_SUMMARY below). Subsequently, subjects were exposed to 2 h of mild cold exposure in CO:COLLECTION_SUMMARY which an individualized protocol was used by means of air cooling using CO:COLLECTION_SUMMARY air-conditioning. In short, each subject was cooled down until shivering CO:COLLECTION_SUMMARY occurred (approximately after 20-60 min). After that, air temperature was CO:COLLECTION_SUMMARY slightly increased until shivering stopped. After 1 h of cold exposure the CO:COLLECTION_SUMMARY [18F]FDG tracer was injected intravenously (74 MBq in replication cohorts 1 and CO:COLLECTION_SUMMARY 2 and 50 MBq in replication cohort 3) and subjects were exposed to another hour CO:COLLECTION_SUMMARY of cold. Next, after 2 h of cooling, the PET-CT scan (Gemini TF PET-CT, Philips, CO:COLLECTION_SUMMARY the Netherlands) was performed to assess BAT volume and activity. In replication CO:COLLECTION_SUMMARY cohort 1 and 2, BAT activity and detectable volume were quantified in the region CO:COLLECTION_SUMMARY of interest by autocontouring the BAT areas with a set threshold (SUV) of 1.5 CO:COLLECTION_SUMMARY g/mL (Vosselman et al. 2015). In replication cohort 3 a threshold of 1.5 g/mL CO:COLLECTION_SUMMARY was used as well, and additionally the regions drawn were localized in fat CO:COLLECTION_SUMMARY tissues only as determined by CT scan (HU -10 to -180) (Vosselman et al. 2012). CO:COLLECTION_SUMMARY For all analyses, PMOD software (PMOD Technologies) was used. #TREATMENT TR:TREATMENT_SUMMARY N/A #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Targeted metabolomics Metabolomic measurements were performed on serum samples SP:SAMPLEPREP_SUMMARY taken at thermoneutral and cold conditions at the Genome Analysis Center at the SP:SAMPLEPREP_SUMMARY Helmholtz Zentrum, Munich, Germany, using the Biocrates AbsoluteIDQTM p150 kit SP:SAMPLEPREP_SUMMARY (BIOCRATES Life Science AG, Innsbruck, Austria) and ESI-FIA-MS/MS measurements SP:SAMPLEPREP_SUMMARY (Menni et al. 2013). The assay allows simultaneous quantification of 163 small SP:SAMPLEPREP_SUMMARY molecule metabolites within 10 µL serum. The assay includes free carnitine, 40 SP:SAMPLEPREP_SUMMARY acylcarnitines, 14 amino acids (13 proteinogenic + ornithine), hexoses (of which SP:SAMPLEPREP_SUMMARY approx. 90-95% is glucose), 92 glycerophospholipids including 15 SP:SAMPLEPREP_SUMMARY lysophosphatidylcholines (LysoPCs) and 77 phosphatidylcholines (PCs), and 15 SP:SAMPLEPREP_SUMMARY sphingolipids (Menni et al. 2013; Illig et al. 2010). Quantification of the SP:SAMPLEPREP_SUMMARY metabolites was achieved by reference to appropriate internal standards. The SP:SAMPLEPREP_SUMMARY assay has been previously described (Menni et al. 2013; Illig et al. 2010). #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE GC CH:INSTRUMENT_NAME Biocrates IDQ p150 CH:COLUMN_NAME Biocrates IDQ p150 #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:MS_COMMENTS - MS:INSTRUMENT_NAME Biocrates IDQ p150 MS:INSTRUMENT_TYPE Triple quadrupole MS:MS_TYPE Other MS:ION_MODE NEGATIVE #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS mmol/L MS_METABOLITE_DATA_START Samples 1 2 3 4 5 6 8 9 10 11 13 14 15 16 17 18 19 20 21 22 23 24 52 53 54 56 58 59 111 112 121 131 141 151 152 162 171 172 181 182 192 510 511 512 513 514 515 516 517 518 519 1111 1112 1122 1141 1142 1151 1192 1201 Factors SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum SampleType:Serum DL-Carnitine 35.31313 29.007692 32.635582 34.72459 29.49405 13.832467 39.91832 39.64343 21.36939 25.321186 24.886911 47.10576 27.930109 29.597408 30.765995 30.975552 21.664066 29.19367 27.329332 23.383518 37.562435 21.596178 40.481865 40.55315 43.620335 47.02318 31.498505 33.744076 44.29182 42.974 27.352404 37.897285 50.50333 41.719513 35.127907 58.619995 23.299026 37.430058 36.320545 46.8531 35.562286 50.904224 49.772263 43.987877 44.097954 36.191624 26.86369 34.62168 54.35051 49.82057 58.356663 26.477947 34.406685 46.899662 30.109814 47.528393 34.432865 41.70384 40.335022 Decanoyl-L-carnitine 0.16093722 0.14310376 0.1504432 0.1877947 0.18142779 0.12560435 0.15410891 0.12602101 0.19085222 0.18756211 0.19389553 0.21216707 0.12525538 0.15933874 0.22520688 0.14479856 0.12862377 0.117859825 0.12878212 0.1749454 0.15212731 0.14624341 0.13999179 0.19264865 0.11178273 0.15612014 0.12274789 0.20171137 0.12265686 0.14739673 0.09194739 0.10372813 0.112565026 0.20940858 0.18580493 0.13030817 0.08216757 0.18412106 0.09557467 0.15979974 0.13095938 0.12209759 0.13452755 0.13951248 0.08123379 0.1575199 0.11884543 0.1332643 0.14029668 0.14481917 0.24136288 0.12665458 0.12514769 0.16473101 0.13417055 0.12208798 0.10124215 0.19388734 0.12778051 Decenoyl-L-carnitine 0.115859754 0.09055307 0.06781146 0.18833332 0.10489535 0.0756941 0.123692706 0.07596053 0.09565772 0.111728325 0.09652581 0.21052493 0.061218746 0.12030398 0.16004051 0.102346756 0.090124756 0.10875521 0.078000605 0.08226498 0.13591205 0.11517391 0.069889314 0.1152576 0.116202354 0.11440329 0.06540337 0.06966895 0.06925068 0.07548311 0.057608407 0.065981194 0.064317636 0.11698661 0.09742563 0.07590693 0.04181618 0.077085 0.0685466 0.09420657 0.060265854 0.06350305 0.110167004 0.05684674 0.06139412 0.08385793 0.07804902 0.0731937 0.081197284 0.08118972 0.1118644 0.0827171 0.06790648 0.09179295 0.07942669 0.07032335 0.06310544 0.09563376 0.074186064 Decadienyl-L-carnitine 0.022825938 0.026849315 0.020791618 0.03632353 0.01962914 0.023637593 0.018215712 0.02215026 0.022274947 0.026176808 0.023593131 0.04086632 0.019632606 0.031811643 0.027861508 0.033766232 0.021818181 0.02752609 0.017876668 0.018342718 0.031325303 0.024149533 0.030927677 0.025254566 0.024698235 0.047260504 0.028011393 0.03079757 0.027896151 0.03334127 0.02573558 0.031747025 0.028826607 0.039842922 0.034436397 0.034757677 0.022909708 0.033189043 0.026916036 0.038847443 0.027542636 0.028024716 0.039636143 0.03662035 0.027101887 0.02820156 0.024138883 0.020907657 0.024256932 0.03228803 0.035879828 0.03265727 0.028738918 0.030160887 0.035268888 0.024094729 0.02617912 0.03090059 0.03469652 Dodecanoyl-L-carnitine 0.057234265 0.040321507 0.048796333 0.07637929 0.05659569 0.03575414 0.045054436 0.03981087 0.064201854 0.060323678 0.039642375 0.07144018 0.03445382 0.048241954 0.061363902 0.045451134 0.0344796 0.041858062 0.04578633 0.052562576 0.047744308 0.050967194 0.053122915 0.049943622 0.043792307 0.054416515 0.044520102 0.073266685 0.04830542 0.051342543 0.031681947 0.04300941 0.033046745 0.067214526 0.065425105 0.045180775 0.027308673 0.06251149 0.035962723 0.048366264 0.04588276 0.043657716 0.06340047 0.0439783 0.036374375 0.05676206 0.05339114 0.05203005 0.054247994 0.04794271 0.08614684 0.03976066 0.05013005 0.07059029 0.088249244 0.05078349 0.03766687 0.06875376 0.050462257 Dodecanedioyl-L-carnitine 0.06901791 0.07938495 0.045855273 0.05083982 0.062323935 0.056979556 0.04588428 0.06453933 0.06143591 0.04834418 0.07067163 0.049032357 0.045783743 0.06925308 0.054751873 0.059619043 0.06370408 0.066375814 0.051154714 0.06359147 0.061170306 0.0493809 0.07748495 0.0842555 0.08204288 0.09346154 0.07454684 0.0783561 0.0895123 0.07952099 0.08757241 0.09256091 0.07975651 0.07801508 0.085661046 0.07387172 0.08210919 0.079438455 0.0781919 0.080618456 0.07935176 0.082504906 0.0858873 0.07020253 0.0754813 0.07994981 0.07450152 0.07761136 0.08450832 0.079243764 0.15548855 0.08522052 0.08532997 0.086849205 0.08797471 0.07986561 0.08426941 0.08265831 0.077565864 Dodecenoyl-L-carnitine 0.049802046 0.043835618 0.04291036 0.06985294 0.05133775 0.029290061 0.047057256 0.026580311 0.06364271 0.044936854 0.045680318 0.059596714 0.03970149 0.042746894 0.031473182 0.031168832 0.03590909 0.028459178 0.042517483 0.048302494 0.046746988 0.05540187 0.07343491 0.070742324 0.058711234 0.0649832 0.045964148 0.07573402 0.058241718 0.057636455 0.04580687 0.054889712 0.044304933 0.08013352 0.08552646 0.059312854 0.04011888 0.07569431 0.042793475 0.07964476 0.052728683 0.044233605 0.06283404 0.037982967 0.039864153 0.074189335 0.06417045 0.065519534 0.06867744 0.058966696 0.08555959 0.06309385 0.062290575 0.083417945 0.088745184 0.058640182 0.051955484 0.08976621 0.064607315 Tetradecanoyl-L-carnitine 0.03331214 0.040441915 0.04946987 0.04039865 0.04439727 0.042725746 0.050448664 0.031980764 0.041773275 0.036803428 0.047023326 0.028191 0.036579117 0.023245074 0.03492577 0.048256714 0.027544944 0.025747543 0.039514232 0.039253514 0.03726011 0.024980217 0.03886613 0.02554806 0.030290157 0.022131689 0.021451538 0.032633703 0.028152758 0.02384925 0.01782216 0.027443036 0.02291348 0.030711276 0.02611931 0.028684523 0.018520605 0.030854328 0.01729113 0.026261458 0.040288307 0.019236099 0.021453554 0.025821572 0.0199693 0.03238415 0.029770741 0.02179578 0.02597108 0.024875395 0.03820289 0.023297032 0.022826541 0.028947674 0.042969085 0.02634722 0.02111687 0.023407264 0.023944672 Tetradecenoyl-L-carnitine 0.12293116 0.094810314 0.13965786 0.14591542 0.12568258 0.11131862 0.084882356 0.077391535 0.13373008 0.1082677 0.1016537 0.16450453 0.08426937 0.07674596 0.11846059 0.07674924 0.0533331 0.06737129 0.09165131 0.08975296 0.09746756 0.14029188 0.0758374 0.05273482 0.04364846 0.044789553 0.04610919 0.07889982 0.04826372 0.049190696 0.02666262 0.0346029 0.030659504 0.058810618 0.0663917 0.052482188 0.029815061 0.07928909 0.028066464 0.057500813 0.050956503 0.04221877 0.052095987 0.050811306 0.030671839 0.07617492 0.064971425 0.057168584 0.060355205 0.04585754 0.082049094 0.043165047 0.044664964 0.067430116 0.10340536 0.0577752 0.03996166 0.071443826 0.05854711 Hydroxytetradecenoyl-L-carnitine 0.006324062 0.003839669 0.012230976 0.017630415 0.007447999 0.0090918 0.011299524 0.008606357 0.012625789 0.006826049 0.008544861 0.006399506 0.009580556 0.010837473 0.007953563 0.00710409 0.004060064 0.007849295 0.01028665 0.011709964 0.008953604 0.013587915 0.013674387 0.007955185 0.009919838 0.008501665 0.007976665 0.011283849 0.008527404 0.00814014 0.006038223 0.009708388 0.007442288 0.009733978 0.00767504 0.008641054 0.006208828 0.012971064 0.006162859 0.009945719 0.008072239 0.006460579 0.010389363 0.009819597 0.00873583 0.009239703 0.010845669 0.008077125 0.010123354 0.009553816 0.012967313 0.009279611 0.008411677 0.013006846 0.014202936 0.009359301 0.008187644 0.012983972 0.009849702 Tetradecadienyl-L-carnitine 0.041293662 0.015635062 0.031970736 0.06702597 0.035016455 0.033263557 0.045491688 0.021177528 0.029870478 0.036760077 0.026295051 0.0564249 0.020205831 0.031246252 0.045562655 0.033220008 0.017709924 0.027333334 0.026550218 0.015639393 0.040673286 0.05929779 0.016579306 0.016383234 0.017296726 0.015160949 0.01112042 0.01974026 0.019093169 0.017790217 0.008098685 0.010730854 0.007659185 0.022302106 0.0175779 0.017056294 0.008127124 0.019299136 0.01033326 0.018244397 0.011123999 0.01058857 0.021052632 0.009903107 0.011457549 0.01790655 0.0178616 0.013316155 0.014126593 0.012442153 0.021474613 0.011811744 0.010938734 0.019967472 0.033230405 0.012928184 0.013423473 0.019738827 0.013490237 Hydroxytetradecadienyl-L-carnitine 0.009176369 0.009516995 0.011120256 0.009681528 0.016436296 0.012293054 0.010109264 0.010930337 0.010861992 0.007001919 0.008765017 0.021701885 0.007821612 0.009113491 0.010457003 0.011073337 0.008549619 0.006 0.013275109 0.008192062 0.00918429 0.009882965 0.005641569 0.007281437 0.005430367 0.004479372 0.003766594 0.004321251 0.006024048 0.006961389 0.004929635 0.004087945 0.004675087 0.007582716 0.00546868 0.006822517 0.003797721 0.006065443 0.005054312 0.00659436 0.004512566 0.005186238 0.007496791 0.008379553 0.004687179 0.007864364 0.007166691 0.005874774 0.0059931 0.005780213 0.011408389 0.006001128 0.00425933 0.004563993 0.00510548 0.005108718 0.005739692 0.005513639 0.005695878 Hexadecanoyl-L-carnitine 0.07973292 0.08733409 0.10125175 0.090954594 0.081664 0.08404926 0.08264006 0.05655781 0.0852858 0.06744185 0.09105856 0.078594655 0.06429013 0.052977417 0.090530664 0.079373464 0.03780549 0.04865615 0.079330936 0.051514547 0.07980299 0.07628162 0.12814723 0.07942406 0.08282592 0.08099567 0.061237358 0.103542656 0.09686982 0.08133618 0.055344813 0.101514265 0.09187782 0.08796402 0.08548102 0.10674615 0.07217608 0.10619385 0.07621752 0.07455766 0.1299539 0.07058102 0.056505945 0.08384496 0.069867 0.1152091 0.113027364 0.076725 0.08285134 0.081335835 0.121783435 0.07584007 0.06883969 0.09192966 0.11351776 0.10086832 0.06525218 0.10398346 0.06921223 Hydroxyhexadecanoyl-L-carnitine 0.006327937 0.009275895 0.001254987 0.005787542 0.003347426 0.002790737 0.004145788 0.004664234 0.010069707 0.002238582 0.006343746 0.002454553 0.005633287 0.002413687 0.008637176 0.004279957 0.001907985 0.007130236 0.002672217 0.00446585 0.003108912 0.008307043 0.005098261 0.005121288 0.00494328 0.004138914 0.006552029 0.005585191 0.005035419 0.005414113 0.005002 0.005295474 0.005753242 0.00548004 0.006800595 0.004266762 0.005571189 0.005566871 0.005465226 0.002968187 0.004401521 0.005845514 0.004347389 0.005353333 0.00598214 0.004393942 0.005599337 0.004322636 0.005597772 0.013126743 0.004956011 0.004844188 0.006489066 0.006038941 0.005032002 0.003248313 0.005786813 0.005605477 Hexadecenoyl-L-carnitine 0.034593668 0.022905294 0.024924187 0.02877605 0.036922462 0.022176059 0.033737957 0.023094326 0.030304562 0.028915714 0.026802612 0.02071342 0.02592741 0.025279246 0.02215925 0.024136104 0.018795788 0.021166911 0.02841261 0.026003685 0.034587137 0.02891693 0.063973196 0.050842345 0.050136134 0.048711717 0.05129258 0.05658846 0.053291995 0.057708252 0.04351829 0.053018555 0.049456015 0.05229551 0.05611655 0.059697233 0.052706163 0.06353429 0.049869373 0.053423624 0.056456786 0.050016757 0.049185723 0.055183273 0.04749112 0.07268509 0.06601033 0.05028936 0.053590283 0.047662478 0.06050022 0.05516393 0.048683975 0.057673443 0.065826766 0.053798083 0.05017615 0.05630979 0.05022774 Hydroxyhexadecenoyl-L-carnitine 0.007571866 0.008055926 0.00451229 0.005690997 0.007540741 0.003399669 0.00624006 0.003935678 0.003789436 0.003187327 0.007685616 0.005001076 0.007782685 0.006354126 0.010891669 0.004991201 0.006462252 0.003074533 0.005716129 0.010248351 0.004219939 0.006195149 0.010959959 0.004967092 0.006967221 0.007525515 0.005538721 0.007500531 0.007840476 0.006202268 0.004401396 0.007021112 0.005859743 0.008965675 0.006146362 0.0054817 0.004630897 0.009144953 0.005391184 0.008349494 0.009524702 0.004558813 0.007134926 0.007460389 0.005584105 0.010336424 0.007913675 0.005931683 0.005753417 0.006095957 0.009853244 0.006275449 0.006334002 0.008748971 0.010709499 0.006046978 0.005913718 0.00561066 0.006359492 Hexadecadienyl-L-carnitine 0.00524364 0.007477639 0.00347508 0.009681528 0.008575458 0.00867745 0.007220903 0.004782022 0.008825368 0.009335892 0.008034599 0.004340377 0.005214408 0.003905782 0.008963145 0.008120447 0.004885496 0.006 0.004646288 0.002234199 0.006560207 0.002635457 0.005641569 0.004604438 0.005229243 0.003675382 0.003407871 0.006383666 0.003879895 0.003964124 0.002024671 0.004496739 0.002884628 0.004125889 0.004785095 0.005116888 0.002962223 0.007499093 0.004043449 0.003626898 0.003882905 0.004213819 0.003902439 0.006221183 0.003958062 0.005444559 0.005182069 0.004895646 0.004815884 0.005290364 0.008388521 0.003048192 0.003775315 0.004944326 0.009942251 0.003753344 0.003332724 0.005403366 0.004896456 Hydroxyhexadecadienyl-L-carnitine 0.009831824 0.003398927 0.011815272 0.008936795 0.010719323 0.007231209 0.008665083 0.005465169 0.009504243 0.01050288 0.011686689 0.006944603 0.001303602 0.005207709 0.010457003 0.00590578 0.008549619 0.008666667 0.008628821 0.005957864 0.012464394 0.013177287 0.010822603 0.012956675 0.009151175 0.009533021 0.006726061 0.008642502 0.007555585 0.00599453 0.005897956 0.007869293 0.006962895 0.009701416 0.006738195 0.006822517 0.005164901 0.011358921 0.007525309 0.007473608 0.007870754 0.010156384 0.0121181 0.009522218 0.008332762 0.010405158 0.011907732 0.007930946 0.008026473 0.009111183 0.012750552 0.006763176 0.008325054 0.00950832 0.01030053 0.00698539 0.006572873 0.007829367 0.007894287 Octadecanoyl-L-carnitine 0.021664275 0.022374451 0.04824513 0.038679633 0.033873588 0.015982287 0.036278896 0.025677659 0.025416527 0.029308654 0.057255626 0.028064733 0.025197394 0.033948626 0.022513729 0.043025423 0.02344348 0.007966204 0.017884107 0.02943757 0.025062365 0.021548217 0.050317444 0.030876717 0.03638646 0.030788051 0.024679745 0.040455744 0.052598197 0.030630076 0.022095991 0.032132223 0.024251262 0.03805893 0.040604696 0.034416497 0.029216636 0.030504875 0.033336382 0.034328688 0.04030274 0.023328492 0.032108683 0.049998853 0.026104102 0.040465154 0.04241248 0.02572408 0.02788347 0.026062524 0.051806252 0.030549647 0.025800103 0.02917588 0.037821922 0.033771265 0.02918302 0.038350336 0.022305964 Octadecenoyl-L-carnitine 0.16991985 0.15963933 0.16522194 0.21067223 0.24365535 0.18982227 0.104579575 0.09697169 0.19346356 0.15432973 0.2009109 0.15316427 0.1535663 0.18339162 0.15434033 0.17537202 0.13157986 0.13105683 0.14681011 0.11661344 0.15618637 0.1721935 0.15275197 0.101275176 0.086315215 0.09430591 0.095703974 0.16190283 0.11396524 0.10174832 0.05377711 0.08088419 0.077741 0.09425496 0.11287839 0.097754724 0.08652216 0.13880941 0.08305571 0.09372957 0.13215002 0.06609193 0.09292692 0.13546029 0.058322705 0.15678555 0.122712135 0.09402414 0.10831311 0.08316832 0.16569082 0.09070025 0.05893578 0.10524928 0.11861387 0.09873383 0.092788085 0.117625766 0.076895624 Hydroxyoctadecenoyl-L-carnitine 0.004384616 0.006300518 0.007763024 0.011283139 0.005972495 0.009691817 0.006037736 0.00428169 0.014982079 0.00971246 0.007443683 0.011231527 0.009009314 0.005650558 0.002945737 0.012172172 0.011167347 0.006791778 0.010410959 0.018114842 0.00541407 0.005192143 0.010142295 0.00879471 0.006082172 0.007690139 0.007833538 0.007080907 0.007928299 0.007249932 0.005462012 0.008245335 0.006661954 0.008339695 0.006578249 0.007709474 0.006120914 0.008833739 0.005915866 0.007175817 0.005810398 0.007962605 0.008142252 0.012208297 0.006199941 0.009784855 0.010379805 0.007124836 0.00689916 0.006320166 0.011501999 0.008852824 0.006807818 0.007815178 0.008950801 0.007886626 0.008462355 0.010854558 0.008578759 Octadecadienyl-L-carnitine 0.12130769 0.078756474 0.07452503 0.1611877 0.082121804 0.07268863 0.07849056 0.045671362 0.039498206 0.069201276 0.09230167 0.1235468 0.06563929 0.093234204 0.09868217 0.12628628 0.035983674 0.06248436 0.046849314 0.05928494 0.10692787 0.092160545 0.044235066 0.042602945 0.073311895 0.034164384 0.022619339 0.041652393 0.052148104 0.033246115 0.016678644 0.030892521 0.043947406 0.037226465 0.03575597 0.04209373 0.023678271 0.03688683 0.046319973 0.035647605 0.041602448 0.031482913 0.055751804 0.04588173 0.03967962 0.03991191 0.038253665 0.033738196 0.034955744 0.026966043 0.055990864 0.030636739 0.020732898 0.025112772 0.042540368 0.029309997 0.033446446 0.031840038 0.029747123 Acetyl-L-carnitine 7.733229 3.3865325 5.521236 8.311688 6.765288 5.2736764 6.1645646 3.842164 6.240424 4.2317333 3.387446 5.7137313 7.3656745 3.7031105 4.50989 3.7619438 2.4604957 3.2677646 4.8932004 4.79043 5.260148 5.2307663 5.942349 3.8055408 5.5443254 4.237924 4.876081 9.3287735 4.9994354 5.0261083 3.1465886 4.1453795 4.1768384 5.1881475 4.8640027 6.295795 2.4704382 7.6294622 3.829755 4.4725933 6.520892 4.145672 4.8098154 5.147417 3.2781851 5.6884966 7.165988 3.3142028 5.5352597 4.975361 5.741707 3.8472228 3.0028822 9.070827 8.847413 6.42258 3.8487864 6.165377 4.865619 Propionyl-L-carnitine 0.45434582 0.183237 0.3378999 0.2940309 0.24559478 0.15697697 0.52937216 0.4386735 0.16708173 0.22574699 0.22107425 0.5325209 0.263897 0.3264077 0.23711284 0.2798875 0.17856118 0.3365637 0.24297433 0.23710315 0.4356738 0.21777442 0.3106052 0.27806067 0.30245337 0.5074197 0.24372637 0.27438137 0.30285597 0.42966634 0.18173973 0.34208688 0.62906593 0.2793899 0.31143746 0.6209378 0.16355005 0.21978065 0.25148714 0.36319843 0.2842654 0.42627585 0.3330593 0.4209197 0.3056998 0.2266172 0.21782407 0.30864522 0.35517824 0.28512245 0.40508673 0.17092066 0.16758765 0.40018257 0.20971972 0.378882 0.25476497 0.24414842 0.3241911 Malonyl-L-carnitine / Hydroxybutyryl-L-carnitine 0.036409955 0.045087833 0.023341974 0.04323594 0.034105662 0.036502913 0.019357407 0.021563256 0.028975986 0.025626466 0.015390404 0.023214309 0.020208992 0.018792976 0.031311 0.02551432 0.021416778 0.018468846 0.026426446 0.024472348 0.021438943 0.027128847 0.06563042 0.051949453 0.036431674 0.061217964 0.044904493 0.08184854 0.04221039 0.038145155 0.036003303 0.051178105 0.03904006 0.045072675 0.03857872 0.045865476 0.04279622 0.049156383 0.03771538 0.044978056 0.049872186 0.063883886 0.057356846 0.04972624 0.045774505 0.051048215 0.06284978 0.08730979 0.06799225 0.055789206 0.058005955 0.05459475 0.042933553 0.051802643 0.060302407 0.04259788 0.038472675 0.04827341 0.09704529 Hydroxypropionyl-L-carnitine 0.014825275 0.014634166 0.019592732 0.011002192 0.016632816 0.011885823 0.016306471 0.012114422 0.01552712 0.015461341 0.013161906 0.01606036 0.01083908 0.012888322 0.015240663 0.015528626 0.013868771 0.012612179 0.009797952 0.013774998 0.00875174 0.014798296 0.018022208 0.021856647 0.017914537 0.01809044 0.019188697 0.015966808 0.022761928 0.021496437 0.018223995 0.017438939 0.022866866 0.01713933 0.01799493 0.023800077 0.021781553 0.019662362 0.01656181 0.022950163 0.017038938 0.019961612 0.018495524 0.02116001 0.017087327 0.020895537 0.017938904 0.016139397 0.020203296 0.014210696 0.0256408 0.019221492 0.018965362 0.022127977 0.016414115 0.017139744 0.018197859 0.02101825 0.015879203 Propenyl-L-carnitine 0.005553682 0.008821823 0.010546106 0.006132837 0.007986725 0.007238095 0.008300971 0.0072058 0.012873563 0.005969563 0.005293094 0.011494253 0.009312733 0.008962264 0.010276583 0.010915619 0.011815658 0.005710983 0.010494822 0.010310077 0.007067834 0.012224071 0.01188214 0.008255591 0.007786885 0.011339156 0.01080987 0.012691072 0.007374549 0.008150134 0.008603036 0.010299401 0.011970283 0.009781502 0.013365127 0.011194364 0.010196454 0.009531204 0.007503857 0.007914091 0.010669787 0.01081761 0.008803089 0.026366238 0.010227272 0.014401596 0.012096173 0.007414634 0.012847199 0.007214476 0.015108038 0.009065607 0.008895558 0.007403284 0.011111111 0.009222153 0.008148363 0.010420918 0.009896907 Butyryl-L-carnitine 0.14092113 0.115456246 0.117619045 0.11369012 0.086402684 0.06627281 0.2410962 0.20813636 0.08110908 0.083553955 0.07351054 0.13658118 0.1296779 0.14405589 0.09209351 0.12131216 0.06875679 0.14450543 0.100069165 0.13694729 0.116403915 0.17511098 0.13548732 0.13895054 0.14309116 0.18223953 0.1273391 0.12539974 0.15039495 0.19011489 0.1626729 0.17859228 0.21904561 0.119378336 0.11586351 0.3215144 0.08820232 0.10937074 0.0798927 0.1137452 0.10684267 0.24032679 0.22343223 0.16211845 0.2550745 0.119644016 0.12188154 0.09370748 0.13739416 0.12846477 0.13821079 0.091400675 0.15891528 0.16362822 0.2277299 0.119420715 0.13811336 0.11386965 0.11801305 Butenyl-L-carnitine 0.02990444 0.022054557 0.023133393 0.025003104 0.026061947 0.021288516 0.019368932 0.020345788 0.021609195 0.018654885 0.020731283 0.025747126 0.021054875 0.024198113 0.0214874 0.017737882 0.02278734 0.016254336 0.020989643 0.018165374 0.02369803 0.020232946 0.024906795 0.025009586 0.018688524 0.02544396 0.0207373 0.022697495 0.020227335 0.024857908 0.020725496 0.019401198 0.022359584 0.020927865 0.018348733 0.021415306 0.01948251 0.024962675 0.020166615 0.029430524 0.026452178 0.02264151 0.025186615 0.03479256 0.021590909 0.024255319 0.023677615 0.019408895 0.02619821 0.023447048 0.04203976 0.022879863 0.021668667 0.019460062 0.020666666 0.028612321 0.022463053 0.02375 0.018762887 Valeryl-L-carnitine 0.1697783 0.12186566 0.12465243 0.17498907 0.1308777 0.08767279 0.20762712 0.13752854 0.1374573 0.13560298 0.074593104 0.17697808 0.14305012 0.13920914 0.15008691 0.21617512 0.079999775 0.13062961 0.11226945 0.08948384 0.1509854 0.170536 0.16130961 0.16772778 0.13451135 0.13660318 0.1350679 0.15130879 0.110162206 0.14040174 0.10936547 0.107463896 0.15851624 0.19899035 0.15599684 0.25092047 0.12042637 0.11159505 0.09967612 0.10922856 0.14252448 0.17765366 0.1997143 0.16353142 0.119669564 0.10466236 0.09744666 0.1822294 0.14825998 0.115708046 0.19152565 0.12565576 0.087215155 0.21601552 0.17417593 0.18584536 0.13110103 0.09616029 0.12834172 Glutaryl-L-carnitine / Hydroxyhexanoyl-L-carnitine 0.01547339 0.011908202 0.01594186 0.01875747 0.027625447 0.015072732 0.013810817 0.014677198 0.009634922 0.018371396 0.0134337 0.016630817 0.014324597 0.01530309 0.017941197 0.020872455 0.011714795 0.01456191 0.013150722 0.016265027 0.015134243 0.013498544 0.022260891 0.01726072 0.024241183 0.028049346 0.015535393 0.01786748 0.012996378 0.015745025 0.015209395 0.015940534 0.013563263 0.022107603 0.01873724 0.013812843 0.0140915 0.016211396 0.012863655 0.02028065 0.018129628 0.020432338 0.022336707 0.02024301 0.013518118 0.0165103 0.022714881 0.013113989 0.021402234 0.01960795 0.025074387 0.017362962 0.01831786 0.020882068 0.02733429 0.020116773 0.013182558 0.018717006 0.017469041 Methylglutaryl-L-carnitine 0.009316085 0.019308055 0.020582711 0.032633737 0.02376453 0.029792987 0.02487118 0.026630227 0.02046452 0.024822874 0.027708016 0.025494557 0.025716588 0.021614704 0.026551649 0.029769996 0.023971722 0.0263104 0.026209516 0.024534961 0.020100337 0.02520028 0.03327698 0.044238016 0.038053125 0.03693904 0.028157363 0.02928807 0.031885613 0.034124542 0.036188953 0.032859925 0.032443862 0.03330468 0.029116228 0.030240254 0.037490647 0.041651495 0.037376467 0.03109492 0.033191375 0.036247708 0.033164665 0.038963318 0.033188082 0.033036888 0.031149197 0.030635146 0.03801464 0.041207198 0.038247917 0.0383579 0.039562356 0.04083274 0.042318318 0.03498824 0.035184707 0.030279903 0.03928006 Methylmalonyl-L-carnitine / Hydroxyvaleryl-L-carnitine 0.01670292 0.023599176 0.033053543 0.026944863 0.029140053 0.017239617 0.025595501 0.025802154 0.020942867 0.018696515 0.024408443 0.024778178 0.019499032 0.023297455 0.024775783 0.024328956 0.011577138 0.024273643 0.02048802 0.039893504 0.027974635 0.027982004 0.029623616 0.02460554 0.023417404 0.030582752 0.020074368 0.024068069 0.025068589 0.024790064 0.02225494 0.02820621 0.028120458 0.029421572 0.023247516 0.031214023 0.019440336 0.025398185 0.02732617 0.026004117 0.02864829 0.032738104 0.028129464 0.034521844 0.03212745 0.021434637 0.024075834 0.026504967 0.03347436 0.024089348 0.03122165 0.025199827 0.029114423 0.034843758 0.032866903 0.024521375 0.022593785 0.024654094 0.020695586 Tiglyl-L-carnitine 0.032294616 0.03487342 0.038091786 0.03989673 0.042564936 0.0413771 0.031365078 0.027832586 0.03726688 0.027804878 0.031937744 0.047732465 0.039113224 0.031444184 0.02477533 0.04582257 0.035492957 0.03164225 0.030223696 0.049076233 0.044705883 0.039163556 0.023129145 0.028018434 0.0161347 0.028294371 0.023191862 0.036996227 0.023230288 0.027833164 0.026876228 0.02239463 0.021660136 0.049850747 0.027153285 0.02284393 0.01536647 0.019101296 0.01965756 0.025414988 0.019431818 0.02189935 0.04032258 0.11752212 0.026933745 0.028309455 0.036146715 0.029536622 0.025174005 0.026098114 0.033760726 0.027414287 0.022686567 0.030763816 0.026328571 0.02119633 0.021148292 0.020760095 0.02526388 Glutaconyl-L-carnitine 0.01184136 0.010221519 0.010555556 0.018313253 0.011720779 0.012169736 0.005428571 0.007952168 0.01221865 0.014417344 0.014785992 0.009298531 0.010229612 0.010679157 0.012052864 0.006546081 0.010140846 0.007617579 0.006296603 0.008179372 0.011449068 0.010784167 0.024018727 0.021889402 0.020863837 0.021385282 0.016794108 0.01749434 0.017686697 0.020359444 0.019161755 0.018992914 0.021389384 0.024477612 0.021021897 0.021379577 0.018140972 0.024889566 0.01301275 0.020515714 0.019431818 0.020357143 0.021290323 0.025132744 0.021078583 0.025198527 0.02266828 0.020448431 0.023262054 0.015773585 0.0214841 0.02442857 0.019089917 0.021935938 0.030671429 0.02119633 0.017668193 0.020760095 0.021096641 Fumaryl-L-carnitine / Hexanoyl-L-carnitine 0.06310162 0.056137826 0.056151632 0.06031477 0.055318754 0.048162322 0.044855878 0.041526105 0.057012655 0.045875646 0.0520417 0.082864285 0.041023113 0.05240547 0.075903736 0.06227611 0.032535825 0.040559985 0.034272153 0.03835661 0.047315765 0.046250205 0.06004103 0.076142095 0.04788425 0.06618201 0.044663884 0.058569588 0.052775703 0.045283742 0.03743841 0.042985134 0.05676027 0.07094062 0.06497281 0.0721759 0.041286252 0.064191364 0.038164172 0.059517715 0.05092988 0.0561887 0.054058883 0.048656683 0.03767621 0.065784395 0.041827895 0.048009656 0.057492338 0.055785917 0.10391497 0.057999317 0.048933536 0.071523346 0.07630882 0.057520196 0.045138292 0.059534118 0.038439468 Hexenoyl-L-carnitine 0.022385057 0.024415156 0.019709045 0.023278145 0.015795363 0.024146147 0.021923076 0.026624205 0.025863875 0.018387096 0.021475667 0.033717833 0.02306525 0.014996054 0.022259414 0.019375 0.026603023 0.023030303 0.021749796 0.02449418 0.023588192 0.016040757 0.026116015 0.03597633 0.020701246 0.03523538 0.024936121 0.023595156 0.023655055 0.024536423 0.023356974 0.025693523 0.024881614 0.030702148 0.02517314 0.022470433 0.020433024 0.027082939 0.026993865 0.030006317 0.024196483 0.029853528 0.026927153 0.036440246 0.0313118 0.026767956 0.028665137 0.025685407 0.030330954 0.027733823 0.025255794 0.02857312 0.027134575 0.0259289 0.03182212 0.024336688 0.029993786 0.024711508 0.02320132 Pimelyl-L-carnitine 0.024147002 0.025117917 0.02231543 0.039228335 0.04554213 0.023205044 0.03287884 0.017831558 0.032293245 0.026664637 0.028406028 0.049968913 0.024390023 0.034668416 0.031357624 0.019994842 0.012052558 0.01792361 0.027390413 0.029042836 0.027161283 0.033572555 0.031261925 0.033106007 0.028073909 0.031781297 0.022420093 0.049305174 0.034792803 0.03429874 0.02331769 0.029335512 0.019166777 0.05055534 0.036649775 0.017984677 0.013853085 0.037268296 0.015518835 0.028218234 0.031902768 0.020439986 0.039074272 0.024929322 0.016432134 0.031666152 0.03677501 0.025299078 0.029411247 0.024863644 0.03581038 0.03025384 0.023583757 0.03192406 0.036647234 0.02121634 0.022402506 0.038514104 0.03038512 Octanoyl-L-carnitine 0.123576485 0.08880762 0.083003104 0.14558002 0.11059025 0.09592508 0.12017268 0.09393261 0.113059744 0.09875734 0.13880076 0.1410251 0.086132854 0.10649082 0.15043093 0.11803917 0.092602484 0.082392894 0.09961549 0.09245549 0.08567761 0.10306835 0.10294432 0.12909162 0.097414695 0.1170944 0.09140939 0.13147299 0.09413093 0.104628235 0.07429413 0.082379244 0.0930763 0.1476533 0.12768458 0.1024704 0.073885374 0.12378559 0.080810644 0.12087959 0.09397431 0.09556523 0.10711138 0.11241559 0.07669586 0.11984206 0.08866259 0.09212647 0.09481751 0.10647491 0.1681533 0.10847465 0.10060435 0.112103775 0.11593283 0.088988215 0.08339808 0.11503391 0.086035155 Octenoyl-L-carnitine 0.07093995 0.095063545 0.12923752 0.09018667 0.10664127 0.13327979 0.04694256 0.0911041 0.10982659 0.10627767 0.066149026 0.32139567 0.0838961 0.18238208 0.088383384 0.179002 0.054314885 0.09118304 0.04350626 0.065783605 0.07860571 0.08649014 0.06149793 0.062741436 0.0640999 0.083043106 0.04621893 0.044731263 0.05909074 0.078856744 0.04088646 0.032782592 0.035903305 0.10004831 0.06860272 0.13115335 0.043745704 0.07996125 0.08030628 0.1590482 0.077996954 0.06851153 0.17048083 0.073457904 0.057488877 0.11383406 0.09498104 0.057785124 0.11018701 0.08341464 0.12961048 0.09289039 0.03952815 0.07505534 0.10307888 0.08751159 0.032387145 0.051003717 0.08655771 Nonayl-L-carnitine 0.011412969 0.021917809 0.014155995 0.021794118 0.021139072 0.013360378 0.03288948 0.02707254 0.030230286 0.007416762 0.010541611 0.030082151 0.020505166 0.021373447 0.014962661 0.016103895 0.015 0.023327194 0.018359821 0.029959776 0.014939759 0.01894081 0.043826424 0.022743879 0.026109563 0.032092437 0.031449154 0.020858353 0.030345568 0.021581363 0.01625405 0.02566465 0.032092676 0.035664637 0.019194057 0.028532423 0.012369092 0.018923579 0.013609232 0.024748372 0.015317829 0.017572254 0.034105517 0.03236217 0.012045283 0.023554713 0.016492404 0.024769582 0.015918612 0.030235823 0.034876198 0.025864558 0.031489052 0.021194136 0.017825432 0.014805195 0.015975976 0.020857899 0.019408781 Arginine 107.28895 110.94685 93.760254 119.982 97.37735 85.79977 125.19808 83.40189 85.20205 96.72493 122.46971 122.51252 72.18958 90.30678 143.11761 90.0393 92.667656 153.77042 101.137535 104.95645 96.784195 77.33706 83.933464 75.72154 87.9555 67.38375 74.94964 98.118126 74.916595 97.80398 68.826454 84.9609 70.63057 82.11871 71.434654 81.68932 69.15129 84.13266 66.07312 102.35804 88.33249 98.16739 64.11338 83.40887 77.92122 96.855736 90.11286 81.18806 95.476204 100.0323 87.721054 82.05412 89.220505 72.70226 69.63676 82.45359 79.19676 96.22588 86.01357 Glutamine 390.159 483.92746 404.52365 368.45242 398.03995 440.24506 510.31458 417.13205 492.88232 402.93903 438.52884 546.79565 363.5541 447.86734 492.03983 397.72458 474.2922 410.07666 473.41693 495.55554 442.89258 393.99805 451.21075 471.4789 532.9916 426.98257 572.9743 518.1954 577.00134 521.3037 447.20572 614.9482 513.0377 497.38293 454.93512 456.79526 368.9875 543.96246 625.7165 528.61005 521.512 525.252 648.9066 481.6246 410.02295 444.5978 440.3321 447.26947 412.06735 577.8977 406.5035 542.5755 505.7399 491.48544 469.50732 474.50873 517.62415 572.30774 476.82706 Glycine 214.4575 210.97903 176.0339 199.61115 186.00558 222.8285 227.62648 194.51805 340.2477 182.4911 235.68884 193.55917 180.41765 217.23795 260.118 190.46822 315.2699 200.75827 226.6357 210.45418 215.20143 149.30278 173.05305 255.79445 265.8984 226.74527 221.53818 189.82527 245.71689 266.2846 176.08687 249.53772 242.2129 253.39291 199.59335 178.88506 180.81244 197.00125 321.29825 205.08514 198.92592 256.39954 278.96136 280.28375 234.68506 213.91829 256.90823 251.8184 232.62604 245.70448 228.15149 188.7587 227.0303 185.97972 197.90907 197.33818 222.74257 177.652 209.28229 Histidine 72.06301 55.53124 63.4736 59.049816 66.424355 57.804047 79.67824 71.74612 68.95066 58.52767 65.47402 85.90452 62.57568 71.61905 70.90706 73.75659 59.236755 49.391014 99.633 75.897705 54.538372 56.443462 49.122402 59.543365 62.364075 61.677116 61.33508 60.37264 68.479744 65.78211 50.174618 69.92298 52.42944 64.95322 54.515053 68.50987 41.87314 62.903683 68.92671 64.37478 66.91469 73.51903 79.7473 64.79115 61.111744 60.35607 70.85172 71.14871 58.67555 62.669846 67.37961 52.06076 54.028297 57.85934 56.14094 58.92848 64.7722 64.634155 55.32093 Methionine 33.11679 28.427094 18.912222 24.822474 24.25612 27.172102 35.07726 27.577805 28.066942 26.2628 28.910324 32.892708 20.855997 22.858177 35.10947 23.928745 28.754343 26.867004 27.209372 27.322092 31.1442 27.79149 23.227112 27.636864 37.18934 30.856773 30.89385 29.696758 32.216175 32.13173 25.390123 35.0312 31.025381 51.000446 23.034857 28.820595 22.243534 27.062828 33.08744 32.020752 31.065722 33.309093 35.646072 33.15218 26.614906 29.49673 29.844614 30.806551 26.617537 32.420765 30.202427 24.073275 34.43504 29.60342 24.920765 28.15195 28.312416 31.50524 26.337326 Ornithine 47.99127 68.99151 53.433132 51.25412 52.33689 54.27004 70.80095 45.83314 62.941082 42.912296 48.640984 72.97813 50.481483 53.967236 62.9848 47.27873 48.464027 57.456963 52.37443 52.08042 56.384533 50.59728 66.06255 49.17469 59.753788 67.80214 66.217575 30.148153 86.92193 75.64451 42.13056 66.31927 62.4916 62.618736 63.33197 51.854057 50.4515 53.598534 62.054398 45.39782 62.088036 82.077385 76.52086 73.71599 63.958927 58.885315 65.41464 65.57186 57.713642 67.98262 78.96322 65.204796 50.959133 51.12767 54.321487 60.497868 49.39671 66.98736 51.960075 Phenylalanine 53.35534 40.24728 34.543266 43.18567 38.500183 37.939342 52.54588 43.334198 44.35283 33.354546 41.2953 49.97901 50.076435 37.418976 39.160995 38.478096 37.749725 32.26234 42.435375 42.072807 47.0706 42.933365 38.742306 39.955868 56.60152 41.674572 49.725876 51.81349 50.44787 38.34483 35.866386 40.93075 42.14895 52.417534 44.416763 50.11624 35.655266 42.60455 42.67002 43.270187 44.005363 46.26417 51.028427 42.085114 48.817657 54.21602 39.619114 47.974445 33.04622 37.750023 49.347294 39.71255 39.006695 42.662106 41.023483 46.31116 41.324562 44.51044 40.933105 Proline 142.19722 389.1678 124.765274 131.66554 125.72035 141.78976 192.63339 152.03253 161.44232 138.04077 187.77362 232.63889 132.49269 134.0631 177.61316 158.33817 157.58142 185.7306 147.4682 162.9452 217.69585 122.56766 309.254 162.03087 349.76932 252.68098 221.49776 206.82927 196.95308 246.13777 128.1827 210.21384 273.94754 248.16 160.36432 252.44547 111.03507 172.266 248.16112 205.00337 283.55777 284.4786 237.18536 280.0511 194.38939 337.26163 170.01581 191.20836 164.05458 250.48833 188.5606 203.5193 397.784 199.30391 173.6375 166.14607 155.9221 319.46786 266.89642 Serine 147.40862 116.46816 111.83035 99.223656 93.34511 115.68368 140.57826 97.345985 127.08667 102.57183 110.19972 107.07127 80.07575 97.084564 105.973076 89.37055 144.9358 92.68829 125.71561 97.144936 125.9387 97.130684 119.23071 108.682274 136.74313 115.38807 137.25285 108.34659 115.57502 98.14272 79.509834 115.80082 98.07002 127.49375 102.92237 86.769745 107.726135 95.672264 100.36975 100.66433 100.3915 122.89087 120.16322 140.56963 99.663795 123.67585 139.79547 112.22382 131.81805 116.23913 129.09813 89.56162 107.61003 104.07971 90.890274 119.87653 108.97486 98.03365 103.48609 Threonine 136.03558 117.010765 112.018166 94.45764 125.658195 121.584114 127.658394 120.08656 119.755486 115.56429 116.03275 124.6514 91.18778 100.89199 139.82202 110.572205 148.01389 108.196495 117.96224 109.906235 102.54837 107.932724 86.89261 89.782684 95.248 97.162964 102.26268 79.184685 121.15654 148.79498 83.493675 100.27985 99.04504 111.12728 73.81394 86.46834 61.695923 104.423195 118.73842 105.148 109.4865 126.35311 97.11762 123.665565 90.879074 115.534904 122.65514 102.45118 100.74116 106.91124 113.80221 74.87501 124.61575 81.6678 107.184235 94.357994 96.31945 98.72605 87.347664 Tryptophan 92.36997 79.49811 66.22484 85.32996 76.74178 79.459404 86.78423 82.00165 86.565735 67.829025 88.40817 100.345314 82.39247 78.17859 80.9365 87.6433 64.656456 71.26476 81.81666 87.99216 82.058624 76.40903 72.26791 71.45375 80.38267 74.55291 82.87108 90.34433 82.36147 75.84283 65.93816 85.26423 85.17269 84.323135 74.58021 82.126434 58.182922 73.89262 82.272064 82.46837 79.18299 82.42963 86.52331 75.92249 70.30029 79.93534 72.90497 82.80087 64.69598 75.13697 84.621086 62.251343 71.413445 78.697464 60.67412 81.50467 78.9596 81.101845 76.60407 Tyrosine 56.552586 64.92526 41.844807 56.092434 47.270103 51.761566 66.34938 71.20349 65.96295 45.757458 61.942493 88.29457 55.023987 45.931393 60.282402 58.323174 57.412853 51.949272 62.19857 63.468376 60.29399 71.88263 46.524075 46.50759 55.333157 57.872692 65.32333 63.76615 57.80506 46.233173 45.68772 55.255447 60.797512 62.745476 43.513348 53.15526 35.00355 50.759228 50.127495 59.22884 59.81901 54.566257 66.781944 56.208935 53.971054 53.45195 55.253918 51.634808 47.148087 52.98299 62.478443 41.60336 51.453747 53.928318 49.95033 55.448936 44.61003 64.31482 41.585953 Valine 321.229 309.40726 297.34503 269.29877 309.87756 323.1985 389.07068 299.14722 260.70337 237.00783 246.13431 390.56277 246.76118 247.85254 296.46747 250.7329 197.71864 212.7681 284.80298 269.58713 328.39667 342.21124 139.89189 139.36673 149.93123 140.69241 159.45529 175.16977 170.80861 144.76306 146.80708 144.85027 166.76918 167.30891 147.71367 183.87163 116.624275 139.11092 150.47981 154.17024 194.25641 155.86462 157.27095 166.04497 172.5566 159.28865 135.85957 189.70956 131.96944 153.41603 185.41751 145.18388 116.9455 144.28896 185.3664 183.80687 149.89731 169.5266 148.62799 xLeucine 233.11375 225.76978 207.46352 184.25862 212.47809 222.2004 259.69458 183.6465 187.94698 188.973 196.67424 268.30573 167.261 174.89528 195.36887 153.55894 160.55789 158.43227 194.06693 182.84427 262.00375 220.9168 142.43423 146.18607 174.534 165.82204 190.25232 218.88124 178.91072 155.37587 146.72823 151.86897 175.2533 190.42558 146.38518 190.94623 132.4444 147.44998 155.01595 172.60553 195.21184 196.24457 171.28993 174.48264 152.69029 175.82469 175.8694 208.1031 135.0646 165.6206 231.81406 161.05377 134.72604 163.52557 200.55681 193.74551 154.1326 176.29416 148.56209 lysoPhosphatidylcholine acyl C14:0 2.2115753 3.2698777 2.0096023 2.1485677 3.153396 2.4961753 3.3159373 3.803784 2.6846178 2.0730636 3.233217 2.7202306 2.9532204 2.5844004 3.155178 3.2879148 2.7316418 2.781216 2.4409688 3.2291486 3.0618494 2.7306488 3.9187727 3.3511665 5.134026 3.3888426 3.5397248 4.1182475 4.185579 3.154778 3.3992689 4.3620954 4.454737 4.037726 3.0922043 4.5860815 3.0758214 3.7090297 3.8885787 3.6709845 4.26504 4.1155515 3.4641795 3.673336 4.7805142 3.8757012 3.4005861 3.8484793 3.2244337 4.1680713 3.0150664 3.1257615 3.8825302 3.3768296 3.2789211 3.7377949 3.7865067 3.434663 4.5237265 lysoPhosphatidylcholine acyl C16:0 99.72009 100.813675 69.487526 106.5988 120.75148 101.40481 91.598854 105.12067 77.988884 71.42605 103.293396 77.444496 87.467575 80.982315 100.52466 98.615685 82.079704 84.13833 64.298195 97.3107 97.13041 83.90674 104.635124 78.97508 108.288086 74.83898 58.46533 93.04897 88.685074 92.535515 72.62145 88.179054 102.0809 95.93079 72.305176 110.43062 44.299065 85.78364 90.489296 74.8721 73.39675 88.20974 99.56531 91.1213 104.279495 99.476395 98.035645 86.91489 84.07883 75.02976 79.00259 62.82238 73.546906 71.63311 70.03894 107.111336 71.80124 113.25271 101.395874 lysoPhosphatidylcholine acyl C16:1 1.989268 2.9293509 1.3545953 1.9028981 3.114893 1.6788791 1.9028503 2.4906204 2.4387295 1.0534135 2.1824214 1.2790488 2.0787063 1.4551804 2.006327 2.5050778 1.8411195 1.9111758 1.3856199 2.9744432 1.951929 1.6565936 3.1212866 2.4037747 3.058078 1.8706633 2.032845 2.7483346 2.6141465 2.4718668 1.8797946 3.6792998 4.390244 2.0894341 2.1897635 3.7446835 1.1288157 3.0250032 1.9561574 2.4935234 2.8548458 2.5231693 2.6237574 2.2404082 3.212407 3.5288916 2.5448787 2.900893 2.136688 2.0491211 2.200909 1.5185751 2.1154592 3.7126973 1.7753093 3.6665988 2.5718813 2.4380834 2.8007889 lysoPhosphatidylcholine acyl C17:0 1.3606746 1.5877575 1.2585734 1.7113591 2.0791621 1.3809485 1.4933761 2.035603 1.2576588 0.9116078 1.3273207 0.93226445 1.3256524 1.7617384 1.1072261 1.7433988 1.5690155 1.5289407 0.9452585 2.1498878 0.9683099 1.6893613 1.4735007 0.9659682 2.2337687 1.161532 1.0940968 1.0976322 1.3886504 1.372629 1.4856611 1.5001383 1.8339587 1.8137449 0.8331142 1.5425631 0.62125146 1.3797123 1.4842223 1.3290155 1.0783838 1.1142658 1.4399918 1.7907708 1.6529027 1.955122 1.3280473 1.4254488 1.0539492 1.0992054 1.3867517 0.99466115 1.072579 0.9179621 0.9089322 1.5002034 1.2180213 1.4170717 1.7484627 lysoPhosphatidylcholine acyl C18:0 23.359406 28.497255 21.091858 33.891132 36.12992 24.98829 25.686888 26.40445 17.74566 22.894505 29.66843 19.753937 20.496115 25.962137 27.840906 29.095942 25.587172 24.84135 15.765164 32.372234 27.843534 26.21419 27.667831 20.737682 27.352942 19.97776 14.399907 21.827501 26.401497 25.846252 21.37766 18.58581 21.125431 28.485554 18.15887 28.161547 10.524272 20.186121 26.178705 21.387348 17.106142 20.915943 24.714802 28.903034 28.045382 28.566162 23.924898 21.980606 22.277466 15.211269 21.695438 18.854698 18.496613 15.443754 16.533728 23.859375 17.8808 26.711422 25.39758 lysoPhosphatidylcholine acyl C18:1 16.117405 26.212646 12.8214 19.970411 30.49459 15.264038 14.512803 26.150183 17.791811 14.0565605 21.20549 11.061734 18.995827 18.594246 18.35342 20.213234 28.299246 16.219568 13.584204 21.032448 20.636356 13.547763 26.108013 16.38993 24.74858 17.645924 18.361149 27.45489 17.108149 24.029062 14.35192 19.099419 21.822704 20.949715 17.331467 19.070637 10.158254 21.418926 19.177282 19.087349 15.029094 17.910767 22.43048 21.37147 15.802509 28.438276 21.185764 21.593327 18.832119 15.044254 18.73001 15.822966 19.341116 22.020782 13.570235 23.397488 13.53422 23.869648 21.442554 lysoPhosphatidylcholine acyl C18:2 37.244156 45.281857 17.345678 44.487007 56.51471 31.64506 41.35287 52.303024 27.007418 26.73712 39.398453 25.49991 28.442532 35.00582 40.667667 39.40843 62.237614 32.115036 19.91117 39.423244 48.2203 28.216703 48.661175 32.158073 63.018986 39.575356 28.926987 52.260902 28.012218 37.16535 25.799362 30.124739 34.75727 38.96056 26.64053 29.122234 16.9573 27.298872 38.378944 32.87953 23.51132 35.324368 52.006252 30.727821 36.231136 33.835354 41.684986 29.903032 31.348104 27.15507 26.926243 33.713253 27.989857 28.152729 20.131811 32.864624 19.869822 42.001644 34.49472 lysoPhosphatidylcholine acyl C20:3 1.4531739 2.8852515 1.2008967 1.5699677 3.6080208 1.2075251 2.1023183 2.6052802 2.0803447 0.9653043 2.0926406 1.6048863 2.0894706 2.0181296 1.9397825 2.1920838 2.9582396 1.6887661 1.5743493 2.5508716 2.0868514 1.381918 2.92051 2.743097 2.9630785 1.6636984 1.7562541 3.2483869 2.5715878 2.4408479 1.9709103 2.6301363 3.0133388 2.8172977 1.8307908 3.4714665 1.5411456 2.2249522 2.6532118 2.2509499 2.2611108 3.049803 2.1541312 2.7062044 2.3677995 2.4305491 1.990377 2.1548586 1.8955276 2.1817222 1.9137948 1.905385 2.1865268 2.7238314 1.5396942 2.3501942 2.9061608 2.9156258 3.0069363 lysoPhosphatidylcholine acyl C20:4 7.439632 6.7079673 5.006859 7.1452365 10.00693 7.734117 7.735849 7.284266 4.978233 4.2710514 9.572024 4.850477 4.372571 4.59837 6.4102564 6.728165 6.0569654 4.9726973 3.765849 5.2452083 8.577005 5.097211 8.937389 8.693714 7.7635603 5.9270053 6.6200624 8.981621 5.380407 6.4263997 5.810562 4.8059754 6.757739 6.602031 6.8310585 7.5217285 3.8966968 8.589195 7.819045 6.027202 5.00268 5.4708843 7.297325 6.6636586 7.0527945 10.010501 10.004187 7.3295507 5.710352 5.255237 6.933758 5.839481 4.522194 8.867582 4.2413197 8.071857 7.7948833 10.8659315 7.8025293 lysoPhosphatidylcholine acyl C24:0 0.2223074 0.23795848 0.2983539 0.25399733 0.22716773 0.19325228 0.2087515 0.28338787 0.27813607 0.22959012 0.19144048 0.1891551 0.104108825 0.15133877 0.31218782 0.29620853 0.15548801 0.19657809 0.17082985 0.21153514 0.15691978 0.18204325 0.2759513 0.24396889 0.2816491 0.30668887 0.33177984 0.20056401 0.3802841 0.24843453 0.19970836 0.27538162 0.2685272 0.25194564 0.259377 0.37292734 0.22737445 0.29667056 0.29042166 0.23186529 0.26289594 0.2665131 0.27800554 0.23648754 0.23718232 0.3675353 0.3676663 0.24532601 0.22280636 0.20226343 0.25945675 0.25364968 0.25129646 0.46635652 0.23678066 0.30639747 0.30224136 0.3587686 0.46061027 lysoPhosphatidylcholine acyl C26:0 0.1938393 0.5529204 0.35820445 0.22441497 0.28837016 0.18002704 0.32025388 0.3533756 0.5991961 0.20857331 0.22605298 0.28309116 0.21604759 0.21147375 0.31216106 0.49089932 0.2610549 0.16904499 0.19860451 0.21497768 0.15836087 0.19258538 0.47450346 0.38858938 0.40564623 0.5675469 0.5567079 0.37701306 1.0711496 0.49797428 0.3772232 0.5395453 0.56748605 0.56343347 0.42776436 0.94055414 0.4440716 0.54291016 0.36425948 0.393495 0.542176 0.48730442 0.36853582 0.39833382 0.44526288 0.45370793 0.5873313 0.3826325 0.43177214 0.3790492 0.41711235 0.33309457 0.5674155 1.31448 0.4224458 0.47466287 0.41939467 0.69989175 0.9475596 lysoPhosphatidylcholine acyl C26:1 0.2184745 0.3569377 0.20233196 0.14573617 0.13476051 0.15299138 0.14853473 0.16364652 0.35875523 0.124924034 0.13188122 0.085570164 0.10063853 0.09701203 0.2081252 0.3512187 0.18375857 0.09464871 0.10629413 0.086340874 0.103337415 0.12743028 0.21125458 0.21053153 0.19909678 0.2775465 0.30071017 0.1786843 0.38396427 0.22688085 0.19336842 0.20747931 0.25445592 0.2163303 0.22112787 0.4268631 0.19246262 0.2785335 0.18849483 0.22020726 0.21567677 0.20356779 0.15629804 0.18047734 0.19785675 0.35924503 0.35065684 0.23021114 0.16773063 0.20346737 0.17535698 0.1340245 0.27071482 0.784069 0.21495755 0.28859845 0.23545393 0.42177814 0.52674323 lysoPhosphatidylcholine acyl C28:0 0.30053294 0.5261127 0.35466164 0.29394433 0.33584023 0.31849483 0.30455825 0.2975371 0.5564741 0.25811157 0.30122712 0.2282046 0.21293835 0.30158818 0.40736538 0.39662138 0.29331174 0.20980018 0.2269654 0.32248342 0.27761272 0.18816295 0.39774975 0.3572482 0.4793985 0.5014628 0.505752 0.38961497 0.83381367 0.45696163 0.4008381 0.487227 0.45356658 0.5278602 0.36683044 0.7499784 0.38544312 0.46841332 0.37863502 0.4637243 0.5100001 0.49516833 0.44057816 0.39594337 0.48608702 0.50662625 0.47674558 0.39803874 0.39525688 0.33733287 0.47562745 0.39642197 0.5659007 0.82335615 0.44965693 0.44497114 0.44118625 0.6048723 0.7630911 lysoPhosphatidylcholine acyl C28:1 0.37178996 0.52925247 0.4835391 0.4538641 0.3272755 0.2898784 0.42151746 0.37918097 0.47162205 0.22621378 0.19994895 0.22068095 0.28803444 0.24447031 0.43706295 0.4527759 0.36398333 0.28758645 0.23536557 0.3367294 0.1951929 0.33860046 0.5004093 0.44706988 0.6094304 0.4829309 0.59143364 0.38411048 0.85379916 0.4537617 0.43005982 0.583457 0.48663226 0.5790793 0.40639716 0.71041113 0.38761076 0.5039513 0.38676348 0.47668394 0.43901068 0.41918895 0.4355847 0.3780689 0.4424126 0.5761738 0.7824358 0.4732118 0.35423708 0.3864676 0.4527073 0.37659776 0.5140155 1.041643 0.4320974 0.59881 0.5207154 0.6172363 0.8075183 lysoPhosphatidylcholine acyl C6:0 0.004102733 0.010288066 0.020819454 0.019251501 0.012078268 0.012043356 0.007982757 0.02015479 0.020257952 0.009007386 0.003470294 0.027163368 0.02081252 0.021157753 0.02473673 0.00728067 0.007592438 0.025902262 0.007654624 0.009242388 0.030960519 0.009712039 0.01110186 0.012205947 0.006077698 0.011040506 0.013612851 0.006339948 0.007544702 0.015243903 0.011871785 0.014343429 0.00770511 0.018798675 0.018137064 0.011170064 0.018134715 0.007657163 0.009374833 0.010249052 0.01711423 0.013518164 0.020725675 0.024859998 0.016277555 0.01126549 0.015651336 0.019682925 0.012184045 0.012564823 0.018154997 0.017458482 0.008899512 0.00905592 0.007715454 0.016243184 Phosphatidylcholine diacyl C 24:0 0.09486728 0.14910537 0.15075934 0.10324086 0.07062147 0.09282113 0.11197025 0.12435799 0.16888326 0.10330579 0.070644855 0.076475985 0.078563415 0.06273878 0.13711822 0.18790247 0.10064702 0.07075923 0.07177978 0.07268082 0.07703726 0.05293106 0.12560904 0.10789496 0.090538956 0.12931277 0.14131415 0.096242785 0.22620949 0.12673464 0.10398832 0.10743228 0.11495055 0.12857533 0.112176165 0.22134477 0.11090917 0.1407866 0.116272256 0.097190425 0.11232563 0.081748635 0.09254619 0.09219065 0.10545801 0.1874757 0.17056227 0.11598838 0.099948436 0.108162954 0.09349803 0.08919985 0.11629512 0.3034134 0.09723045 0.11706602 0.115512565 0.19042343 0.21367972 Phosphatidylcholine diacyl C 26:0 0.66407096 1.1514248 0.89679635 0.68228745 0.6678773 0.58646077 0.6823847 0.69256276 1.0046635 0.6517503 0.61483103 0.63475066 0.5826786 0.5562214 0.7567669 0.9310672 0.6829619 0.5584242 0.51232815 0.62659675 0.5618083 0.5954744 0.9450427 0.7880766 0.8506774 1.0454344 1.0319752 0.79320097 1.540963 0.98577285 0.7452916 0.89075744 0.95693654 0.8994076 0.8221822 1.2422643 0.853272 0.8438171 0.73183125 0.81419337 0.85477775 0.78219265 0.78934777 0.73316973 0.80019075 0.97889334 1.1068718 0.8419392 0.83724916 0.78752667 0.756562 0.76505095 1.1271069 1.8720813 0.7587239 0.8811229 0.69256204 1.2516038 1.4410223 Phosphatidylcholine diacyl C 28:1 1.1403838 1.5159045 2.84004 1.7360176 1.7231638 2.0030377 1.8791989 1.8340275 1.8586754 0.8482833 1.280438 1.5907005 1.4590348 1.3924264 1.3722289 1.4557163 0.8570972 1.4037101 1.4293149 2.1198573 0.77319103 1.8327378 2.2477407 1.6544878 2.65979 1.5570632 1.767318 1.5222402 2.6229463 1.2644299 1.8078356 2.1102972 1.4068015 2.2542508 1.5276692 1.9541365 1.3784715 2.1262386 1.3649776 1.7553902 1.869772 1.4763019 1.5126319 1.4667025 1.3569305 1.8009529 2.2859504 1.5798982 1.4131839 1.2954465 1.9913365 1.4322466 1.3833278 1.8233185 1.5757395 2.564431 1.5817521 1.893153 1.808383 Phosphatidylcholine diacyl C 30:0 1.4767593 3.1161327 2.8026414 2.2028625 2.1394413 1.9234651 2.8479712 3.3074245 2.2534714 1.0983485 3.1879642 2.610094 2.410102 1.1705184 2.1981633 1.9179426 1.1187952 1.7801894 1.4783132 2.48613 1.4717443 1.8994659 4.7704597 2.1905832 3.708742 1.7724828 2.8985062 2.421463 3.945475 1.8386745 2.9057276 4.6511154 4.0224824 4.1635656 1.5510967 3.9451458 2.1904495 3.8725436 2.1068878 2.66515 3.4638052 3.139361 1.8946639 2.1996622 3.3392048 2.428978 1.9221171 2.74452 2.121588 2.2802045 2.5134115 1.7090383 3.2632875 2.6660838 1.956907 2.663498 2.8070192 2.6081772 4.4009604 Phosphatidylcholine diacyl C 30:2 0.106247164 0.17376958 0.2772159 0.12392819 0.048736796 0.21014206 0.1175236 0.23115651 0.26582894 0.09426632 0.21511874 0.15681005 0.21898638 0.0945509 0.20589545 0.17051746 0.14097176 0.17475592 0.110860854 0.27014458 0.19037962 0.15125917 0.052879356 0.11392629 0.03801003 0.059910767 0.0598377 0.16122657 0.13292034 0.11648348 0.07809018 0.18628916 0.17522934 0.06659888 0.01786305 0.09971313 0.103942595 0.041159917 0.026394242 0.025696311 0.05268005 0.14228284 0.06298004 0.16299017 0.030563578 0.0751037 0.039819665 0.13143043 0.12013531 0.13564105 0.03431677 0.08179958 0.15098757 Phosphatidylcholine diacyl C 32:0 14.419317 17.703918 21.135347 18.4207 17.15599 17.44617 16.265564 15.838407 15.358307 11.618801 18.43204 17.285244 14.126392 10.100334 14.567498 13.228987 8.311665 10.934977 11.919684 14.0518875 10.596295 12.894378 12.553126 6.923249 8.548842 7.307981 8.268532 7.314876 8.950989 6.8839793 6.352609 10.074507 9.637951 10.392728 6.1452985 10.018622 6.094683 11.396301 6.14724 8.410694 7.7122664 8.184405 7.263556 6.1915107 7.958581 7.9123483 8.236527 8.344186 7.610983 6.140141 10.863741 6.8986773 7.4667773 8.151052 6.427183 8.522795 7.440915 10.424827 11.080965 Phosphatidylcholine diacyl C 32:1 6.968614 19.574194 6.0396433 5.9109845 13.545665 4.704258 6.4032807 13.703377 14.644055 3.8559797 12.937121 10.061116 18.151476 2.7819808 10.347628 8.160349 3.1970353 5.496545 7.1353526 14.620854 6.4871655 5.2432475 14.660186 9.767124 7.9663277 5.9821696 8.561144 8.4336 11.764263 8.27228 6.742221 19.40655 17.479376 7.507636 6.4635425 21.5901 5.876307 16.356052 4.756706 9.090661 18.892141 10.069886 5.4464855 5.8293214 11.279759 12.434072 5.8232193 9.082561 8.554786 6.430424 9.311743 5.2591596 9.462585 17.547651 7.3572016 13.594567 8.586455 8.419936 13.017439 Phosphatidylcholine diacyl C 32:2 3.6890006 8.634044 4.142562 4.825239 5.9968715 4.1067185 7.017913 7.4247785 5.2313995 2.49064 7.6271343 8.935857 6.652156 2.7659087 7.7678747 6.8560495 2.5469394 6.2524815 3.208955 7.3853245 4.970142 4.5485897 3.0178604 2.2777379 4.888951 1.8617283 1.8256612 1.6632075 3.2347307 1.7841399 1.9068995 3.2844932 2.7487698 3.1281931 1.1411334 3.9616199 1.2733128 3.120256 2.167885 2.7334843 3.8502777 2.7124848 1.8704593 2.0390303 3.395694 2.9663515 1.3439122 2.093766 1.5923336 2.590906 2.6168578 1.3492681 2.1279576 2.2517686 1.2454484 2.4485037 1.9002723 1.8761808 3.3862305 Phosphatidylcholine diacyl C 32:3 0.49725443 0.99602467 0.9869314 0.77779365 0.7154555 0.7421033 0.6444473 0.78744245 0.5918861 0.36739162 0.5430051 0.82534194 0.54405624 0.4806992 0.60777456 0.55635244 0.3187845 0.5154352 0.38519555 0.7643865 0.44883797 0.5246891 0.339618 0.21919464 0.32156935 0.28380606 0.3067479 0.18012701 0.2655839 0.2322747 0.18704112 0.29843375 0.23686254 0.30577415 0.16948561 0.4161209 0.16791458 0.28487775 0.2614759 0.31599903 0.31325033 0.259466 0.22682828 0.2223408 0.26921067 0.33143568 0.23804112 0.24099593 0.19691883 0.24364132 0.37457794 0.19741859 0.22504084 0.25738943 0.19154853 0.26467362 0.19760126 0.2277568 0.39407003 Phosphatidylcholine diacyl C 34:1 188.46594 287.82556 269.92224 189.49883 263.37823 185.10052 136.01866 241.6669 243.35976 141.08405 266.36694 269.1042 262.3714 125.20251 206.18562 174.14319 120.31606 139.71692 166.36934 221.5408 151.15202 150.06172 169.3804 126.24409 109.96229 121.038506 111.6583 119.749855 130.87718 138.47142 94.212234 146.71458 125.6829 129.47188 113.6447 178.13905 95.9521 168.6393 88.3627 135.14214 140.77332 124.31884 107.21678 119.961975 104.794304 163.8993 115.92407 129.45775 134.20457 103.939095 184.55528 96.341965 122.23401 142.60078 116.37549 157.50493 101.08498 155.15088 137.40656 Phosphatidylcholine diacyl C 34:2 608.45166 696.3137 707.4532 773.68774 694.9772 612.8937 587.0484 646.8332 544.7662 483.00464 680.6336 1038.9427 608.2694 417.45422 678.6042 554.5524 375.13257 492.13467 455.85617 589.4822 515.3679 551.6561 232.3704 200.06831 193.24382 213.43422 161.85861 170.6215 189.01512 195.39316 150.87675 185.79697 173.42734 212.62236 161.70326 224.42865 136.28261 209.18228 153.17566 194.78781 191.12283 187.91264 194.35686 166.28183 182.06984 205.13864 189.27373 162.50534 195.1061 164.92561 261.10056 168.88469 158.0093 167.12755 151.2589 200.23534 136.21255 222.50961 180.45378 Phosphatidylcholine diacyl C 34:3 14.325536 32.543186 18.873505 19.476181 27.1589 15.024325 14.671824 26.42147 17.805355 9.047027 24.759972 27.483719 22.49558 13.142237 19.819513 20.40801 9.162625 16.364754 12.691235 21.369112 14.575305 15.665658 12.5144205 9.469278 10.839385 8.731749 8.9152155 7.4667554 10.356856 9.28756 6.29948 12.669326 10.93696 10.519427 5.9317 18.339863 5.5192995 11.728805 9.554216 14.406587 13.089364 11.732573 9.68193 8.222606 11.307562 13.106039 7.960574 8.288722 8.242141 8.11323 10.945837 6.8462143 7.5103407 11.725323 7.3927646 12.852537 6.7621694 8.619343 13.759465 Phosphatidylcholine diacyl C 34:4 1.3544844 3.502468 2.1366556 2.0693593 2.5701127 1.7601167 3.1538863 3.389426 1.8767846 0.95626044 3.979746 3.4939475 2.5465248 1.1990168 2.6624846 2.784836 0.73272854 2.209406 1.1421183 2.172994 2.2331755 1.882218 1.3383541 1.3885462 1.5663539 0.8497833 1.1436741 1.017535 1.2876344 0.77072966 0.9140058 1.2966841 1.1901371 1.2544497 0.5497948 2.3158207 0.5711656 1.8320262 1.1397156 1.3666416 1.7263575 1.2890526 0.78380454 0.98177963 1.6493641 1.8779056 0.7823155 1.0991426 0.63361704 1.2408574 1.3798473 0.5378214 0.8559887 1.2090317 0.63266027 1.2549942 1.2899046 0.9809142 1.8993112 Phosphatidylcholine diacyl C 36:0 3.1045582 4.1041675 4.1712866 5.316859 4.0437884 3.9747467 4.6786046 3.4723828 2.471271 2.411377 2.9186854 3.1670635 2.0866754 2.8697248 2.9364145 3.472641 1.5658703 2.3003378 2.327669 2.8720539 2.886081 3.4579027 1.3951858 1.53453 1.1880139 1.458155 1.6266273 0.9652248 1.0668411 1.2139535 1.1473379 1.5432146 0.8221676 1.3117726 0.87743807 1.501077 0.7698778 1.6998948 0.674541 1.0799819 1.5682155 1.1146216 0.7282429 1.1164649 0.87913626 1.5235195 1.2102015 1.370712 1.1206635 1.0567433 1.7792265 0.96752256 0.81767553 0.9660352 1.0665411 1.1591581 1.3458681 1.0823036 1.5304271 Phosphatidylcholine diacyl C 36:1 21.10305 47.779438 46.458595 31.156937 40.27646 28.048449 26.308449 39.810654 32.6801 26.928204 42.10158 42.410393 34.432507 27.605232 40.239403 27.489433 23.520248 25.861437 26.305046 39.664482 23.48056 26.863922 42.609703 28.45671 29.647898 33.397846 31.009176 30.306116 37.96322 37.478436 24.34714 31.26912 27.014805 34.985195 27.6165 48.452747 21.349907 36.430454 22.226158 39.260838 35.098003 29.100859 28.247856 38.914524 27.948483 43.525406 25.554567 32.805798 29.666742 20.836864 41.407764 25.13977 32.949524 32.03153 24.830828 32.781185 22.58446 35.87509 33.547188 Phosphatidylcholine diacyl C 36:2 242.99626 393.71323 349.51346 411.92102 400.6932 258.61206 308.13333 328.66205 250.4971 271.60092 365.86203 490.44366 289.17035 262.84927 338.01154 321.30835 237.00606 272.60757 222.96577 376.96274 269.89005 305.28162 174.16745 127.29467 134.89928 151.4877 112.30651 116.20892 141.04079 145.73924 108.34485 118.34024 108.321175 157.55405 107.55994 150.43309 85.65843 131.38821 106.91558 149.39735 122.08841 124.44462 141.92854 132.74016 130.84125 150.35849 120.03969 115.35604 133.1023 94.1608 166.88126 118.609985 108.6051 103.39824 93.296906 118.92107 86.14472 146.34554 127.30652 Phosphatidylcholine diacyl C 36:3 111.583595 209.41452 203.41675 185.33429 216.51123 120.045235 156.80595 196.2874 178.21803 117.42039 178.98018 285.54636 208.62561 152.82828 171.76314 178.97841 131.958 152.2985 157.21382 187.46252 133.583 152.63411 113.00767 84.829834 90.156784 88.28971 73.33318 77.288956 102.3655 96.984795 67.09887 93.11056 85.58881 105.90311 66.19436 119.95442 55.845142 94.76075 71.957695 100.66454 90.672455 92.90255 86.88104 82.31249 83.71936 96.669785 73.29977 77.589226 87.20504 77.77053 111.32185 70.23696 74.30172 87.10561 60.964134 93.16085 76.885414 96.804924 93.36938 Phosphatidylcholine diacyl C 36:4 272.23953 255.32816 353.22247 316.29648 283.85913 337.50858 283.52924 272.87875 231.64111 188.91345 404.97675 459.8905 242.18823 165.17146 282.33795 245.93326 115.972466 210.34917 195.93811 209.04091 256.412 239.59392 159.47943 145.6286 114.90657 118.24984 112.61033 116.724556 108.388405 113.05028 98.19133 107.402504 109.20478 121.49765 107.70748 166.36908 77.530495 169.97182 93.15046 119.61486 114.12943 108.9176 110.269104 95.76602 118.44892 156.9833 140.84465 111.54473 109.33098 94.265976 163.69987 93.3603 80.58506 137.98727 95.21575 144.03758 123.04065 162.25618 126.68626 Phosphatidylcholine diacyl C 36:5 41.534847 40.1769 29.971865 23.888487 27.236279 55.87111 53.089417 48.329346 26.087708 17.654215 29.727737 27.535255 26.028162 24.935844 24.249002 25.55173 7.3939624 21.10699 18.457243 18.089075 14.352628 21.245018 18.423542 20.17571 12.505478 8.870694 13.009749 13.38793 11.339645 10.756204 14.9834795 16.86151 11.946346 24.078892 10.031254 33.18497 6.6268506 26.640995 15.154517 17.083551 29.406015 12.6563635 9.447917 9.644134 14.594592 20.118362 10.918844 13.580439 10.802447 37.20157 15.688829 6.913172 8.206415 18.064669 15.390075 26.558964 13.255803 9.369389 18.938093 Phosphatidylcholine diacyl C 36:6 0.9983353 1.3980572 1.2950735 1.1226895 1.2980498 1.1225164 1.6738561 1.7261034 0.9479113 0.600175 1.0326159 1.1406257 0.97235286 0.90097266 1.2184573 1.1586103 0.37887406 0.89615846 0.5543736 1.1824857 0.6640257 0.97061723 0.646797 0.7171665 0.72457296 0.36396548 0.52141136 0.38948864 0.46939766 0.37389264 0.56595546 0.6490939 0.5695462 0.75230926 0.24132574 1.0198994 0.24338247 0.9004869 0.500432 0.6075208 1.1318878 0.6975879 0.29433224 0.4829753 0.57459897 0.89535725 0.31206357 0.5471491 0.27481285 1.0740595 0.61016566 0.22587563 0.33699176 0.4828803 0.37846318 0.71337426 0.73307395 0.34393904 0.7262072 Phosphatidylcholine diacyl C 38:0 3.3670044 2.9736404 3.572064 4.701545 3.895279 3.1938522 3.7596097 3.3106906 2.487676 2.8665085 2.326059 2.291475 1.7543497 3.4655352 2.7763288 3.2587502 1.6512665 2.2209663 2.092706 2.5846329 2.8425016 3.104234 2.4628916 3.262494 2.2652848 2.3179078 2.287223 1.4210657 1.9165643 2.3277836 1.876906 1.9954493 1.7985976 2.3465881 1.4948401 2.164869 1.4461973 2.6397712 1.6079065 2.3583603 2.5634146 2.499023 1.4158175 1.9752457 1.4520041 2.490128 2.1655374 2.181493 1.5508353 1.9996424 2.6933796 1.7346176 1.723984 1.3757238 1.9739442 2.0578117 2.3277032 2.1000233 2.840321 Phosphatidylcholine diacyl C 38:1 1.331722 1.1387802 1.9868848 1.899546 0.65915453 1.2299489 1.6946143 1.2318274 0.95544887 1.0457871 0.695064 0.80077225 1.2801757 0.7637791 1.5947369 1.1865547 1.0260781 0.6254544 1.0683377 1.2074417 1.0512886 1.2250022 1.222777 1.0178429 0.9823938 0.92797625 1.0168804 0.73888737 1.1480132 0.93941754 0.74597836 1.0813253 0.63635224 1.4340101 0.81562215 1.2934824 0.6449416 0.9431906 0.70745873 1.10222 1.222484 0.88435984 0.6696126 0.68565845 0.5641101 1.0546662 0.8249221 0.9457712 0.74207515 0.92789996 1.1366132 0.9081091 0.8025413 0.7991721 0.6781658 0.92969805 1.1954942 1.2037686 1.3011221 Phosphatidylcholine diacyl C 38:3 24.654055 44.102406 45.505386 32.84442 46.363556 29.652517 39.003895 33.329487 34.70549 23.535418 35.03439 61.556786 35.449314 31.352646 38.65084 36.058445 24.377026 32.73641 30.344263 47.159245 27.724148 33.176006 34.312447 32.001186 24.349728 24.319181 22.90712 27.046423 41.31674 33.070957 23.576578 32.458042 30.639658 35.636524 26.160822 56.195927 22.052076 34.626564 27.51641 39.92835 32.73325 38.1531 24.454685 36.95521 34.548454 34.493385 26.2507 30.578941 28.229181 25.274084 37.458565 21.5869 27.448372 30.60786 26.104637 31.016039 39.15891 33.216717 37.245773 Phosphatidylcholine diacyl C 38:4 87.21848 86.76085 123.955765 119.87055 101.70535 116.16524 101.56801 75.37602 73.10457 72.328415 129.21378 154.42442 68.21342 64.74653 97.240776 94.80035 43.30945 77.07258 64.18489 81.589005 88.60237 88.89541 83.87963 80.654594 51.969402 63.89632 58.803925 60.539238 68.3396 75.2768 56.131226 52.002422 54.661007 72.72099 68.117546 102.61773 43.50539 95.523674 58.53474 78.49856 59.464092 60.569214 62.427814 70.09128 73.9241 101.47277 83.302025 75.51403 63.112793 47.00881 96.56801 53.491627 44.670296 74.79163 52.40431 76.71851 81.12788 87.57818 75.10878 Phosphatidylcholine diacyl C 38:5 38.8323 44.79014 48.48341 42.595196 48.581055 46.385975 42.142426 41.740395 36.67298 27.83347 46.828873 46.400322 41.7549 33.790234 38.430504 46.39661 18.728176 30.976637 30.917377 33.326557 29.316069 33.691433 43.239975 37.22467 28.996527 26.850216 29.061493 27.272139 32.807594 35.986923 30.23081 33.21895 28.428366 44.52412 29.693144 57.704906 18.252796 52.711758 38.6104 38.421112 37.95399 28.683548 28.26439 28.553055 31.232756 50.791668 38.247185 36.72265 35.87458 35.756676 41.710358 22.437258 22.558298 38.96003 28.58973 45.020695 36.20253 33.152462 40.37493 Phosphatidylcholine diacyl C 38:6 98.97676 52.22321 77.46746 112.09761 90.51968 108.285904 66.33377 67.817696 50.593437 61.674736 62.919785 74.11109 48.75135 55.26728 61.662884 53.436813 22.935616 49.399727 48.393967 57.48901 41.95255 72.46387 66.12078 59.81774 46.39759 43.519196 41.811417 35.353725 36.780685 53.527004 51.1176 47.984726 44.492043 58.855457 31.401 61.053864 29.324892 76.9791 32.657887 46.747684 67.49647 65.6839 33.32781 39.747616 39.16284 63.312927 52.252163 44.74042 39.848194 62.204174 64.91574 30.5644 28.78897 41.69703 59.00114 63.390923 63.99831 55.5705 52.902695 Phosphatidylcholine diacyl C 40:1 0.51905984 0.52005416 0.73934317 0.7149055 0.5122124 0.3447355 0.6706341 0.44296885 0.543424 0.4166871 0.4541381 0.4836001 0.40864542 0.5490083 0.45260602 0.5487344 0.42649585 0.36913738 0.3888232 0.5171244 0.40023133 0.38675216 0.3440624 0.3416835 0.36167926 0.3797814 0.37689698 0.28409806 0.4228136 0.3074207 0.31845382 0.31455156 0.33958662 0.4052043 0.29499918 0.4011464 0.30037445 0.41810772 0.3019739 0.33717862 0.33849427 0.34657425 0.29459926 0.2969891 0.28839818 0.38134608 0.38427374 0.33903182 0.27971572 0.3571065 0.39069018 0.3083751 0.37245867 0.3733618 0.32689682 0.33055392 0.365666 0.39956284 0.43359244 Phosphatidylcholine diacyl C 40:2 0.3174793 0.6774167 1.0325854 0.50875115 0.41845366 0.34388238 0.5781523 0.44535783 0.29462868 0.4937931 0.30745625 0.38917 0.28299013 0.43457037 0.5038183 0.32784122 0.32596242 0.2869591 0.25529933 0.2710342 0.27595466 0.3521515 0.29015023 0.26727504 0.30249554 0.29783472 0.2959864 0.20181714 0.36838678 0.24429405 0.22318326 0.24118608 0.22752927 0.36293048 0.2154546 0.40385726 0.17192532 0.3245666 0.19878575 0.29351893 0.21953246 0.26060396 0.27823707 0.2243944 0.2280997 0.33645374 0.30830827 0.29006183 0.25577056 0.2808633 0.30064312 0.23737743 0.22642477 0.272477 0.20106237 0.25589666 0.23056269 0.3131032 0.3537891 Phosphatidylcholine diacyl C 40:3 0.56556606 0.69460124 1.0032337 0.76369464 0.68402195 0.6253096 0.89502805 0.5633223 0.55192655 0.5792205 0.49756616 0.6209819 0.42067257 0.5797737 0.54811794 0.5145685 0.33367354 0.44865322 0.37280887 0.50077355 0.3532001 0.43859679 0.5427169 0.45794937 0.39196882 0.38478115 0.41729614 0.35355124 0.6432863 0.46267322 0.37589565 0.5169954 0.41627485 0.5872516 0.40157965 0.6540566 0.32892293 0.5154885 0.38371107 0.48909968 0.43725994 0.4102047 0.4018504 0.35310978 0.41014412 0.5161515 0.49233258 0.48980907 0.46760866 0.5103356 0.5139643 0.3573112 0.3775918 0.4797491 0.3176374 0.42688695 0.44444978 0.43751854 0.5492805 Phosphatidylcholine diacyl C 40:4 2.166255 3.9799578 3.8857586 3.0464664 3.4710236 2.9782364 3.5204034 3.0492413 2.8772511 2.5056453 3.6959293 4.8665266 3.3109508 1.9847902 3.8767152 3.8926964 1.7477474 3.0780933 2.651454 3.1385033 3.0586097 2.741608 2.868373 2.8375788 1.9774728 1.9863527 2.125514 1.9619199 3.3402536 3.019599 1.8996048 3.186342 2.5174005 2.4626684 2.092446 5.236627 1.4954951 3.020216 2.1836314 2.9742532 2.3702059 2.1145952 2.4117084 2.423795 2.650985 3.5878754 2.5695255 2.8232253 2.858386 1.6582186 2.7904267 2.320968 2.175004 3.0623708 1.820178 2.338938 3.0369742 2.798892 2.994206 Phosphatidylcholine diacyl C 40:5 9.045397 11.934911 11.210203 11.229432 12.398156 10.722235 7.977723 8.798716 8.555998 7.735367 9.992871 14.362682 10.473781 7.914079 11.121182 11.107866 4.7288365 7.8525286 6.904273 9.84079 7.3508773 7.6985536 8.470067 7.4233875 5.6570992 5.2280493 5.1584897 5.570133 8.06239 8.785119 6.683408 9.270735 7.3154645 8.4605255 6.3340077 18.236336 4.057514 10.098007 8.63695 8.518336 7.847632 7.3586974 6.2148952 6.258367 7.1100864 11.116214 7.3766594 8.188269 7.6389427 5.1078706 8.229671 5.2129383 5.5683203 8.016735 7.3657575 7.8712544 9.182351 7.233916 9.078757 Phosphatidylcholine diacyl C 40:6 25.758959 17.689207 21.223377 32.47196 26.90253 29.696821 19.173496 17.824036 12.367941 18.508427 17.287003 23.573221 13.425379 15.799059 20.363314 16.062458 6.9751406 16.251804 13.158242 20.027933 13.507189 20.605242 19.225735 16.309923 12.333913 12.640137 11.001772 10.8540945 12.672288 18.491829 16.129385 15.524539 15.68529 17.730032 9.729188 25.085762 9.241173 21.360895 10.840069 17.366024 19.311852 22.084446 10.2151985 14.832336 14.62737 21.994358 15.3763685 15.234721 10.869007 13.866107 20.329506 9.073854 10.001332 11.970412 19.712776 15.912034 22.32128 16.5578 18.98147 Phosphatidylcholine diacyl C 42:0 0.22746435 0.17148781 0.18024339 0.31714645 0.2728432 0.24023108 0.2777484 0.27080682 0.28578964 0.16286384 0.20882498 0.21330035 0.1754487 0.3006909 0.16807367 0.2296273 0.16151905 0.16677436 0.2234626 0.16878922 0.23701516 0.23857868 0.44806334 0.45757523 0.47972295 0.49148467 0.44772643 0.30852494 0.5415048 0.3256871 0.32582146 0.37418202 0.42465764 0.5829322 0.38594732 0.40351662 0.36232105 0.6982994 0.3129105 0.43824688 0.48010713 0.54950005 0.33886838 0.32555103 0.30481473 0.42796192 0.5430972 0.42178035 0.3693037 0.40494406 0.5060622 0.34975088 0.52352244 0.43299124 0.49434453 0.5038488 0.5181851 0.4923958 0.62970954 Phosphatidylcholine diacyl C 42:1 0.124741055 0.13945338 0.14932688 0.19078025 0.16497412 0.14907204 0.16313198 0.11683684 0.17701489 0.06848652 0.16121359 0.08062711 0.115801856 0.12133181 0.104911745 0.12239052 0.09135195 0.086773664 0.1426493 0.08617779 0.12270908 0.08478003 0.24864273 0.24247226 0.27549034 0.2528523 0.25339174 0.14599466 0.2970378 0.20015484 0.19342051 0.21351421 0.22091429 0.26625383 0.18765004 0.26597682 0.18105151 0.39109075 0.1886033 0.21872783 0.23374408 0.23938452 0.19788787 0.18054634 0.17540088 0.25968564 0.27001968 0.22180544 0.1980311 0.20865005 0.273597 0.1579654 0.2604667 0.23723759 0.22590184 0.24389152 0.25468126 0.25055772 0.33331278 Phosphatidylcholine diacyl C 42:2 0.15558267 0.12777948 0.16957584 0.19266447 0.1381781 0.1363694 0.113917455 0.09959746 0.074357554 0.10683018 0.051551115 0.09825499 0.068363085 0.109249815 0.13266146 0.09221312 0.078506626 0.117017716 0.07811658 0.10013797 0.10739068 0.088836245 0.2172055 0.2289157 0.24578732 0.19389054 0.19824757 0.16017535 0.2452921 0.20449065 0.16020595 0.19935255 0.17806295 0.26957256 0.16424946 0.23481677 0.1414579 0.30018368 0.1600126 0.18389346 0.1773572 0.21712369 0.19268528 0.16665894 0.19442993 0.21038061 0.20994343 0.20776474 0.19841745 0.1989205 0.22206093 0.18763545 0.20225893 0.18887763 0.15178846 0.22591785 0.1694491 0.20123717 0.24723768 Phosphatidylcholine diacyl C 42:4 0.060436975 0.07580901 0.12689212 0.027448863 0.058069054 0.033597846 0.04487681 0.029934652 0.051924076 0.026909843 0.11194279 0.015245562 0.044819035 0.05872993 0.06487248 0.048428588 0.036047623 0.03532685 0.03307828 0.03619142 0.029409047 0.04968177 0.15723197 0.16326219 0.14774014 0.14123708 0.13672125 0.11441497 0.19639175 0.14238025 0.1156996 0.15197591 0.14061481 0.15070654 0.11986192 0.21817121 0.08762928 0.18912885 0.12947498 0.1501654 0.107843384 0.13488 0.14621033 0.13702042 0.13504489 0.1764761 0.1522444 0.17421605 0.13395174 0.10121462 0.16503376 0.12645738 0.13704877 0.124142595 0.09861531 0.14826156 0.14299935 0.17719759 0.18552883 Phosphatidylcholine diacyl C 42:5 0.17979127 0.44478026 0.47806466 0.36737087 0.48815653 0.4201125 0.45004436 0.47897187 0.26848885 0.3501618 0.30739346 0.42771277 0.37445715 0.30462685 0.26584384 0.35936764 0.21997356 0.2871571 0.20782618 0.36413753 0.26397297 0.24183948 0.27702954 0.33258927 0.22245973 0.18599038 0.24421583 0.17361397 0.32402235 0.31903872 0.24306355 0.34525877 0.2555459 0.3250938 0.20045713 0.45895147 0.17396572 0.3766261 0.21020629 0.30077422 0.27158222 0.24134949 0.21696256 0.17713347 0.19274378 0.37805352 0.26757658 0.26959193 0.23746702 0.31237015 0.35175076 0.2019943 0.21338166 0.25513536 0.26571104 0.25729477 0.2791269 0.26508042 0.3334173 Phosphatidylcholine diacyl C 42:6 0.5948886 0.83208215 0.92959183 0.92631286 0.7306312 0.7890282 0.86133033 0.69765013 0.6799976 0.6122672 0.5585579 0.76947457 0.6883778 0.6585821 0.7298075 0.7327538 0.57482356 0.70127976 0.5210514 0.7193312 0.51853734 0.63780624 0.41656646 0.3691693 0.33832324 0.29486322 0.31543592 0.26154897 0.45832825 0.417836 0.30401808 0.4601258 0.3889659 0.43371373 0.24148713 0.7473967 0.25002536 0.43050423 0.34783524 0.3845269 0.4092623 0.33698133 0.27858615 0.29508057 0.2772436 0.48912057 0.342221 0.39557144 0.2844482 0.40241438 0.4305639 0.27971485 0.28018376 0.38405198 0.339496 0.38689575 0.4577098 0.27059352 0.5196363 Phosphatidylcholine acyl-alkyl C 30:0 0.14723453 0.30159965 0.24256448 0.20187613 0.22544564 0.156759 0.24215868 0.27016574 0.27501097 0.119842194 0.14709212 0.20706514 0.22689502 0.13267502 0.18263528 0.1754868 0.18395618 0.18411823 0.1569206 0.1890223 0.12743038 0.18869475 0.33050892 0.23653932 0.4646708 0.23549725 0.3238374 0.22364013 0.49005502 0.20231633 0.30086848 0.45932674 0.34386137 0.38861695 0.18863072 0.35511032 0.19296336 0.3077694 0.2258545 0.32028303 0.39322847 0.2721095 0.21891548 0.25534952 0.28617314 0.2258207 0.22192252 0.28954092 0.22530286 0.23021916 0.27853957 0.22628422 0.30481184 0.3137473 0.22448894 0.27998152 0.24431036 0.2674687 0.41471502 Phosphatidylcholine acyl-alkyl C 30:1 0.14415921 0.3688566 0.27086353 0.22771938 0.1410295 0.24691458 0.29786116 0.24012747 0.3634221 0.11042735 0.18888402 0.16596952 0.10686314 0.15204874 0.169239 0.27215236 0.0968631 0.081814244 0.16315141 0.13876992 0.061006214 0.08980957 0.18627177 0.20353898 0.26639697 0.2566214 0.22158939 0.13544324 0.34988827 0.14284594 0.176621 0.3102897 0.18181632 0.18640801 0.14017951 0.337199 0.13166784 0.22782788 0.12775536 0.1736134 0.2320142 0.17872424 0.119394325 0.115536585 0.1334409 0.16783717 0.20697038 0.22527003 0.14913738 0.11328995 0.2004685 0.16198966 0.2674836 0.43459308 0.1496639 0.10701587 0.16838136 0.2356019 0.33484986 Phosphatidylcholine acyl-alkyl C 30:2 0.08794988 0.12321902 0.17292982 0.10885178 0.08575464 0.110752486 0.09929438 0.075828046 0.09499683 0.06047168 0.0640219 0.08794738 0.057052 0.055247582 0.0805962 0.07811675 0.055116225 0.064065784 0.06819079 0.080389395 0.06012664 0.06899942 0.092554025 0.077743486 0.101370305 0.089019656 0.08427925 0.064963885 0.118952535 0.07980571 0.08057206 0.08600222 0.09346447 0.0972835 0.07549296 0.13440146 0.06921704 0.1049883 0.06513852 0.07632131 0.09520105 0.06636421 0.07460646 0.07186516 0.06731363 0.10642294 0.11143005 0.08105541 0.08169698 0.074710496 0.09821582 0.0716484 0.08124728 0.12668025 0.07414696 0.10306576 0.07803515 0.10527237 0.11999747 Phosphatidylcholine acyl-alkyl C 32:1 2.8697052 5.533098 4.7840214 5.262395 3.8842902 4.2928596 4.4124546 2.768575 4.3676844 2.2923968 3.9296863 3.4608486 3.2630346 2.7025793 3.3700252 3.4739401 2.5992885 2.4100585 2.5426018 3.1558092 2.7595284 3.7555146 2.0653768 1.8590922 1.7608042 2.003866 1.9757614 1.1650347 2.225992 1.5459177 1.3263965 2.5992043 1.7637275 1.8636763 1.6222789 1.9614061 1.281478 2.5728478 1.073918 1.9422107 1.9811138 1.6089082 1.5731298 1.6395869 1.5253111 1.5816045 1.6004946 1.8709949 1.8398857 1.1211603 2.4549592 1.5442276 1.6261476 1.9518602 1.3727888 1.6377375 1.5607163 2.482104 2.3549821 Phosphatidylcholine acyl-alkyl C 32:2 1.0585723 1.3990215 1.3498236 1.8160411 0.9918117 1.2590384 1.2335633 0.91505164 1.112389 0.7165439 0.85574853 0.6917151 0.8345993 0.80025494 0.93788564 0.8545082 0.63519 0.69653404 0.6195453 1.0180694 0.70216984 0.9244522 0.52579415 0.39229253 0.40224984 0.4992763 0.5248202 0.29140672 0.52609485 0.39620063 0.33731806 0.53706175 0.3458637 0.4072679 0.37534863 0.45805246 0.27736846 0.5944324 0.24717122 0.4419025 0.388612 0.3562484 0.34944618 0.35265183 0.30031946 0.44283396 0.4012603 0.3744792 0.39233905 0.28255424 0.54675907 0.3544504 0.3164463 0.5137041 0.3173304 0.44269815 0.33085474 0.52758455 0.5176889 Phosphatidylcholine acyl-alkyl C 34:0 1.2355311 1.9622625 2.1433823 2.1322725 1.8154408 1.4287153 1.723233 2.129836 2.0952663 0.997551 1.7211465 1.7060384 1.6017427 0.98637855 1.2096028 1.3884579 0.95973134 1.3211814 1.3133384 2.0975232 0.740352 1.4556179 1.1992221 0.7553302 1.0883274 0.71615547 0.9217105 0.6171879 1.0758064 0.6365341 0.7544726 1.2641348 0.9528371 1.1491061 0.5986979 1.1354287 0.56633174 1.1622615 0.60685855 0.9632717 0.9383382 0.8140066 0.6412345 0.73223245 0.97016865 0.9686029 0.6919663 0.81865424 0.65421325 0.6559602 1.1701311 0.72879064 0.8144069 0.83143634 0.61081254 0.83791554 0.80247474 0.8267246 1.2519441 Phosphatidylcholine acyl-alkyl C 34:1 7.0958533 12.889941 13.196727 9.369277 11.323288 8.399565 8.450336 10.652291 11.9358 6.6161213 10.03606 10.17738 9.627929 7.0708675 8.511397 8.914228 7.283935 7.270348 8.0724535 11.350421 6.1179056 8.032812 7.3260036 5.186514 6.300312 5.4403434 6.207654 4.277502 7.0733438 5.484584 4.555307 8.2467785 6.9371424 6.807449 4.666624 7.2742887 4.0666003 7.0220833 4.3958807 7.7896185 7.013437 5.318955 5.0106807 5.753885 4.9642076 6.492769 5.0443196 6.5560036 5.0713496 4.3911037 8.860411 5.27195 6.164883 5.889986 4.4666243 6.665247 5.1763535 6.6213264 7.9595485 Phosphatidylcholine acyl-alkyl C 34:2 9.624272 13.452876 14.969862 15.335648 15.877335 11.095429 16.462095 15.668604 10.70746 8.629717 11.526227 12.627509 11.820549 10.153285 13.038493 15.5526085 8.292248 8.569967 8.475375 12.424361 10.851607 11.506247 9.375423 7.8601446 7.339686 9.350499 7.325415 5.087781 6.727815 6.697945 5.2869954 7.505554 5.154617 7.3035936 5.8459015 7.1268373 3.8836226 6.864628 5.687899 8.8084955 7.4890394 6.7136865 6.0103984 5.7018986 6.0682597 6.116829 5.491784 5.813011 6.0418224 4.4514785 9.002688 6.768753 5.1548047 4.7975016 4.066682 6.6631727 4.330604 6.281103 8.331298 Phosphatidylcholine acyl-alkyl C 34:3 8.672972 15.353195 18.232794 15.573712 11.533265 13.024863 16.465956 9.6609535 9.113261 7.652689 11.337809 9.585757 8.431447 7.1968317 11.800699 12.879098 5.2052274 8.21353 6.9281325 8.805466 10.3673315 11.10453 7.6154904 5.656413 4.682349 8.843436 7.2322855 4.4348903 5.1326327 4.7949724 3.6850052 5.838054 3.146888 4.8497205 4.8599653 5.8376727 2.9424524 6.2648115 4.331318 5.632784 5.1875467 4.3603024 5.986307 5.211282 5.619922 6.567669 4.91899 4.626675 6.069416 2.7398758 7.852228 7.2886844 3.7851315 4.7447777 3.983009 5.4982796 4.218264 5.4212356 7.2834435 Phosphatidylcholine acyl-alkyl C 36:0 1.117388 1.5268013 1.9603428 1.7651017 0.99474275 1.1107186 1.2838141 1.5421946 1.329939 0.8783974 1.0245833 1.329336 1.0673976 0.7003285 1.1682832 0.98986214 0.7813238 1.08912 0.8198117 1.0332043 0.75105864 1.0857329 0.9158918 0.61955047 0.619384 0.6516898 0.7413521 0.52058357 0.7193474 0.623255 0.5809205 0.6989018 0.5703315 0.6677004 0.5401151 0.7138559 0.48466003 0.98393184 0.4078693 0.67699367 0.64709836 0.57131654 0.5631162 0.56647736 0.46673086 0.80500096 0.61340946 0.730392 0.7115132 0.4979382 0.8832054 0.570455 0.5831982 0.8019089 0.5686043 0.7028141 0.55464864 0.8011116 0.8313644 Phosphatidylcholine acyl-alkyl C 36:1 5.5961795 10.533393 12.103741 7.6564226 8.492303 6.57774 6.308276 7.9067984 8.1920805 4.5844145 6.9014006 7.9634066 6.7393584 5.241974 6.6513467 6.2634273 4.97533 5.440806 5.790157 9.0853195 3.4579544 6.080332 5.337479 3.4903755 4.6799116 3.9476974 4.246839 3.3325984 4.6980033 4.2689075 3.841797 5.608703 4.3965507 5.0698457 3.3280694 5.771519 3.1243792 5.631092 2.8740902 4.845121 4.482694 3.6019754 3.2820005 4.221607 3.2990358 6.018777 3.9270017 4.666558 3.708422 3.2323313 6.2113166 3.5856657 3.8435938 4.33248 3.2568038 5.298473 3.664181 4.5802693 4.935853 Phosphatidylcholine acyl-alkyl C 36:2 10.918339 15.791161 18.558859 17.22975 17.249117 11.816394 14.900477 16.269049 14.296556 9.275411 12.408995 17.839884 12.77263 11.506574 12.416402 14.674102 10.909103 11.135832 10.721794 18.585037 8.421089 14.675726 10.933116 6.977125 10.803443 10.5354395 8.4309225 6.1991606 9.095635 8.883726 7.676167 9.127144 8.389894 11.525885 6.018967 9.2078085 5.507502 9.47102 6.799573 11.007459 8.457859 7.680005 8.651632 7.9256973 7.906563 10.644542 7.4500823 7.7832403 7.607305 6.8779817 12.178126 8.221401 6.719781 6.2126274 5.455319 8.271676 6.130406 9.48571 10.09051 Phosphatidylcholine acyl-alkyl C 36:3 5.413005 10.130779 10.5690975 8.8592825 10.089848 6.268747 9.990584 9.132194 7.8265758 5.704466 7.7249103 7.194282 7.9503493 6.9185143 8.417856 10.114567 5.6915293 6.0971785 5.8564324 8.650974 7.575766 7.1533318 6.9684696 6.2278714 5.0469494 6.8161187 5.2551446 4.0022044 5.74111 5.284775 3.6840904 5.88485 4.024284 5.2599287 4.564073 6.3398075 3.3133733 5.09023 4.5519547 7.1375546 5.515423 5.425752 4.6956043 4.9601617 4.2884493 5.151535 4.114893 4.4507074 4.8648405 3.6272228 6.7285266 5.3945274 4.552598 3.9786227 3.2150395 4.694154 3.8405695 5.0719976 6.8047876 Phosphatidylcholine acyl-alkyl C 36:4 13.760806 19.321424 25.72448 18.229021 21.857306 18.043785 26.588993 18.023666 17.015682 14.45849 20.475168 18.780418 15.729312 13.613021 16.698334 25.018772 9.633545 11.817922 14.304338 15.975814 17.503613 19.686432 13.315478 18.757973 10.635351 13.103788 12.794513 9.972764 11.62835 9.727812 7.999307 10.362172 8.555905 9.456591 10.648354 13.86893 7.1021867 14.333517 9.917603 12.711642 11.737933 9.759024 9.947872 10.278659 8.766727 11.439123 11.705129 12.663519 10.0904875 7.749683 14.667765 10.604021 7.7246194 9.449469 7.234832 9.5972395 11.281704 14.436678 14.292846 Phosphatidylcholine acyl-alkyl C 36:5 10.979256 16.601503 23.845755 18.28172 15.528148 18.374985 24.723343 10.660041 12.045923 10.174924 15.709343 15.630404 10.792822 10.3186455 13.901687 15.122951 5.069625 9.119023 8.644004 9.3695755 13.913978 15.77121 9.984633 11.052866 6.249856 10.430853 10.6769705 7.2185693 6.9400954 7.1768994 5.910177 7.969639 4.8814764 7.197652 7.660198 9.8635025 5.201298 12.152285 5.594453 7.4379168 8.601824 6.13072 6.8864946 8.662011 6.650999 11.086024 8.907915 9.425091 8.85865 5.8799157 12.295365 7.979775 4.781423 8.204758 5.2525806 7.264031 8.177528 11.477383 10.81553 Phosphatidylcholine acyl-alkyl C 38:0 1.7961441 1.8546777 1.9981036 2.311401 1.8961538 2.4641058 2.0898504 2.1595125 1.3773551 1.234562 1.5385195 1.291116 1.3978593 1.4526986 1.5134044 1.8310571 0.8412306 1.5213042 1.1642084 1.5241196 0.8652164 1.5659597 1.8167593 2.041233 1.4607317 1.1331879 1.4322426 1.098455 1.2865628 1.3779578 1.375553 1.5262908 1.2851169 1.8657874 0.84308964 1.8668945 0.7141703 2.0997734 1.1134923 1.6520404 2.0996644 1.5739392 1.0365878 1.1942732 1.1646394 2.023361 1.2612361 1.3114867 1.0252182 2.5927947 1.5511276 0.7975296 0.8475902 1.3715507 1.1732707 1.8355855 1.6297898 1.0603138 1.5886401 Phosphatidylcholine acyl-alkyl C 38:1 0.6249504 0.39348644 0.16243634 0.36232653 0.3738526 0.25335726 0.18226247 0.47485957 0.4378625 0.31688306 0.18077774 0.2646543 0.40320724 0.19510593 0.52493 0.14699568 0.38511914 0.24544649 0.34079605 0.20741868 0.22990598 0.19878528 0.34540164 0.5235738 0.19941218 0.2678202 0.26372868 0.24695788 0.3966467 0.36814275 0.4114625 0.31660792 0.223566 0.21854204 0.050121363 0.2951222 0.31784552 Phosphatidylcholine acyl-alkyl C 38:2 1.0921619 3.4008706 3.6402686 2.473453 1.9919813 1.3381068 2.078477 2.350542 1.7183143 1.3336511 1.7870873 2.5195124 1.5569037 1.5654203 2.040654 1.8464657 1.9384193 1.804122 1.2736768 2.3228683 1.1615182 1.9736792 2.038534 1.2193353 1.6929953 1.4819677 1.2557456 0.93873125 1.7680373 1.3257374 0.99509627 1.575044 1.534104 1.9356489 0.92328286 1.7485342 0.895804 1.3126876 1.0041269 1.475136 1.2650731 1.187684 1.3411779 1.0988616 1.3669958 1.6273398 1.1711042 1.2006817 1.0886964 1.0759075 1.6297467 1.2198508 1.1406652 1.190994 0.80836284 1.1139624 0.9898741 1.2782342 1.4676939 Phosphatidylcholine acyl-alkyl C 38:3 2.9716833 6.4332905 8.429895 3.9226277 4.003234 2.8289163 3.6870775 3.3861964 4.631568 2.1481013 2.887668 3.6707385 3.455512 3.2920275 2.9924874 3.805007 2.721798 2.828876 3.2431047 4.6632404 2.13852 3.5596378 2.799916 2.4523911 2.5595112 2.2733908 2.19677 1.9208419 3.2440562 2.2531755 2.0294502 2.8611932 2.4751194 2.9902494 1.9839444 3.5749674 1.8156264 2.8106773 1.9694272 2.924712 2.5717416 2.5392036 2.0183768 2.4872432 2.329807 2.788584 2.1433737 2.2271864 2.0442204 2.2046363 3.1945524 2.0198214 2.1666155 2.2499697 1.7208737 2.3550837 2.7231941 2.649509 3.2064571 Phosphatidylcholine acyl-alkyl C 38:4 8.731941 12.855914 18.191109 12.009043 12.096919 11.073765 13.8993635 11.086653 13.808274 8.384022 13.1638 13.518602 9.197694 8.909663 9.211892 13.44626 7.7236404 9.112581 10.041656 11.800124 10.369527 12.814739 8.720705 10.403759 8.311655 8.465939 8.351804 6.661488 8.835815 6.9863524 6.4665117 7.576461 6.3679943 8.489962 7.530171 9.942659 5.7559934 10.972878 7.306344 9.2143545 7.4502454 6.9041452 7.043883 8.431249 6.9099574 9.47635 8.614827 8.338558 7.0166206 5.8994856 10.435088 7.2485847 6.535405 7.1504536 5.6632223 7.3981795 9.458794 10.123417 9.976854 Phosphatidylcholine acyl-alkyl C 38:5 14.576476 19.880161 26.5989 19.08845 22.073217 16.748674 21.835888 17.4088 18.522118 15.311768 18.915016 19.28266 14.938106 16.42128 17.530949 24.326986 11.673371 12.646419 14.035471 14.991399 17.911411 17.83366 14.573126 18.023909 12.989482 14.179325 13.928221 10.461855 12.960995 12.666429 9.506066 11.116321 10.250665 13.116946 12.604631 15.242289 8.21888 16.751959 11.805247 16.06653 12.895934 11.558091 11.17126 12.734251 9.836414 15.287215 14.697646 14.864204 11.866766 9.910675 16.268143 11.865772 10.538617 10.415156 8.567537 12.022007 12.978637 16.63386 16.502398 Phosphatidylcholine acyl-alkyl C 38:6 6.936714 7.3490825 9.355947 9.550897 8.827129 8.515037 10.115695 6.827632 5.5862565 6.009536 6.413219 6.14696 5.128354 7.2571526 6.6589084 8.059617 2.875912 4.3875284 4.631449 5.777296 6.127826 7.8005 5.64667 7.4032316 4.2571783 5.051953 5.3947573 3.5890484 3.831863 4.6347547 3.736541 4.5473413 3.2247396 4.695485 3.8093278 5.36485 2.8882987 6.5680923 3.357465 4.9510245 5.901106 4.5810637 3.2272737 4.2289133 3.4182494 5.7243686 4.895473 4.9357543 3.9888134 4.5457516 6.323997 3.9989958 2.968347 3.712438 3.5156991 4.5621986 4.709481 5.0091186 6.2842803 Phosphatidylcholine acyl-alkyl C 40:0 4.851389 4.071639 5.9803576 7.5411444 7.11763 5.3622847 4.50852 4.9506974 4.2743382 4.543244 4.8094416 4.7608576 4.430939 5.057115 4.4539657 5.737485 3.0313392 4.402036 4.472697 5.2212563 3.3290856 5.0153313 5.7991586 4.4378943 3.8872483 3.7955475 3.5935407 3.143948 4.336462 5.758607 4.412064 3.9543102 4.602883 5.427336 2.7403834 4.111859 2.46069 5.0624976 3.4680924 4.6627555 3.794909 4.735283 3.1878633 3.73982 3.4701612 5.531009 4.4890623 4.4205933 3.9073262 4.66088 5.4643416 2.8615258 3.0583615 3.6053147 3.4491682 4.8510327 5.0259395 3.4066086 4.7039576 Phosphatidylcholine acyl-alkyl C 40:1 1.0739121 1.2405385 1.2919922 1.7958555 1.2740054 1.3328166 1.1930974 1.3661778 0.9692505 1.0209962 1.4438618 1.132333 1.0624496 0.9658666 1.0361471 1.3104361 0.70446974 0.97293323 0.8293212 1.201466 1.0750177 1.1548054 1.5932535 1.4917705 1.412068 1.1251888 1.3162289 1.0849526 1.1819346 1.1695952 1.1827465 1.0993272 1.0977663 1.4189088 0.83266914 1.4920568 0.6970975 1.5974491 0.8308716 1.2421141 1.0582732 1.364325 0.9493023 0.9116655 1.0464536 1.5768503 1.3753817 1.0457591 0.96513414 1.1527516 1.3450248 0.7585181 0.83367115 1.50117 0.9350442 1.317967 1.1204879 1.2934163 1.3456045 Phosphatidylcholine acyl-alkyl C 40:2 0.868248 1.637794 2.3844564 1.5630136 1.3696893 1.2538105 1.2658459 1.332278 1.2770325 0.63830477 1.1136013 0.90848887 0.94943875 1.168427 0.92115647 1.16293 0.761125 0.92329854 0.92984045 1.1907752 0.5409635 1.2666149 1.6147634 1.1776807 1.260696 0.9482771 1.2178046 0.9721055 1.344807 0.96693873 1.1191022 1.2820519 0.9739769 1.2710087 0.89873344 1.1318496 0.8654375 1.3827277 0.75093955 1.1721969 1.221447 1.0440353 0.94160485 0.84958774 0.9215191 1.4516828 1.3376595 1.0074244 1.0172014 1.2799181 1.4577111 0.87842286 0.76805586 1.2222618 0.9957705 1.3786609 1.3010405 1.110522 1.1131754 Phosphatidylcholine acyl-alkyl C 40:3 0.66485643 1.8021598 2.1032858 0.99136955 0.6093359 0.6220277 0.7014017 0.79124856 0.84362775 0.51891077 0.6282196 0.62060803 0.5368234 0.63462055 0.6732161 0.79884124 0.4933995 0.61211824 0.68175155 0.77717394 0.4282335 0.6350763 0.8041569 0.65985644 0.7584391 0.7252872 0.6252433 0.5448617 0.9935357 0.6363094 0.53751415 0.76280504 0.6386262 0.8661931 0.6531312 0.93985295 0.59384644 0.81123847 0.50207585 0.7971108 0.6243874 0.7007623 0.62015903 0.5965138 0.61710954 0.7679822 0.78615606 0.62539834 0.6444567 0.54417086 0.82685125 0.6032413 0.70634973 0.711418 0.5570143 0.72088397 0.7029169 0.7760461 0.8720393 Phosphatidylcholine acyl-alkyl C 40:4 1.8242453 3.3660772 4.0215597 2.8748128 2.117509 1.8661826 2.5022972 2.0773368 2.970511 1.7405683 2.059093 2.257293 1.8503767 1.6459631 1.8136212 2.5739498 1.9066839 1.7379576 2.2942083 2.158496 1.9849561 2.393864 1.9223359 2.1253946 1.8843377 1.8774883 1.7291192 1.4620223 2.2907197 1.4759678 1.3981415 1.5533631 1.5079799 2.0425205 1.6906319 2.0315075 1.357623 2.4734302 1.687577 1.9308938 1.6034102 1.6203587 1.6561599 1.7077084 1.5464488 2.0696034 2.0620081 1.8030869 1.6209486 1.3096819 1.963998 1.7330823 1.7941865 1.6569604 1.3616844 1.7524368 2.1708539 2.218743 2.3240066 Phosphatidylcholine acyl-alkyl C 40:5 3.5042007 5.2169533 6.2280717 4.958754 3.9774566 3.3783748 3.9251444 3.6385489 4.324236 2.6392975 3.0663056 3.4061203 2.8944025 3.5805514 2.9565134 4.011206 3.0082016 2.4270122 3.2077296 3.4436572 3.1878455 3.270498 2.5548081 2.9345 2.9934194 2.6101449 2.606329 1.9617776 3.0170066 2.4149451 2.054586 2.2530131 2.2455108 3.0238502 2.2977805 2.9971817 1.8446761 3.6565998 2.3167636 2.880277 2.5956676 2.4462624 2.1827931 2.3861642 2.0209725 3.2162676 3.0785396 2.630985 2.304291 2.2398157 3.0643785 2.4253097 2.3935294 2.286192 2.0397263 2.6043344 2.88554 3.1419063 3.358467 Phosphatidylcholine acyl-alkyl C 40:6 4.465991 4.1003475 5.2713137 6.158769 5.2395043 4.9569855 5.043364 4.696503 4.4447575 3.1642559 3.7266135 3.7143323 3.1816344 4.6029577 3.638759 4.737897 2.5364385 2.912334 3.7033403 4.5667925 3.8767624 5.0085335 3.1109746 3.4157698 3.284471 2.9454064 2.9145474 2.0416694 2.7945032 2.8137157 2.8751698 2.8082452 2.6509473 3.750084 2.1681907 3.2394958 1.9222068 4.150402 2.547046 3.127674 3.4168909 3.1553597 2.1502788 2.7238019 2.2517529 3.7137096 3.0320404 2.9804506 2.3144183 2.952075 3.7983453 2.348979 2.4712455 2.0979526 2.730109 2.8824635 3.8062015 2.9590018 3.8052702 Phosphatidylcholine acyl-alkyl C 42:0 0.59403485 0.5444526 0.73163193 0.8074095 0.5771565 0.5536794 0.54854846 0.53543925 0.608782 0.5266328 0.60672355 0.488032 0.5616105 0.66729856 0.47723582 0.67869574 0.52123773 0.56867903 0.47729763 0.6139209 0.4704999 0.50570196 0.5591431 0.5468002 0.46943077 0.49099338 0.48421165 0.45050094 0.6437953 0.59949476 0.5247455 0.5249089 0.56537247 0.60195714 0.44276416 0.54575294 0.40192097 0.5786023 0.47128752 0.5525491 0.466689 0.5224809 0.44045758 0.45153427 0.48362467 0.5915644 0.54883516 0.5629405 0.4647542 0.50953436 0.5925135 0.4377561 0.4860221 0.5301675 0.48586184 0.5161554 0.5954037 0.4944357 0.6113467 Phosphatidylcholine acyl-alkyl C 42:1 0.28642824 0.4717808 0.6297369 0.61945486 0.49413955 0.30112264 0.48455575 0.2848861 0.37126034 0.29666018 0.38009664 0.29535428 0.3232617 0.2857783 0.43211693 0.45134577 0.21652596 0.31730667 0.28448987 0.35941193 0.27660784 0.31509897 0.43345594 0.3724496 0.29279366 0.3434521 0.34339046 0.27908984 0.5102953 0.40867618 0.2905602 0.33646595 0.3873059 0.39228582 0.30643263 0.58460593 0.23538081 0.45795804 0.32646564 0.35626024 0.27785966 0.30159062 0.32123092 0.29658404 0.35506403 0.5058394 0.45530856 0.39114404 0.34707305 0.25848526 0.38005543 0.28954044 0.30736074 0.52757096 0.2793358 0.36841387 0.38206083 0.35616115 0.4537806 Phosphatidylcholine acyl-alkyl C 42:2 0.28254187 0.4512413 0.6568215 0.69258934 0.44800854 0.46209762 0.47611925 0.48726326 0.4135281 0.3217799 0.4048688 0.3562256 0.44693264 0.36280763 0.4704519 0.42700136 0.34543866 0.3220495 0.42001688 0.3657307 0.390632 0.43523496 0.65932554 0.5187466 0.46693942 0.4816109 0.4738046 0.42306212 0.61385655 0.46348706 0.44589865 0.50791264 0.4212766 0.5521896 0.40064725 0.6539708 0.3276803 0.69025445 0.40874526 0.52697134 0.48135448 0.4838103 0.39293987 0.43772113 0.3706034 0.61019737 0.5307628 0.45991832 0.49982646 0.43508792 0.5964123 0.38519588 0.44562465 0.56181633 0.4091964 0.628432 0.4799058 0.44014698 0.5444372 Phosphatidylcholine acyl-alkyl C 42:3 0.5422513 0.7470027 0.8736009 0.8812342 0.6289804 0.65407723 0.6813804 0.60003626 0.5630177 0.48446754 0.55604285 0.4974389 0.62496805 0.5408556 0.6187382 0.5620357 0.60345966 0.43485588 0.47271642 0.49718043 0.42432058 0.61164284 0.8113288 0.7057952 0.64171547 0.6579336 0.59259236 0.5008531 0.7546473 0.64778733 0.56023806 0.53785676 0.5137736 0.7767482 0.52073926 0.67367554 0.4669183 0.77476996 0.47606888 0.7023443 0.5947763 0.7619844 0.61577266 0.5327715 0.49288836 0.72089726 0.7222001 0.55585206 0.56236917 0.5964299 0.728897 0.50734144 0.60769457 0.55023116 0.58996195 0.80976206 0.60020435 0.6601628 0.6959898 Phosphatidylcholine acyl-alkyl C 42:4 0.58443815 0.8131198 0.8518642 0.75533277 0.56388503 0.61928886 0.82314605 0.731709 0.99214524 0.5717811 0.75763977 0.6147349 0.5528672 0.55762774 0.5954693 0.87827915 0.64827347 0.527085 0.65875083 0.8295257 0.70144176 0.9052169 0.7704863 0.7924438 0.8074036 0.78689235 0.6746 0.6043181 1.0281584 0.5403786 0.5235033 0.53273576 0.57812786 0.8560959 0.747058 0.74047446 0.6237918 1.1254337 0.7160554 0.82643086 0.69318455 0.79592526 0.71713436 0.75120586 0.5811801 0.68905413 0.84886307 0.68378615 0.6818557 0.5237853 0.7744132 0.80280054 0.85911036 0.62364036 0.61640054 0.79115295 0.7678327 0.8790737 1.0215751 Phosphatidylcholine acyl-alkyl C 42:5 1.4582062 2.1263816 2.2010944 1.7803625 1.937564 1.4302931 1.8096602 1.6807071 2.2693925 1.2480892 1.5705906 1.3952209 1.5381694 1.5731974 1.3296998 1.9149591 1.7295249 1.0141536 1.6619977 1.7190351 1.4539046 1.6212615 1.9367774 1.9542503 2.2567484 2.0075681 1.9004976 1.5921992 2.3210242 1.4800566 1.3924768 1.2925186 1.7054658 2.150116 1.8891444 1.7559344 1.5999892 2.848465 1.4377847 1.9508832 1.8347087 1.9305544 1.6780542 1.7694461 1.4163473 1.9355017 2.3671515 1.8595502 1.611917 1.4391971 2.0652146 1.7717503 1.9117359 1.8782979 1.6681726 2.0376718 2.1454618 2.4401176 2.4304247 Phosphatidylcholine acyl-alkyl C 44:3 0.038511034 0.063292526 0.08953203 0.061901342 0.035014186 0.073311284 0.101640664 0.109045 0.09175156 0.061927065 0.052440893 0.019666925 0.055657048 0.097513355 0.08986139 0.058250464 0.062455527 0.053323068 0.06577757 0.059346925 0.042422377 0.05634607 0.14388727 0.12025179 0.10393633 0.13696676 0.10754429 0.10149062 0.17959341 0.116791405 0.08577209 0.11335321 0.10950198 0.1411744 0.10623559 0.182239 0.0965471 0.14236885 0.07917938 0.12711143 0.10093633 0.13666229 0.11642935 0.10873484 0.0910947 0.13836235 0.120710626 0.112565875 0.11701821 0.109879375 0.1394269 0.10726448 0.13287964 0.14190072 0.11870638 0.118510365 0.110454924 0.12659909 0.16012508 Phosphatidylcholine acyl-alkyl C 44:4 0.115359746 0.22313686 0.2528981 0.2923762 0.29367608 0.19816604 0.17792949 0.15247191 0.29607186 0.07758504 0.1871314 0.22104558 0.24965999 0.19782148 0.1274466 0.30375245 0.1965702 0.15406115 0.21942125 0.19300587 0.16645202 0.20900613 0.4389643 0.3518638 0.3593309 0.34980044 0.33272633 0.31790692 0.57336533 0.2944085 0.23853958 0.30981624 0.3359344 0.4234204 0.42357245 0.36982784 0.4194513 0.58933043 0.348619 0.44738796 0.33103803 0.4181625 0.35678077 0.37751472 0.25555408 0.33433157 0.39670977 0.37301964 0.3722732 0.3137881 0.42268363 0.32006362 0.4977793 0.36633843 0.31360713 0.42526662 0.38667172 0.46135607 0.47110093 Phosphatidylcholine acyl-alkyl C 44:5 0.6594716 1.0980188 0.9893634 0.86396754 0.9767518 0.86299276 0.9910296 1.0245882 1.2676897 0.6164502 0.9360208 0.62713295 0.944217 0.76260793 0.69812274 1.2011291 1.0126115 0.57458335 1.3124585 0.9904537 0.8239725 1.0947791 1.9710908 1.6405857 1.8384905 1.8209218 1.5511333 1.6773541 2.3161495 1.2379445 0.9770773 1.2625226 1.6203479 1.9300803 1.8029069 1.5206358 1.6839464 2.9610367 1.2915833 1.9814568 1.5942051 1.8614612 1.7055744 1.5185747 1.1063186 1.6854702 2.231607 1.7503968 1.5037047 1.1926029 2.0478268 1.5906448 1.8815904 1.845169 1.7045871 2.0556324 2.1192484 2.563437 2.1050093 Phosphatidylcholine acyl-alkyl C 44:6 0.50922173 0.54789305 0.4853419 0.6200744 0.63807416 0.5732163 0.97423023 0.49821746 0.6356837 0.3927031 0.5463493 0.48709825 0.46956754 0.455147 0.533443 0.7281814 0.4375284 0.4265779 0.50284356 0.5223454 0.6807267 0.62805223 1.1609703 1.0737785 1.2507392 1.3077599 1.0557272 0.86154455 1.431293 0.7442947 0.71988654 0.8298935 1.1597778 1.3078067 1.1042598 1.0558323 0.8614891 1.8138745 0.9651526 1.1164013 0.97405326 1.1367416 1.0247166 0.8340388 0.88588625 1.0341946 1.2913684 1.1733167 1.0097564 0.80870265 1.2327242 1.0136496 1.3497063 1.0898967 1.0313396 1.324137 1.2831688 1.2434707 1.390715 HydroxySphingomyeline C 14:1 4.5465717 4.7667084 9.907626 5.658953 5.110884 7.1630683 5.3870277 5.6749725 5.8997054 3.199212 3.9141653 4.4998474 4.057759 5.0092 4.6497345 4.797746 3.2771747 4.7565875 4.5912404 7.7683306 2.8365734 6.471789 5.1117525 4.127544 6.660528 4.131562 4.7773237 3.6575692 5.379542 3.0109112 4.349147 5.4289546 3.8028255 5.4108 3.8422472 4.400514 3.730289 4.87839 3.258908 4.3689666 4.3152127 3.798006 4.093638 4.145659 3.0386727 4.4636087 5.6529284 3.679714 3.7388208 3.2041583 6.1368465 3.72588 3.5712295 4.0686274 3.8514879 6.0903115 4.367752 4.8979673 4.1752996 HydroxySphingomyeline C 16:0 2.2031562 2.310613 3.939053 2.0948265 2.1674323 3.1960766 2.2471054 1.9128914 2.532575 1.3130354 1.8716918 1.9110891 1.2489536 1.9009687 1.7171612 1.986518 1.2709801 1.8383703 1.7178329 2.9194849 1.1594286 2.4020877 2.508403 1.9945464 2.557945 1.9412515 2.342944 1.7435491 2.31964 1.6276698 2.164678 2.6930988 1.7574124 2.4067938 1.9095817 2.0530398 1.8106744 2.0929759 1.3466245 2.2566223 2.051688 2.0864708 1.7139916 2.1761274 1.696369 2.3495185 2.6883695 1.8743263 1.9232466 1.7391293 3.3689787 1.7909887 1.8297931 2.2641602 2.1676188 2.5972102 2.2538195 2.5054371 2.1846013 HydroxySphingomyeline C 22:1 5.5017877 5.3929853 10.612616 8.299556 6.271151 8.079941 7.034859 6.6151166 5.3550606 4.699767 6.9032326 9.072742 4.664284 5.8888907 7.2971854 6.0286226 3.379074 6.301474 5.3190966 7.733656 3.6091757 6.4486985 11.791199 12.178753 10.707142 10.116479 11.043419 8.962664 10.780369 6.8196945 7.568296 10.492093 7.4595532 11.9101095 8.397566 10.100031 8.250794 10.600261 8.112143 9.407247 11.742944 9.328773 9.637945 10.350338 7.7171836 10.1490135 10.936985 9.138164 7.999235 7.155258 11.18995 8.033634 7.397509 8.889778 6.976785 11.011582 10.834501 12.176968 10.795434 HydroxySphingomyeline C 22:2 4.3018394 4.682792 7.014418 5.9728236 5.1361365 6.7255816 5.4232345 5.188308 4.5651884 3.4118302 4.485952 4.9564896 3.4712172 4.1915293 5.319377 3.6674452 2.8777618 4.100286 4.14131 6.5378757 2.665565 5.039185 9.094495 8.803891 8.804466 7.2703834 8.436783 6.932304 7.986708 6.055755 6.79346 9.410289 7.0213556 8.930486 7.4472938 7.546916 7.119878 8.694294 6.1020207 8.543758 8.123283 7.2508645 6.9587536 7.152346 6.075781 8.477675 9.859177 7.0592136 7.949443 5.7778153 10.145812 6.224361 5.8543158 7.5598226 6.9778633 10.351643 8.283706 9.229051 8.590336 HydroxySphingomyeline C 24:1 0.50565547 0.46138445 1.0885661 0.6273375 0.5415227 0.7205545 0.6495352 0.5960683 0.37052783 0.3286621 0.48331624 0.64052445 0.30587894 0.54041433 0.398478 0.48437417 0.27608347 0.5465317 0.42968583 0.49030155 0.25750858 0.5316301 1.5842972 1.13112 1.3516527 0.99689883 1.2447602 1.0149314 1.429113 0.78498703 0.8041127 1.291973 0.93812406 1.280866 0.8548544 0.9913411 0.95202374 1.1800506 0.9009949 1.1480044 0.9750561 1.1444722 1.167067 1.0468569 0.9276498 1.3863227 1.5292003 1.1274073 0.95778084 0.8837121 1.31559 0.922301 0.8825174 1.0622863 0.8345801 1.2945719 1.6397357 1.3547568 1.1679614 Sphingomyeline C 16:0 91.96171 88.44802 154.34428 115.07433 100.02092 131.27261 107.76515 83.21194 92.2614 80.117645 99.99707 99.84718 72.41242 75.51155 94.52925 88.73137 57.37703 86.00804 79.46244 114.7655 78.5568 97.656624 90.59 77.348465 73.19532 79.21845 77.43849 63.114414 93.20677 66.14022 64.8889 78.60627 59.754234 87.94334 72.56771 69.17269 61.56274 87.9695 63.496685 79.433014 73.63854 73.19933 78.0074 78.358025 63.727005 76.786964 85.65779 75.29255 80.931595 60.98725 103.236595 67.25945 68.36444 66.938805 67.010765 82.93383 72.69796 96.60669 87.09293 Sphingomyeline C 16:1 12.785463 14.233399 23.284704 15.203248 15.713638 19.623796 14.716251 11.678346 12.796228 12.2335825 12.544933 17.235046 11.054896 9.550131 15.396335 10.912788 6.6157055 12.520862 11.240524 15.825543 10.993657 14.111714 15.306998 11.812542 11.528339 12.376119 12.195393 9.354775 12.984032 9.731658 8.732763 10.862106 9.819131 12.98448 11.479524 11.138561 9.390809 14.8063965 9.999576 12.243256 10.632889 10.12863 11.667706 10.576195 9.584992 14.082941 14.737928 11.964264 13.190475 8.705107 17.644001 9.92789 8.712398 11.545563 10.929726 14.459041 9.880672 16.18038 13.805255 Sphingomyeline C 18:0 17.03277 16.254051 26.005686 15.6501665 16.067968 26.633953 14.167099 12.261344 17.791178 10.760048 16.259382 16.83128 9.551051 10.745768 11.348912 13.302215 8.330709 12.970865 12.404186 18.530787 11.55764 15.336101 16.798668 14.483414 13.785787 13.640587 14.909584 13.350629 12.870535 13.472806 13.645433 14.33266 10.733657 14.489503 15.856516 14.543982 12.051495 14.726526 9.018345 15.04258 14.02546 16.558725 10.607566 15.642903 12.05712 16.18817 19.136417 13.611971 14.837082 12.597089 21.56153 10.987151 11.595395 16.551838 18.033033 17.046865 12.80697 21.099846 13.972422 Sphingomyeline C 18:1 9.081054 8.599366 11.704711 7.8599963 9.122964 12.32571 6.688184 5.2349057 7.521837 5.566205 7.3350353 8.875482 4.7380505 4.665175 6.1632366 5.73981 3.839577 5.723536 5.2971087 8.580913 6.2267227 7.8337865 8.265175 6.773818 5.5297093 6.7534404 7.1920223 5.9221544 5.4399533 7.0534782 5.901741 6.6158624 5.250092 6.691745 7.5779657 7.1956687 5.57596 7.6193275 4.503484 7.553119 5.9845576 7.516156 5.2542186 6.6339164 6.1500387 8.745512 8.386625 6.9079084 8.369646 5.777806 11.514311 4.9551897 5.0543814 8.717504 8.892086 8.01492 5.418494 10.667908 6.7821493 Sphingomyeline C 20:2 0.38731134 0.32976666 0.48364922 0.3892284 0.4691566 0.5265061 0.37940216 0.34968463 0.45095646 0.1826508 0.33742133 0.39273247 0.3266436 0.29609767 0.35292175 0.3800884 0.22660673 0.36550048 0.35805792 0.4539752 0.22545984 0.39678153 0.40051737 0.34944916 0.3968243 0.31130213 0.35834157 0.27273062 0.2987531 0.26241866 0.2678437 0.31355596 0.27140737 0.2901111 0.28231254 0.2735569 0.25421837 0.34047064 0.29071894 0.3298341 0.23638551 0.3228172 0.27048326 0.26214454 0.34714022 0.4037573 0.37627503 0.31648824 0.33305475 0.28405473 0.47014222 0.26962918 0.1786758 0.38691133 0.31514937 0.36368105 0.29304713 0.3808707 0.34787172 Sphingomyeline C 22:3 0.45604524 1.0627854 0.28937843 0.23185536 0.008035512 0.06787886 0.78332734 0.8167317 0.24986489 0.78862953 0.580723 0.15418354 0.8208328 0.010016017 0.39150906 0.7108463 0.76418126 0.3112962 0.25122774 0.18420574 0.17913301 0.37530163 0.1342551 0.43215176 0.06608763 0.06925126 0.11407635 0.19274892 0.1627158 0.06437319 0.042111255 0.08114456 0.11353034 0.23601921 0.22377671 0.58694947 0.15647389 0.087085195 0.09775333 0.60123646 0.16957568 0.084499136 0.3787189 0.11187721 0.45226952 0.20843029 Sphingomyeline C 24:0 10.959892 10.674238 19.94981 15.527638 14.52514 14.568294 13.406189 11.385153 9.379883 11.577546 13.349745 22.095509 9.742044 10.829773 15.690232 12.488809 7.0031056 13.533947 9.547882 12.630664 8.792124 11.05943 22.28681 21.266659 18.57669 19.451412 19.43951 16.86123 23.688421 16.41082 12.409695 15.768011 12.402469 21.062098 15.567713 19.408009 14.207957 25.664669 17.195412 18.251907 21.78644 19.643988 20.045626 18.814495 15.923706 20.900345 22.507364 20.1569 15.982078 13.378086 20.71138 18.663187 15.541234 14.848089 13.629267 20.275923 18.821447 25.23011 24.063744 Sphingomyeline C 24:1 27.850557 28.264982 43.079975 35.444183 30.925121 38.659374 30.133232 28.148458 26.080994 21.687777 30.022827 30.699253 23.09242 24.245558 29.741228 25.415874 18.067186 25.652082 23.0344 35.221355 20.497986 27.332932 55.012096 47.995457 37.472446 42.916584 47.46123 38.59202 48.07084 40.660255 32.35221 39.90135 35.88117 41.238377 41.553635 36.581253 36.62347 53.246765 32.90478 50.04406 47.936386 42.482502 40.965343 34.826237 34.399597 51.260525 54.068954 45.404278 43.734467 41.35225 55.76744 37.243664 34.97748 40.040222 44.135727 46.193386 43.88034 60.119144 51.996914 Sphingomyeline C 26:0 0.106758095 0.055955846 0.08390936 0.09965205 0.11669881 0.103227794 0.036568366 0.06666787 0.04458277 0.02659288 0.08222994 0.040448934 0.024185164 0.056815695 0.08540275 0.06237761 0.044475634 0.09327557 0.061152562 0.06712382 0.054489728 0.07468606 0.19020952 0.14583984 0.16063862 0.120541155 0.1266761 0.120909154 0.16225451 0.11281248 0.09351888 0.19098885 0.1252919 0.13409308 0.09492621 0.118421346 0.11646846 0.19490832 0.10733682 0.09726493 0.1597792 0.12089543 0.08128469 0.13454327 0.093170896 0.17809992 0.21125878 0.1507501 0.098328926 0.10742123 0.15890111 0.111368224 0.10969156 0.14317285 0.12013623 0.16925952 0.18654732 0.1522604 0.14716788 Sphingomyeline C 26:1 0.17639206 0.21929656 0.33362678 0.30351815 0.247034 0.2935767 0.17056197 0.19032617 0.19677137 0.1204504 0.15201437 0.18987617 0.14026695 0.15000126 0.18924157 0.21452814 0.11615776 0.1825282 0.18977876 0.208782 0.11453166 0.20380726 0.45465177 0.37126955 0.3567658 0.29845685 0.3620087 0.2695712 0.323194 0.27104822 0.29931033 0.37900853 0.26284817 0.34503666 0.30093282 0.21704319 0.24629991 0.45874336 0.24788088 0.3160187 0.26497978 0.34396726 0.32626367 0.30879897 0.20402047 0.4522261 0.39637148 0.31288144 0.27053195 0.36514622 0.4768267 0.24965718 0.25436828 0.31913954 0.3813872 0.35273468 0.42601988 0.36658227 0.414189 Hexose 4537.9697 4963.6157 3838.3354 4381.258 4699.4683 4274.784 4540.4863 4527.5 4337.47 3932.3857 4966.924 4816.1177 3756.964 4203.4917 4720.416 4623.759 3703.5369 3762.1626 4119.9766 4093.7322 4423.709 4173.761 4861.5254 4549.6675 4886.488 4734.7085 4213.585 4006.6633 4360.636 4404.442 3427.7197 4376.561 4603.056 4372.291 3936.23 4887.183 2972.2153 4756.7246 4644.357 5154.8125 4677.546 5011.7935 4514.0303 4629.6943 4000.268 4886.446 4870.4614 4323.7207 4504.3354 4655.661 5348.8184 4195.546 3878.4202 4660.3887 3752.1243 4724.414 4127.9937 5269.784 4782.1787 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name retention index quantified m/z PubChem ID KEGG ID HMDB DL-Carnitine C15025 HMDB00062 Decanoyl-L-carnitine HMDB00651 Decenoyl-L-carnitine HMDB13205 Decadienyl-L-carnitine Dodecanoyl-L-carnitine HMDB02250 Dodecanedioyl-L-carnitine HMDB13327 Dodecenoyl-L-carnitine Tetradecanoyl-L-carnitine HMDB05066 Tetradecenoyl-L-carnitine HMDB02014 Hydroxytetradecenoyl-L-carnitine HMDB13330 Tetradecadienyl-L-carnitine HMDB13331 Hydroxytetradecadienyl-L-carnitine Hexadecanoyl-L-carnitine C02990 HMDB00222 Hydroxyhexadecanoyl-L-carnitine Hexadecenoyl-L-carnitine HMDB06317 Hydroxyhexadecenoyl-L-carnitine HMDB13333 Hexadecadienyl-L-carnitine HMDB13334 Hydroxyhexadecadienyl-L-carnitine HMDB13335 Octadecanoyl-L-carnitine HMDB00848 Octadecenoyl-L-carnitine HMDB05065 Hydroxyoctadecenoyl-L-carnitine HMDB13339 Octadecadienyl-L-carnitine HMDB06461 Acetyl-L-carnitine C02571 HMDB00201 Propionyl-L-carnitine C03017 HMDB00824 Malonyl-L-carnitine / Hydroxybutyryl-L-carnitine HMDB02095 Hydroxypropionyl-L-carnitine HMDB13125 Propenyl-L-carnitine HMDB13124 Butyryl-L-carnitine C02862 HMDB00736 Butenyl-L-carnitine HMDB13126 Valeryl-L-carnitine HMDB00688 Glutaryl-L-carnitine / Hydroxyhexanoyl-L-carnitine HMDB13130 Methylglutaryl-L-carnitine HMDB00552 Methylmalonyl-L-carnitine / Hydroxyvaleryl-L-carnitine HMDB13132 Tiglyl-L-carnitine HMDB02366 Glutaconyl-L-carnitine HMDB13129 Fumaryl-L-carnitine / Hexanoyl-L-carnitine HMDB00705 Hexenoyl-L-carnitine HMDB13161 Pimelyl-L-carnitine HMDB13328 Octanoyl-L-carnitine HMDB00791 Octenoyl-L-carnitine Nonayl-L-carnitine HMDB06320 Arginine C00062 HMDB00517 Glutamine C00064 HMDB00641 Glycine C00037 HMDB00123 Histidine C00135 HMDB00177 Methionine C00073 HMDB00696 Ornithine C00077 HMDB00214 Phenylalanine C02455 HMDB00159 Proline C00148 HMDB00162 Serine C00065 HMDB00187 Threonine C00188 HMDB00167 Tryptophan C00078 HMDB00929 Tyrosine C00082 HMDB00158 Valine C00183 HMDB00883 xLeucine C00123 HMDB00687 lysoPhosphatidylcholine acyl C14:0 C04230 HMDB10379 lysoPhosphatidylcholine acyl C16:0 C04230 HMDB10382 lysoPhosphatidylcholine acyl C16:1 C04230 HMDB10383 lysoPhosphatidylcholine acyl C17:0 C04230 HMDB12108 lysoPhosphatidylcholine acyl C18:0 C04230 HMDB10384 lysoPhosphatidylcholine acyl C18:1 C04230 HMDB02815 lysoPhosphatidylcholine acyl C18:2 C04230 HMDB10386 lysoPhosphatidylcholine acyl C20:3 C04230 HMDB10393 lysoPhosphatidylcholine acyl C20:4 C04230 HMDB10395 lysoPhosphatidylcholine acyl C24:0 C04230 HMDB10405 lysoPhosphatidylcholine acyl C26:0 HMDB29205 lysoPhosphatidylcholine acyl C26:1 HMDB29220 lysoPhosphatidylcholine acyl C28:0 HMDB29206 lysoPhosphatidylcholine acyl C28:1 HMDB29221 lysoPhosphatidylcholine acyl C6:0 Phosphatidylcholine diacyl C 24:0 Phosphatidylcholine diacyl C 26:0 Phosphatidylcholine diacyl C 28:1 Phosphatidylcholine diacyl C 30:0 C00157 HMDB07869 Phosphatidylcholine diacyl C 30:2 Phosphatidylcholine diacyl C 32:0 C00157 HMDB00564 Phosphatidylcholine diacyl C 32:1 C00157 HMDB07872 Phosphatidylcholine diacyl C 32:2 C00157 HMDB07874 Phosphatidylcholine diacyl C 32:3 C00157 HMDB07876 Phosphatidylcholine diacyl C 34:1 C00157 HMDB07971 Phosphatidylcholine diacyl C 34:2 C00157 HMDB07973 Phosphatidylcholine diacyl C 34:3 C00157 HMDB07974 Phosphatidylcholine diacyl C 34:4 C00157 HMDB07883 Phosphatidylcholine diacyl C 36:0 C00157 HMDB07886 Phosphatidylcholine diacyl C 36:1 C00157 HMDB08037 Phosphatidylcholine diacyl C 36:2 C00157 HMDB08039 Phosphatidylcholine diacyl C 36:3 C00157 HMDB07980 Phosphatidylcholine diacyl C 36:4 C00157 HMDB07982 Phosphatidylcholine diacyl C 36:5 C00157 HMDB07984 Phosphatidylcholine diacyl C 36:6 C00157 HMDB07892 Phosphatidylcholine diacyl C 38:0 C00157 HMDB07893 Phosphatidylcholine diacyl C 38:1 C00157 HMDB07894 Phosphatidylcholine diacyl C 38:3 C00157 HMDB08046 Phosphatidylcholine diacyl C 38:4 C00157 HMDB07988 Phosphatidylcholine diacyl C 38:5 C00157 HMDB07989 Phosphatidylcholine diacyl C 38:6 C00157 HMDB07991 Phosphatidylcholine diacyl C 40:1 C00157 HMDB07993 Phosphatidylcholine diacyl C 40:2 C00157 HMDB08276 Phosphatidylcholine diacyl C 40:3 Phosphatidylcholine diacyl C 40:4 C00157 HMDB08054 Phosphatidylcholine diacyl C 40:5 C00157 HMDB08055 Phosphatidylcholine diacyl C 40:6 C00157 HMDB08057 Phosphatidylcholine diacyl C 42:0 C00157 HMDB08058 Phosphatidylcholine diacyl C 42:1 C00157 HMDB08059 Phosphatidylcholine diacyl C 42:2 HMDB08570 Phosphatidylcholine diacyl C 42:4 HMDB08572 Phosphatidylcholine diacyl C 42:5 C00157 HMDB08287 Phosphatidylcholine diacyl C 42:6 C00157 HMDB08288 Phosphatidylcholine acyl-alkyl C 30:0 HMDB13341 Phosphatidylcholine acyl-alkyl C 30:1 HMDB13402 Phosphatidylcholine acyl-alkyl C 30:2 Phosphatidylcholine acyl-alkyl C 32:1 Phosphatidylcholine acyl-alkyl C 32:2 Phosphatidylcholine acyl-alkyl C 34:0 HMDB13405 Phosphatidylcholine acyl-alkyl C 34:1 Phosphatidylcholine acyl-alkyl C 34:2 HMDB11151 Phosphatidylcholine acyl-alkyl C 34:3 HMDB11211 Phosphatidylcholine acyl-alkyl C 36:0 HMDB13406 Phosphatidylcholine acyl-alkyl C 36:1 HMDB13427 Phosphatidylcholine acyl-alkyl C 36:2 HMDB11243 Phosphatidylcholine acyl-alkyl C 36:3 HMDB13429 Phosphatidylcholine acyl-alkyl C 36:4 HMDB13435 Phosphatidylcholine acyl-alkyl C 36:5 HMDB11220 Phosphatidylcholine acyl-alkyl C 38:0 HMDB13408 Phosphatidylcholine acyl-alkyl C 38:1 HMDB13430 Phosphatidylcholine acyl-alkyl C 38:2 HMDB13431 Phosphatidylcholine acyl-alkyl C 38:3 HMDB13439 Phosphatidylcholine acyl-alkyl C 38:4 HMDB13420 Phosphatidylcholine acyl-alkyl C 38:5 HMDB13432 Phosphatidylcholine acyl-alkyl C 38:6 HMDB13409 Phosphatidylcholine acyl-alkyl C 40:0 HMDB13421 Phosphatidylcholine acyl-alkyl C 40:1 HMDB13433 Phosphatidylcholine acyl-alkyl C 40:2 HMDB13437 Phosphatidylcholine acyl-alkyl C 40:3 HMDB13445 Phosphatidylcholine acyl-alkyl C 40:4 HMDB13442 Phosphatidylcholine acyl-alkyl C 40:5 HMDB13444 Phosphatidylcholine acyl-alkyl C 40:6 HMDB13422 Phosphatidylcholine acyl-alkyl C 42:0 HMDB13443 Phosphatidylcholine acyl-alkyl C 42:1 HMDB13434 Phosphatidylcholine acyl-alkyl C 42:2 HMDB13438 Phosphatidylcholine acyl-alkyl C 42:3 HMDB13459 Phosphatidylcholine acyl-alkyl C 42:4 HMDB13448 Phosphatidylcholine acyl-alkyl C 42:5 HMDB13451 Phosphatidylcholine acyl-alkyl C 44:3 HMDB13449 Phosphatidylcholine acyl-alkyl C 44:4 HMDB13453 Phosphatidylcholine acyl-alkyl C 44:5 HMDB13456 Phosphatidylcholine acyl-alkyl C 44:6 HMDB13457 HydroxySphingomyeline C 14:1 HydroxySphingomyeline C 16:0 HydroxySphingomyeline C 22:1 HydroxySphingomyeline C 22:2 HydroxySphingomyeline C 24:1 Sphingomyeline C 16:0 HMDB10169 Sphingomyeline C 16:1 HMDB29216 Sphingomyeline C 18:0 HMDB01348 Sphingomyeline C 18:1 C00550 HMDB12100 Sphingomyeline C 20:2 Sphingomyeline C 22:3 Sphingomyeline C 24:0 Sphingomyeline C 24:1 C00550 HMDB12107 Sphingomyeline C 26:0 HMDB11698 Sphingomyeline C 26:1 C00550 HMDB13461 Hexose C00031 HMDB00122 METABOLITES_END #END