#METABOLOMICS WORKBENCH mcglinchey_aidan_20210907_070307 DATATRACK_ID:2826 STUDY_ID:ST001919 ANALYSIS_ID:AN003118
VERSION                          	1
CREATED_ON                       	03-03-2022
#PROJECT
PR:PROJECT_TITLE                 	Exposure to environmental contaminants is associated with alterations in hepatic
PR:PROJECT_TITLE                 	lipid metabolism in non-alcoholic fatty liver disease
PR:PROJECT_SUMMARY               	Background & aims: Recent experimental models and epidemiological studies
PR:PROJECT_SUMMARY               	suggest that specific environmental contaminants (ECs) contribute to the
PR:PROJECT_SUMMARY               	initiation and pathology of NAFLD. However, the underlying mechanisms linking EC
PR:PROJECT_SUMMARY               	exposure with NAFLD remain poorly understood and there is no data on their
PR:PROJECT_SUMMARY               	impact on the human liver metabolome. Herein, we hypothesized that exposure to
PR:PROJECT_SUMMARY               	ECs, particularly perfluorinated alkyl substances (PFAS), impacts liver
PR:PROJECT_SUMMARY               	metabolism, specifically bile acid metabolism. Methods: In a well-characterized
PR:PROJECT_SUMMARY               	human NAFLD cohort of 105 individuals, we investigated the effects of EC
PR:PROJECT_SUMMARY               	exposure on liver metabolism. We characterized the liver (via biopsy) and
PR:PROJECT_SUMMARY               	circulating metabolomes using four mass spectrometry-based analytical platforms,
PR:PROJECT_SUMMARY               	and measured PFAS and other ECs in serum. We subsequently compared these results
PR:PROJECT_SUMMARY               	with an exposure study in a PPARa-humanized mouse model. Results: PFAS exposure
PR:PROJECT_SUMMARY               	appears associated with perturbation of key hepatic metabolic pathways
PR:PROJECT_SUMMARY               	previously found altered in NAFLD, particularly as regards bile acid metabolism.
PR:PROJECT_SUMMARY               	Specifically, we identified stronger associations between the liver metabolome,
PR:PROJECT_SUMMARY               	chemical exposure and NAFLD-associated clinical variables in female subjects
PR:PROJECT_SUMMARY               	versus males. The murine exposure study further corroborated our findings,
PR:PROJECT_SUMMARY               	vis-à-vis a sex-specific association between PFAS exposure and NAFLD-associated
PR:PROJECT_SUMMARY               	lipid changes. Conclusions: Females may be more sensitive to the harmful impacts
PR:PROJECT_SUMMARY               	of PFAS. Lipid-related changes subsequent to PFAS exposure may be secondary to
PR:PROJECT_SUMMARY               	the interplay between PFAS and bile acid metabolism.
PR:INSTITUTE                     	Örebro University
PR:DEPARTMENT                    	Department of Medical Sciences
PR:LAST_NAME                     	McGlinchey
PR:FIRST_NAME                    	Aidan
PR:ADDRESS                       	School of Medical Sciences, Örebro, Örebro, 70281, Sweden
PR:EMAIL                         	aidan.mcglinchey@oru.se
PR:PHONE                         	+46736485638
PR:DOI                           	http://dx.doi.org/10.21228/M89D7G
#STUDY
ST:STUDY_TITLE                   	Exposure to environmental contaminants is associated with alterations in hepatic
ST:STUDY_TITLE                   	lipid metabolism in non-alcoholic fatty liver disease
ST:STUDY_SUMMARY                 	Background & aims: Recent experimental models and epidemiological studies
ST:STUDY_SUMMARY                 	suggest that specific environmental contaminants (ECs) contribute to the
ST:STUDY_SUMMARY                 	initiation and pathology of NAFLD. However, the underlying mechanisms linking EC
ST:STUDY_SUMMARY                 	exposure with NAFLD remain poorly understood and there is no data on their
ST:STUDY_SUMMARY                 	impact on the human liver metabolome. Herein, we hypothesized that exposure to
ST:STUDY_SUMMARY                 	ECs, particularly perfluorinated alkyl substances (PFAS), impacts liver
ST:STUDY_SUMMARY                 	metabolism, specifically bile acid metabolism. Methods: In a well-characterized
ST:STUDY_SUMMARY                 	human NAFLD cohort of 105 individuals, we investigated the effects of EC
ST:STUDY_SUMMARY                 	exposure on liver metabolism. We characterized the liver (via biopsy) and
ST:STUDY_SUMMARY                 	circulating metabolomes using four mass spectrometry-based analytical platforms,
ST:STUDY_SUMMARY                 	and measured PFAS and other ECs in serum. We subsequently compared these results
ST:STUDY_SUMMARY                 	with an exposure study in a PPARa-humanized mouse model. Results: PFAS exposure
ST:STUDY_SUMMARY                 	appears associated with perturbation of key hepatic metabolic pathways
ST:STUDY_SUMMARY                 	previously found altered in NAFLD, particularly as regards bile acid metabolism.
ST:STUDY_SUMMARY                 	Specifically, we identified stronger associations between the liver metabolome,
ST:STUDY_SUMMARY                 	chemical exposure and NAFLD-associated clinical variables in female subjects
ST:STUDY_SUMMARY                 	versus males. The murine exposure study further corroborated our findings,
ST:STUDY_SUMMARY                 	vis-à-vis a sex-specific association between PFAS exposure and NAFLD-associated
ST:STUDY_SUMMARY                 	lipid changes. Conclusions: Females may be more sensitive to the harmful impacts
ST:STUDY_SUMMARY                 	of PFAS. Lipid-related changes subsequent to PFAS exposure may be secondary to
ST:STUDY_SUMMARY                 	the interplay between PFAS and bile acid metabolism.
ST:INSTITUTE                     	Örebro University
ST:DEPARTMENT                    	Department of Medical Sciences
ST:LAST_NAME                     	McGlinchey
ST:FIRST_NAME                    	Aidan
ST:ADDRESS                       	School of Medical Sciences, Örebro, Örebro, 70281, Sweden
ST:EMAIL                         	aidan.mcglinchey@oru.se
ST:PHONE                         	+46736485638
ST:SUBMIT_DATE                   	2021-09-07
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Mus musculus
SU:TAXONOMY_ID                   	10090
SU:GENDER                        	Male and female
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0031	Cohort:2 | Mouse:10 | Sex:Female | Genotype:KO | Ear Mark:1x Rt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0031
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0038	Cohort:2 | Mouse:11 | Sex:Male | Genotype:KO | Ear Mark:1x Lt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0038
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0030	Cohort:2 | Mouse:12 | Sex:Male | Genotype:hPPARa | Ear Mark:None | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0030
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0009	Cohort:2 | Mouse:13 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0009
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0012	Cohort:2 | Mouse:8 | Sex:Female | Genotype:KO | Ear Mark:1x Lt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0012
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0021	Cohort:2 | Mouse:9 | Sex:Female | Genotype:hPPARa | Ear Mark:None | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0021
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0011	Cohort:3 | Mouse:14 | Sex:Male | Genotype:KO | Ear Mark:None | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0011
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0029	Cohort:3 | Mouse:15 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0029
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0002	Cohort:3 | Mouse:16 | Sex:Female | Genotype:hPPARa | Ear Mark:None | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0002
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0008	Cohort:3 | Mouse:17 | Sex:Female | Genotype:KO | Ear Mark:1x Rt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0008
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0016	Cohort:3 | Mouse:18 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0016
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0006	Cohort:3 | Mouse:19 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Bt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0006
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0025	Cohort:4 | Mouse:20 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0025
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0022	Cohort:4 | Mouse:21 | Sex:Male | Genotype:KO | Ear Mark:2x Rt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0022
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0033	Cohort:4 | Mouse:22 | Sex:Female | Genotype:KO | Ear Mark:1x Lt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0033
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0036	Cohort:5 | Mouse:23 | Sex:Female | Genotype:KO | Ear Mark:None | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0036
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0034	Cohort:5 | Mouse:24 | Sex:Female | Genotype:KO | Ear Mark:1x Rt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0034
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0017	Cohort:5 | Mouse:25 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0017
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0032	Cohort:5 | Mouse:26 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Bt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0032
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0027	Cohort:5 | Mouse:27 | Sex:Male | Genotype:KO | Ear Mark:None | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0027
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0028	Cohort:5 | Mouse:28 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0028
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0026	Cohort:5 | Mouse:29 | Sex:Male | Genotype:KO | Ear Mark:1x Lt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0026
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0041	Cohort:6 | Mouse:30 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0041
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0035	Cohort:6 | Mouse:31 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0035
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0018	Cohort:6 | Mouse:32 | Sex:Male | Genotype:KO | Ear Mark:1x Bt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0018
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0007	Cohort:6 | Mouse:33 | Sex:Female | Genotype:KO | Ear Mark:None | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0007
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0010	Cohort:6 | Mouse:34 | Sex:Female | Genotype:KO | Ear Mark:1x Rt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0010
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0004	Cohort:6 | Mouse:35 | Sex:Female | Genotype:KO | Ear Mark:1x Lt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0004
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0040	Cohort:6 | Mouse:36 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Bt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0040
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0023	Cohort:6 | Mouse:37 | Sex:Male | Genotype:hPPARa | Ear Mark:None | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0023
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0014	Cohort:7 | Mouse:38 | Sex:Male | Genotype:hPPARa | Ear Mark:None | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0014
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0015	Cohort:7 | Mouse:39 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0015
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0039	Cohort:7 | Mouse:40 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0039
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0003	Cohort:7 | Mouse:41 | Sex:Male | Genotype:KO | Ear Mark:1x Bt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0003
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0013	Cohort:7 | Mouse:42 | Sex:Female | Genotype:hPPARa | Ear Mark:None | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0013
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0005	Cohort:8 | Mouse:43 | Sex:Male | Genotype:hPPARa | Ear Mark:None | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0005
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0001	Cohort:8 | Mouse:44 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0001
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0020	Cohort:8 | Mouse:45 | Sex:Female | Genotype:KO | Ear Mark:1x Bt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0020
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0037	Cohort:8 | Mouse:46 | Sex:Female | Genotype:hPPARa | Ear Mark:2x Rt | Treatment:PFOA	RAW_FILE_NAME=0060_LC_20190903_sample_0037
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0024	Cohort:8 | Mouse:47 | Sex:Female | Genotype:hPPARa | Ear Mark:None | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0024
SUBJECT_SAMPLE_FACTORS           	-	0060_LC_20190903_sample_0019	Cohort:8 | Mouse:48 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:Vh	RAW_FILE_NAME=0060_LC_20190903_sample_0019
#COLLECTION
CO:COLLECTION_SUMMARY            	Male and female, humanized PPARa mice (hPPARa) were generated from mouse
CO:COLLECTION_SUMMARY            	PPARa-null, human PPARa-heterozygous breeding pairs (generously provided by Dr.
CO:COLLECTION_SUMMARY            	Frank Gonzalez, NCI). At weaning, mice were provided a custom diet based on the
CO:COLLECTION_SUMMARY            	"What we eat in America (NHANES 2013/2014)" analysis (Research Diets, New
CO:COLLECTION_SUMMARY            	Brunswick, NJ) (USDA, 2018): 51.8% carbohydrate, 33.5% fat (soybean oil, lard
CO:COLLECTION_SUMMARY            	and butter, with cholesterol at 224 mg/1884 kcal), and 14.7% protein, as a %
CO:COLLECTION_SUMMARY            	energy intake. Fats are in the form of . Vehicle (VH) and treatment water were
CO:COLLECTION_SUMMARY            	prepared from NERL High Purity water (23-249-589, Thermo Fisher Scientific),
CO:COLLECTION_SUMMARY            	prepared with PFAS removal. Mice were administered vehicle (0.5% sucrose)
CO:COLLECTION_SUMMARY            	drinking water or PFOA (8 mM +0.5% sucrose) drinking water ad libitum for 6-7
CO:COLLECTION_SUMMARY            	weeks. Food and water consumption were determined on a per cage basis each week
CO:COLLECTION_SUMMARY            	and previously reported. Body weight was measured weekly. Aliquots of liver for
CO:COLLECTION_SUMMARY            	lipidomics were flash frozen in liquid nitrogen and stored at -80?C. A total of
CO:COLLECTION_SUMMARY            	11 female mice (5 VH and 6 PFOA) and 12 male mice (7 VH and 5 PFOA) were
CO:COLLECTION_SUMMARY            	analyzed.
CO:SAMPLE_TYPE                   	Liver
CO:STORAGE_CONDITIONS            	-80?
#TREATMENT
TR:TREATMENT_SUMMARY             	Male and female, humanized PPARa mice (hPPARa) were generated from mouse
TR:TREATMENT_SUMMARY             	PPARa-null, human PPARa-heterozygous breeding pairs (generously provided by Dr.
TR:TREATMENT_SUMMARY             	Frank Gonzalez, NCI). At weaning, mice were provided a custom diet based on the
TR:TREATMENT_SUMMARY             	"What we eat in America (NHANES 2013/2014)" analysis (Research Diets, New
TR:TREATMENT_SUMMARY             	Brunswick, NJ) (USDA, 2018): 51.8% carbohydrate, 33.5% fat (soybean oil, lard
TR:TREATMENT_SUMMARY             	and butter, with cholesterol at 224 mg/1884 kcal), and 14.7% protein, as a %
TR:TREATMENT_SUMMARY             	energy intake. Fats are in the form of . Vehicle (VH) and treatment water were
TR:TREATMENT_SUMMARY             	prepared from NERL High Purity water (23-249-589, Thermo Fisher Scientific),
TR:TREATMENT_SUMMARY             	prepared with PFAS removal. Mice were administered vehicle (0.5% sucrose)
TR:TREATMENT_SUMMARY             	drinking water or PFOA (8 mM +0.5% sucrose) drinking water ad libitum for 6-7
TR:TREATMENT_SUMMARY             	weeks. Food and water consumption were determined on a per cage basis each week
TR:TREATMENT_SUMMARY             	and previously reported. Body weight was measured weekly. Aliquots of liver for
TR:TREATMENT_SUMMARY             	lipidomics were flash frozen in liquid nitrogen and stored at -80?C. A total of
TR:TREATMENT_SUMMARY             	11 female mice (5 VH and 6 PFOA) and 12 male mice (7 VH and 5 PFOA) were
TR:TREATMENT_SUMMARY             	analyzed.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Male and female, humanized PPARa mice (hPPARa) were generated from mouse
SP:SAMPLEPREP_SUMMARY            	PPARa-null, human PPARa-heterozygous breeding pairs (generously provided by Dr.
SP:SAMPLEPREP_SUMMARY            	Frank Gonzalez, NCI). At weaning, mice were provided a custom diet based on the
SP:SAMPLEPREP_SUMMARY            	"What we eat in America (NHANES 2013/2014)" analysis (Research Diets, New
SP:SAMPLEPREP_SUMMARY            	Brunswick, NJ) (USDA, 2018): 51.8% carbohydrate, 33.5% fat (soybean oil, lard
SP:SAMPLEPREP_SUMMARY            	and butter, with cholesterol at 224 mg/1884 kcal), and 14.7% protein, as a %
SP:SAMPLEPREP_SUMMARY            	energy intake. Fats are in the form of . Vehicle (VH) and treatment water were
SP:SAMPLEPREP_SUMMARY            	prepared from NERL High Purity water (23-249-589, Thermo Fisher Scientific),
SP:SAMPLEPREP_SUMMARY            	prepared with PFAS removal. Mice were administered vehicle (0.5% sucrose)
SP:SAMPLEPREP_SUMMARY            	drinking water or PFOA (8 mM +0.5% sucrose) drinking water ad libitum for 6-7
SP:SAMPLEPREP_SUMMARY            	weeks. Food and water consumption were determined on a per cage basis each week
SP:SAMPLEPREP_SUMMARY            	and previously reported. Body weight was measured weekly. Aliquots of liver for
SP:SAMPLEPREP_SUMMARY            	lipidomics were flash frozen in liquid nitrogen and stored at -80?C. A total of
SP:SAMPLEPREP_SUMMARY            	11 female mice (5 VH and 6 PFOA) and 12 male mice (7 VH and 5 PFOA) were
SP:SAMPLEPREP_SUMMARY            	analyzed. Liver tissues were first homogenized with cryo-homogenization
SP:SAMPLEPREP_SUMMARY            	(Covaris, CryoPrep CP02, Massachusetts, USA) and weighted (ca. 5 mg). 20 µL of
SP:SAMPLEPREP_SUMMARY            	internal standard mixture 1A was added. This mixture contained PC(17:0/0:0),
SP:SAMPLEPREP_SUMMARY            	PC(17:0/17:0), PE(17:0/17:0), PG(17:0/17:0)[rac], Cer(d18:1/17:0), PS(17:0/17:0)
SP:SAMPLEPREP_SUMMARY            	and PA(17:0/17:0) (Avanti Polar Lipids, Inc., Alabaster, AL) as well as
SP:SAMPLEPREP_SUMMARY            	MG(17:0/0:0/0:0)[rac], DG(17:0/17:0/0:0)[rac] and TG(17:0/17:0/17:0). The lipids
SP:SAMPLEPREP_SUMMARY            	were extracted using a mixture of HPLC-grade chloroform and methanol (2:1; 400
SP:SAMPLEPREP_SUMMARY            	µL). 50 µl of 0.9% NaCl was added and the lower phase (200 µL) was collected
SP:SAMPLEPREP_SUMMARY            	and 20 µL of an internal standard mixture containing labeled PC (16:1/0:0-D3),
SP:SAMPLEPREP_SUMMARY            	PC(16:1/16:1-D6) and TG(16:0/16:0/16:0-13C3) was added. The extracts were
SP:SAMPLEPREP_SUMMARY            	analyzed on a Waters Q-Tof Premier mass spectrometer combined with an Acquity
SP:SAMPLEPREP_SUMMARY            	Ultra Performance LCTM. The column (at 50 °C) was an Acquity UPLCTM BEH C18 2.1
SP:SAMPLEPREP_SUMMARY            	× 100 mm with 1.7 µm particles. The solvent system included A. ultrapure water
SP:SAMPLEPREP_SUMMARY            	(1% 1 M NH4Ac, 0.1% HCOOH) and B. LC/MS grade acetonitrile/isopropanol (1:1, 1%
SP:SAMPLEPREP_SUMMARY            	1M NH4Ac, 0.1% HCOOH). The gradient started from 65% A / 35% B, reached 80% B in
SP:SAMPLEPREP_SUMMARY            	2 min, 100% B in 7 min and remained there for 7 min. The flow rate was 0.400
SP:SAMPLEPREP_SUMMARY            	ml/min and the injected amount was 2.0 µL (Acquity Sample Organizer, at 10
SP:SAMPLEPREP_SUMMARY            	°C). Reserpine was used as the lock spray reference compound. The lipid
SP:SAMPLEPREP_SUMMARY            	profiling was carried out using electrospray ionization mode and the data were
SP:SAMPLEPREP_SUMMARY            	collected at a mass range of m/z 300-1200 with a scan duration of 0.2 sec. The
SP:SAMPLEPREP_SUMMARY            	data processing included alignment of peaks, peak integration, normalization and
SP:SAMPLEPREP_SUMMARY            	identification. Lipids were identified using an internal spectral library. The
SP:SAMPLEPREP_SUMMARY            	data were normalized using one or more internal standards representative of each
SP:SAMPLEPREP_SUMMARY            	class of lipid present in the samples: the intensity of each identified lipid
SP:SAMPLEPREP_SUMMARY            	was normalized by dividing it with the intensity of its corresponding standard
SP:SAMPLEPREP_SUMMARY            	and multiplying it by the concentration of the standard. All monoacyl lipids
SP:SAMPLEPREP_SUMMARY            	except cholesterol esters, such as monoacylglycerols and
SP:SAMPLEPREP_SUMMARY            	monoacylglycerophospholipids, were normalized with PC(17:0/0:0), all diacyl
SP:SAMPLEPREP_SUMMARY            	lipids except ethanolamine phospholipids were normalized with PC(17:0/17:0), all
SP:SAMPLEPREP_SUMMARY            	ceramides with Cer(d18:1/17:0), all diacyl ethanolamine phospholipids with
SP:SAMPLEPREP_SUMMARY            	PE(17:0/17:0), and TG and cholesterol esters with TG(17:0/17:0/17:0). Other
SP:SAMPLEPREP_SUMMARY            	(unidentified) molecular species were normalized with PC(17:0/0:0) for retention
SP:SAMPLEPREP_SUMMARY            	times < 300 s, PC(17:0/17:0) for a retention time between 300 s and 410 s,
SP:SAMPLEPREP_SUMMARY            	and TG(17:0/17:0/17:0) for longer retention times. Quality control of the method
SP:SAMPLEPREP_SUMMARY            	showed that the day-to-day repeatability of control serum samples, and the
SP:SAMPLEPREP_SUMMARY            	relative standard deviation (RSD) for values identified was on average below 25%
SP:SAMPLEPREP_SUMMARY            	and 20% for discovery and validation sECs, respectively. The internal standards
SP:SAMPLEPREP_SUMMARY            	added to all samples in the study had an average RSD of 25% and 13 % in the
SP:SAMPLEPREP_SUMMARY            	discovery and validation sECs.
SP:PROCESSING_STORAGE_CONDITIONS 	Described in summary
SP:EXTRACT_STORAGE               	-80?
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	The extracts were analyzed on a Waters Q-Tof Premier mass spectrometer combined
CH:CHROMATOGRAPHY_SUMMARY        	with an Acquity Ultra Performance LCTM. The column (at 50 °C) was an Acquity
CH:CHROMATOGRAPHY_SUMMARY        	UPLCTM BEH C18 2.1 × 100 mm with 1.7 µm particles. The solvent system included
CH:CHROMATOGRAPHY_SUMMARY        	A. ultrapure water (1% 1 M NH4Ac, 0.1% HCOOH) and B. LC/MS grade
CH:CHROMATOGRAPHY_SUMMARY        	acetonitrile/isopropanol (1:1, 1% 1M NH4Ac, 0.1% HCOOH). The gradient started
CH:CHROMATOGRAPHY_SUMMARY        	from 65% A / 35% B, reached 80% B in 2 min, 100% B in 7 min and remained there
CH:CHROMATOGRAPHY_SUMMARY        	for 7 min. The flow rate was 0.400 ml/min and the injected amount was 2.0 µL
CH:CHROMATOGRAPHY_SUMMARY        	(Acquity Sample Organizer, at 10 °C). Reserpine was used as the lock spray
CH:CHROMATOGRAPHY_SUMMARY        	reference compound. The lipid profiling was carried out using electrospray
CH:CHROMATOGRAPHY_SUMMARY        	ionization mode and the data were collected at a mass range of m/z 300-1200 with
CH:CHROMATOGRAPHY_SUMMARY        	a scan duration of 0.2 sec.
CH:INSTRUMENT_NAME               	Agilent 6545 LC/QTOF
CH:COLUMN_NAME                   	Acquity UPLC BEH C18
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Agilent 6545 LC/QTOF
MS:INSTRUMENT_TYPE               	GC-TOF
MS:MS_TYPE                       	ESI
MS:MS_COMMENTS                   	The data processing included alignment of peaks, peak integration, normalization
MS:MS_COMMENTS                   	and identification. Lipids were identified using an internal spectral library.
MS:MS_COMMENTS                   	The data were normalized using one or more internal standards representative of
MS:MS_COMMENTS                   	each class of lipid present in the samples: the intensity of each identified
MS:MS_COMMENTS                   	lipid was normalized by dividing it with the intensity of its corresponding
MS:MS_COMMENTS                   	standard and multiplying it by the concentration of the standard. All monoacyl
MS:MS_COMMENTS                   	lipids except cholesterol esters, such as monoacylglycerols and
MS:MS_COMMENTS                   	monoacylglycerophospholipids, were normalized with PC(17:0/0:0), all diacyl
MS:MS_COMMENTS                   	lipids except ethanolamine phospholipids were normalized with PC(17:0/17:0), all
MS:MS_COMMENTS                   	ceramides with Cer(d18:1/17:0), all diacyl ethanolamine phospholipids with
MS:MS_COMMENTS                   	PE(17:0/17:0), and TG and cholesterol esters with TG(17:0/17:0/17:0). Other
MS:MS_COMMENTS                   	(unidentified) molecular species were normalized with PC(17:0/0:0) for retention
MS:MS_COMMENTS                   	times < 300 s, PC(17:0/17:0) for a retention time between 300 s and 410 s,
MS:MS_COMMENTS                   	and TG(17:0/17:0/17:0) for longer retention times. Quality control of the method
MS:MS_COMMENTS                   	showed that the day-to-day repeatability of control serum samples, and the
MS:MS_COMMENTS                   	relative standard deviation (RSD) for values identified was on average below 25%
MS:MS_COMMENTS                   	and 20% for discovery and validation sECs, respectively. The internal standards
MS:MS_COMMENTS                   	added to all samples in the study had an average RSD of 25% and 13 % in the
MS:MS_COMMENTS                   	discovery and validation sECs.
MS:ION_MODE                      	UNSPECIFIED
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS         	Summarised value
MS_METABOLITE_DATA_START
Samples	0060_LC_20190903_sample_0031	0060_LC_20190903_sample_0038	0060_LC_20190903_sample_0030	0060_LC_20190903_sample_0009	0060_LC_20190903_sample_0012	0060_LC_20190903_sample_0021	0060_LC_20190903_sample_0011	0060_LC_20190903_sample_0029	0060_LC_20190903_sample_0002	0060_LC_20190903_sample_0008	0060_LC_20190903_sample_0016	0060_LC_20190903_sample_0006	0060_LC_20190903_sample_0025	0060_LC_20190903_sample_0022	0060_LC_20190903_sample_0033	0060_LC_20190903_sample_0036	0060_LC_20190903_sample_0034	0060_LC_20190903_sample_0017	0060_LC_20190903_sample_0032	0060_LC_20190903_sample_0027	0060_LC_20190903_sample_0028	0060_LC_20190903_sample_0026	0060_LC_20190903_sample_0041	0060_LC_20190903_sample_0035	0060_LC_20190903_sample_0018	0060_LC_20190903_sample_0007	0060_LC_20190903_sample_0010	0060_LC_20190903_sample_0004	0060_LC_20190903_sample_0040	0060_LC_20190903_sample_0023	0060_LC_20190903_sample_0014	0060_LC_20190903_sample_0015	0060_LC_20190903_sample_0039	0060_LC_20190903_sample_0003	0060_LC_20190903_sample_0013	0060_LC_20190903_sample_0005	0060_LC_20190903_sample_0001	0060_LC_20190903_sample_0020	0060_LC_20190903_sample_0037	0060_LC_20190903_sample_0024	0060_LC_20190903_sample_0019
Factors	Cohort:2 | Mouse:10 | Sex:Female | Genotype:KO | Ear Mark:1x Rt | Treatment:PFOA	Cohort:2 | Mouse:11 | Sex:Male | Genotype:KO | Ear Mark:1x Lt | Treatment:Vh	Cohort:2 | Mouse:12 | Sex:Male | Genotype:hPPARa | Ear Mark:None | Treatment:Vh	Cohort:2 | Mouse:13 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:PFOA	Cohort:2 | Mouse:8 | Sex:Female | Genotype:KO | Ear Mark:1x Lt | Treatment:Vh	Cohort:2 | Mouse:9 | Sex:Female | Genotype:hPPARa | Ear Mark:None | Treatment:PFOA	Cohort:3 | Mouse:14 | Sex:Male | Genotype:KO | Ear Mark:None | Treatment:Vh	Cohort:3 | Mouse:15 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:Vh	Cohort:3 | Mouse:16 | Sex:Female | Genotype:hPPARa | Ear Mark:None | Treatment:Vh	Cohort:3 | Mouse:17 | Sex:Female | Genotype:KO | Ear Mark:1x Rt | Treatment:Vh	Cohort:3 | Mouse:18 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:Vh	Cohort:3 | Mouse:19 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Bt | Treatment:Vh	Cohort:4 | Mouse:20 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:PFOA	Cohort:4 | Mouse:21 | Sex:Male | Genotype:KO | Ear Mark:2x Rt | Treatment:PFOA	Cohort:4 | Mouse:22 | Sex:Female | Genotype:KO | Ear Mark:1x Lt | Treatment:PFOA	Cohort:5 | Mouse:23 | Sex:Female | Genotype:KO | Ear Mark:None | Treatment:PFOA	Cohort:5 | Mouse:24 | Sex:Female | Genotype:KO | Ear Mark:1x Rt | Treatment:PFOA	Cohort:5 | Mouse:25 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:PFOA	Cohort:5 | Mouse:26 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Bt | Treatment:PFOA	Cohort:5 | Mouse:27 | Sex:Male | Genotype:KO | Ear Mark:None | Treatment:PFOA	Cohort:5 | Mouse:28 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:PFOA	Cohort:5 | Mouse:29 | Sex:Male | Genotype:KO | Ear Mark:1x Lt | Treatment:PFOA	Cohort:6 | Mouse:30 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:Vh	Cohort:6 | Mouse:31 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:Vh	Cohort:6 | Mouse:32 | Sex:Male | Genotype:KO | Ear Mark:1x Bt | Treatment:Vh	Cohort:6 | Mouse:33 | Sex:Female | Genotype:KO | Ear Mark:None | Treatment:Vh	Cohort:6 | Mouse:34 | Sex:Female | Genotype:KO | Ear Mark:1x Rt | Treatment:Vh	Cohort:6 | Mouse:35 | Sex:Female | Genotype:KO | Ear Mark:1x Lt | Treatment:Vh	Cohort:6 | Mouse:36 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Bt | Treatment:Vh	Cohort:6 | Mouse:37 | Sex:Male | Genotype:hPPARa | Ear Mark:None | Treatment:PFOA	Cohort:7 | Mouse:38 | Sex:Male | Genotype:hPPARa | Ear Mark:None | Treatment:Vh	Cohort:7 | Mouse:39 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:Vh	Cohort:7 | Mouse:40 | Sex:Male | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:Vh	Cohort:7 | Mouse:41 | Sex:Male | Genotype:KO | Ear Mark:1x Bt | Treatment:Vh	Cohort:7 | Mouse:42 | Sex:Female | Genotype:hPPARa | Ear Mark:None | Treatment:PFOA	Cohort:8 | Mouse:43 | Sex:Male | Genotype:hPPARa | Ear Mark:None | Treatment:PFOA	Cohort:8 | Mouse:44 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Lt | Treatment:PFOA	Cohort:8 | Mouse:45 | Sex:Female | Genotype:KO | Ear Mark:1x Bt | Treatment:PFOA	Cohort:8 | Mouse:46 | Sex:Female | Genotype:hPPARa | Ear Mark:2x Rt | Treatment:PFOA	Cohort:8 | Mouse:47 | Sex:Female | Genotype:hPPARa | Ear Mark:None | Treatment:Vh	Cohort:8 | Mouse:48 | Sex:Female | Genotype:hPPARa | Ear Mark:1x Rt | Treatment:Vh	
100.PC(38:5)	4134.9924	1166.4830	2068.6562	1860.3959	1586.2965	3386.8382	1994.1589	9.8232	3004.6615	1787.8991	2186.7210	1963.3277	2829.9061	3501.7056	2073.7201	3017.6637	3050.2041	2786.4077	3071.2577	2777.1645	3211.4653	1993.0206	17.3717	1881.6847	1931.6460	1379.8485	1949.6567	1550.2835	1773.2055	2767.3988	1374.8201	1951.1348	1737.4754	1555.7612	2489.7319	3016.9431	3462.8469	2061.5021	3289.6832	1962.0642	2413.4042
101.PC(38:5)	6978.4913	3664.4122	7733.3640	6976.0792	6281.0405	9705.8020	5489.2506	7871.0876	10677.9118	6546.3771	7469.0848	8124.5984	7156.9641	4919.7076	3532.7130	4878.3430	5665.7386	8037.8067	8840.9994	4915.8416	6855.7214	4127.9936	5243.9834	6348.8601	5618.4373	2806.0859	7491.9904	5450.6509	5972.7867	8060.9552	4688.1961	7323.4525	5603.0411	5222.8633	6780.8671	9798.3977	9667.2277	5018.6915	7339.9148	7330.3395	6478.6833
102.PC(38:5)	4870.3776	2244.0747	789.5060	355.2573	3319.3057	3278.3495	392.1671	3978.5397	1124.4794	529.8989	1148.3676	670.4990	855.1723	970.2327	2373.5040	3663.1012	3836.9880	951.8639	3713.4218	825.0009	3171.0804	2452.6774	421.1616	3526.7266	3096.1161	2989.1046	3457.8866	2864.4763	623.8748	3092.0151	1280.6249	1160.0507	946.5585	523.2705	650.6207	1109.9449	498.0065	2846.6223	778.3774	767.0111	735.7826
103.PC(38:6)	1041.7511	535.8831	1737.4487	654.6275	832.0307	1641.5991	1257.6628	1999.5793	1582.5506	838.6688	1472.7110	1094.6998	847.2156	852.1481	460.0359	711.0686	795.4789	1027.6364	1278.8434	687.3929	850.8264	533.9861	843.6824	1317.1524	1224.6752	485.8979	1091.3558	609.1098	799.9907	1035.9905	1057.3768	1738.2328	1244.8037	877.1636	751.5836	1150.6193	914.4492	585.7567	979.9165	1065.1568	1107.1418
104.PC(38:6)	24933.8714	7775.4639	12827.9486	10396.5663	10802.4428	17834.1364	12424.6245	14860.0719	18023.1499	11921.0743	13030.6385	12344.2198	16134.8725	20839.9571	13809.2602	18733.7909	19140.9886	15250.9958	18096.8503	17732.9544	18400.2560	13330.1689	11945.3499	11224.6812	11576.0001	9365.9748	12820.5941	10475.3880	11376.1701	15129.2804	8277.7803	10942.1798	10918.9115	10531.3830	13816.9198	16702.1300	21169.0030	13973.5630	18296.4225	12330.9303	15282.7637
105.PC(38:6)	27055.1067	90.8554	179.8066	10986.6175	108.7153	19762.0608	212.4656	171.6640	173.3122	115.7272	153.3482	13348.8309	101.4109	123.6334	49.0136	86.6846	20906.2559	16752.6884	20238.3330	74.9476	108.1635	69.9638	131.5349	194.7939	161.7277	77.7297	13758.7948	78.2102	98.3089	111.4915	107.8339	137.5696	74.6890	124.0602	102.7893	18383.4882	22058.6067	14530.6566	20152.6343	125.7373	122.1266
106.PC(39:6)	476.2970	141.3693	182.9676	85.4363	234.6312	175.0566	261.1665	292.1803	331.0841	276.6744	299.8440	260.3341	180.3180	470.5237	257.9333	427.5964	371.3744	198.7341	242.9084	391.1494	230.9599	289.8850	195.2036	203.9791	274.7206	216.1004	280.0665	249.0113	232.1957	150.8784	190.5625	209.5520	231.2103	244.0137	189.6977	154.6701	279.2272	244.4388	219.1559	218.0363	235.4201
107.PC(39:6)	150.9104	74.4237	133.7878	63.4736	99.8403	167.1033	100.8319	149.3912	192.5940	115.1567	155.7824	153.3208	107.5790	143.5550	91.8405	134.8482	122.1208	127.2035	137.6361	124.8215	127.3287	83.2737	88.9462	110.2272	106.1793	96.5745	138.5788	126.7577	118.1070	134.7030	141.8100	149.6100	114.9039	110.9721	114.2424	138.1985	143.6394	63.5898	140.9646	146.5322	123.9396
108.PC(40:4)	95.8848	89.5883	121.7463	20.7777	43.5861	61.0503	132.1797	197.1797	71.9291	44.8698	36.7464	29.0865	88.1201	142.3907	36.7655	56.9967	78.9503	38.1846	38.1844	81.7679	64.9497	64.8523	110.2157	142.3337	188.4228	33.4516	52.4968	36.9474	26.9852	53.6624	61.8804	93.8869	80.9850	61.5591	22.6736	105.9145	28.5325	31.2816	30.8817	39.0442	35.3097
109.PC(40:4)	362.9360	73.4212	99.7784	125.3157	118.8830	145.8382	149.2018	140.3005	163.1033	155.6187	120.7641	114.1198	228.5538	345.7284	105.7474	256.5970	234.3604	120.6537	129.2809	214.9196	199.2797	119.0481	88.0399	96.8645	124.4256	101.7717	115.7960	94.8671	76.6032	140.6480	77.2690	113.1065	106.5617	142.9284	111.7160	208.3269	86.7799	158.2707	155.6544	105.6729	100.9077
10.CE(18:2)	4426.4301	3825.9419	4249.7148	4213.5949	4105.7525	2778.2199	5076.1785	8396.4181	5530.1735	4069.2099	19308.2144	6290.8760	2814.7506	4784.7869	6341.6122	3827.7572	4295.6307	3817.0292	5534.7562	3398.9066	3531.0621	4819.2886	5403.2587	5961.5281	4077.8030	3739.3199	3096.0192	3392.1203	9501.1800	3501.4024	7988.6984	8450.2934	17445.8028	5544.9479	3642.0491	2953.7780	7121.4519	5220.9815	3930.3396	4180.4321	9860.5748
110.PC(40:5)	286.9871	59.6243	211.0475	71.7817	204.0097	97.3334	118.9534	130.6926	394.3628	325.2435	555.6603	234.0961	149.3890	571.3732	149.1669	241.8902	322.1742	167.2668	152.4839	281.5995	168.9853	312.0548	240.5429	95.5759	149.1484	132.9327	161.0563	106.3769	186.9640	102.8946	367.2752	453.1646	83.6133	178.7913	95.2817	153.2397	94.8273	203.9180	105.0455	222.0496	99.6253
111.PC(40:5)	2083.5260	289.5458	406.2876	532.5364	303.6242	546.7982	739.6726	603.5135	674.1228	844.0522	613.0742	459.0757	785.1902	2117.5856	351.7867	1708.8672	1502.0869	516.6970	621.6625	1142.8338	658.5075	427.1713	892.8644	411.2390	535.2792	656.0896	1095.3005	265.3657	296.8820	1027.5046	295.1784	459.6951	390.1794	422.9550	907.5770	904.6040	520.6959	514.5052	683.3245	437.2527	346.6681
112.PC(40:6)	18709.0447	3595.8118	3807.3022	3314.5660	7026.5684	4427.2312	6913.8140	5965.8707	7908.1789	8392.9164	5374.9147	5286.1726	5541.1298	13893.6985	8513.7170	14305.2512	13927.7434	4880.1106	5962.4186	10785.3186	5299.7892	7756.5177	4754.5525	3421.0704	5282.7650	6445.5338	7615.9928	5985.6943	4192.2857	3208.7574	2850.0291	3364.0338	3871.8749	6144.5272	4784.9039	3862.2891	5711.2662	10319.9717	5553.0739	4283.1960	6303.8612
113.PC(40:6)	339.6440	42.1823	448.0686	549.4541	206.3325	603.4117	251.2995	457.8969	633.5624	191.4280	567.3730	472.6345	441.3141	84.9117	191.4763	271.3170	286.4222	176.7820	471.3159	51.6431	452.3764	191.7721	262.5871	377.1493	38.5527	170.4633	29.8694	201.8203	304.8057	541.6478	430.3695	376.5163	417.2057	252.6127	39.1289	680.6645	46.3758	202.4716	120.7304	380.9186	324.6342
114.PC(40:6)	92.4406	267.1473	646.0803	339.0139	354.5306	478.9077	51.1236	102.5758	921.8753	40.9775	802.5414	659.6857	184.0996	90.7420	37.9348	64.8944	46.6852	108.2343	143.0839	50.1459	222.3005	40.7531	58.6957	512.6624	445.3019	289.6419	33.2484	314.8494	437.2834	306.6883	540.5177	752.0618	552.6297	59.9313	142.6124	269.0833	835.1696	324.9173	199.2824	518.4621	485.3036
115.PC(40:6)	824.4042	327.6179	820.8056	978.7654	451.8911	1357.8452	22.0668	848.4526	1185.8549	458.7623	976.4897	873.6759	930.5605	627.6237	417.5925	620.3301	655.3445	35.3667	587.6605	580.0544	961.8857	418.7122	532.7465	651.2870	552.4893	356.4829	20.7153	390.0382	21.1398	1078.7393	196.8890	884.8227	665.3695	475.9346	875.0053	1269.5459	1095.0833	268.2078	1011.6693	715.3263	708.6356
116.PC(40:7)	3325.7363	883.8374	2526.9414	2786.6224	1690.5189	5143.5814	1856.1155	2658.6427	3862.4837	1851.5656	2855.5490	2737.2378	3288.7950	2326.9678	1557.4774	2354.7212	2516.1166	3672.7330	3948.4357	2188.6336	3458.8948	1541.2008	1835.2289	1878.1489	1635.7529	1230.7960	1957.0877	1307.5759	2066.6349	3589.3471	1336.4759	2063.5978	1725.3434	1480.9765	3248.6737	4058.1254	3808.9832	1730.4240	3914.9199	2326.3720	2639.1903
117.PC(40:7)	274.1120	82.6415	108.4123	212.8454	118.4225	148.6486	106.3849	121.4923	128.9746	121.7686	116.5594	146.1242	141.0783	201.7101	156.1639	203.6058	205.7494	123.5500	122.3682	143.4309	98.5897	112.9295	839.6016	92.5546	102.9650	99.7297	120.8674	109.3666	109.3960	116.5920	94.5608	105.8190	1088.1502	115.4511	118.4687	188.9299	320.8178	168.7927	124.6727	130.4210	90.6756
118.PC(40:7)	47.1949	29.2234	114.1470	56.1585	14.4262	123.6464	24.6470	124.9632	93.3485	14.3844	3156.9948	56.9697	83.4864	37.2858	21.2810	2664.0560	44.6329	99.0276	98.1412	2432.3419	82.5523	15.3901	38.5510	77.0882	57.9547	14.8168	45.2221	24.2389	43.7660	107.6802	44.5905	2377.9076	61.8836	28.7111	62.2130	98.8470	61.7384	19.4744	94.5071	60.4122	53.3192
119.PC(40:8)	370.3502	185.4722	591.8476	202.8544	337.0990	441.4781	458.4428	646.6410	749.6104	437.7318	690.4734	562.3771	286.4314	276.0730	179.2207	291.0058	286.7791	382.2342	428.9457	234.3145	302.1998	168.3011	312.8283	397.0366	359.0892	250.1902	510.5240	309.4059	354.0194	318.9915	355.8936	434.9805	436.1223	340.7732	323.2457	306.6279	372.1152	154.1010	406.4357	397.0452	548.1757
11.CE(20:3)	462.0699	166.1792	378.6716	141.6781	326.9742	82.0627	363.7950	1006.5514	523.2260	405.4223	2047.4222	914.2914	346.7322	546.4481	464.3022	498.1698	646.7136	196.2605	411.8000	440.0151	405.2054	452.8039	455.3960	358.6050	237.7046	254.6654	209.5450	235.5209	838.7069	120.6672	1557.0207	715.7881	2211.1873	334.4069	193.1358	151.3552	286.1863	179.0000	200.7451	294.4648	885.0750
120.PC(40:8)	75.9763	55.3521	309.4916	99.3550	56.3993	205.7051	100.3549	119.4178	123.8879	164.2026	108.3032	188.6642	124.5448	37.8642	11.3772	123.8031	44.1202	211.2932	204.0407	124.1323	69.7461	12.8488	62.7304	105.2191	186.4956	3.8067	139.6155	104.8126	129.2650	85.0352	169.1274	204.4004	206.9128	136.4610	55.2942	72.1174	158.1167	42.4938	214.0481	69.7067	73.7708
121.PC(42:6)	15.4002	11.9502	9.8052	22.2675	8.3414	13.0209	11.7274	16.6858	17.2099	10.5760	34.9415	8.3380	18.8136	17.5445	8.4076	6.4351	11.2223	12.0089	18.5114	10.8733	23.2054	8.4943	8.7826	11.5039	16.1713	8.4616	11.9922	8.6527	4.3761	24.9901	14.7423	5.1798	6.9267	2.8020	7.5459	36.8965	24.8836	7.9280	20.9523	10.9370	10.0255
122.PC(42:6)	6.7388	6.7084	33.9447	2.9301	10.7915	49.6352	5.3518	18.8217	32.2010	9.6494	7.4797	3.6629	3.3428	15.2786	9.5563	15.7208	4.6345	4.9721	30.0498	14.4309	22.4214	9.5320	13.0733	2.6300	19.4817	6.2452	14.4634	7.0224	21.4594	3.0609	13.3870	3.3830	16.7712	1.3917	21.6674	33.7827	21.2768	6.6175	18.2041	11.1750	14.8098
123.PC(O-32:0)	136.8584	59.1040	77.3455	48.9350	100.2894	118.1591	116.2612	79.5816	200.2080	161.5983	80.5733	118.7400	65.8789	71.7944	30.3436	79.5080	67.8366	78.1152	92.6988	46.0826	60.6867	38.9326	79.0538	73.2147	73.2795	106.8243	115.5359	92.2360	80.2946	100.5255	34.6961	97.2640	59.5768	86.6097	60.5924	153.5537	96.5023	57.3305	113.9157	98.8738	114.1835
124.PC(O-34:2)	34.8281	17.4123	25.3646	18.2604	24.5888	38.9833	30.7940	32.4801	43.2115	21.7716	29.2257	30.0938	16.4883	20.0625	10.8043	17.1520	16.0065	22.9694	28.5342	14.3148	23.6381	14.1174	22.4072	36.9578	21.5089	25.3807	26.6244	18.7078	27.2488	25.8929	16.2385	34.1381	22.5371	23.9460	19.6656	36.4895	43.3227	21.8883	32.2256	31.9111	31.9958
125.PC(O-34:3) NH4 adduct	192.7019	424.1417	431.1707	83.6408	655.7130	200.1797	772.2034	420.1896	699.2683	662.1042	395.5007	417.1693	115.5144	212.7250	38.8484	234.5903	150.1285	170.6849	212.6683	131.6520	106.9622	118.3091	387.5490	336.4079	488.4103	549.8671	639.3398	430.3658	313.6713	123.3537	159.5164	283.0543	198.1417	625.5808	133.9422	158.6734	158.5308	162.5319	262.8683	482.3954	521.7841
126.PC(O-36:3)	27.7402	2.2775	17.2895	13.6593	11.9297	28.7091	14.6303	7.0131	26.2468	29.1277	19.0989	11.3097	8.1509	2.2607	6.3975	9.5779	11.0230	17.2804	12.7619	8.1316	3.8543	2.1258	4.3272	20.7120	6.0249	12.7504	19.9086	13.7680	15.2977	20.4118	10.7622	4.5569	14.8246	6.6945	12.2812	29.4421	24.8441	12.0673	24.2580	11.7175	16.3539
127.PC(O-38:5)	161.6975	93.1417	116.5154	11.9486	207.9299	81.7086	177.5561	142.2994	294.2298	288.9259	185.6656	180.9119	70.9832	86.7139	52.9392	111.4762	83.5542	70.3837	127.5525	74.6403	104.6902	51.3485	107.4742	143.5104	119.5369	164.5935	200.7337	171.0858	187.8211	65.1127	49.2129	154.1745	128.2837	127.3452	92.7770	122.5676	112.9706	128.2494	187.1860	233.6996	224.3047
128.PC(O-40:6)	23.2699	14.9535	12.4187	0.8656	32.0780	17.1760	26.2898	17.9811	40.0576	48.8509	26.4315	28.4157	4.4655	14.9123	9.9410	24.2468	18.9532	14.8176	19.3209	12.3711	10.6130	8.2966	13.8586	15.8699	15.7451	30.9319	32.7304	21.8369	20.4561	4.9023	8.0817	19.6371	13.6728	17.5793	13.9693	11.0443	21.7380	11.8185	11.4053	18.2205	26.6420
129.PC(P-18:0/22:6)	43.6103	19.9525	26.0271	15.1739	53.6193	25.2548	37.7767	26.1948	64.3841	71.5369	37.1250	54.9831	15.7221	21.8055	13.6247	34.6166	28.9297	23.5662	26.4293	17.2620	20.1147	19.0467	22.9294	22.7802	25.5262	44.3829	44.4630	46.4744	36.4475	14.3707	14.8483	25.2188	25.0874	32.0086	18.9688	19.8680	40.3701	25.4896	36.0107	36.8481	47.6715
12.CE(20:4)	167.0085	285.1097	228.9556	192.1545	190.0255	129.2373	290.7823	372.8709	334.8329	137.1352	613.6602	288.4145	53.0612	138.9187	303.7745	160.0680	166.0189	174.3835	215.9982	97.4172	75.4840	188.4896	102.4046	480.9220	271.0944	206.7127	220.1529	190.9112	560.9197	129.6379	210.0577	421.9691	516.1277	261.0478	165.0109	83.4239	322.5898	269.9724	166.3033	297.0916	468.4503
130.PE(16:0/18:1)	666.3063	350.8748	655.7325	792.0632	412.8587	997.1318	418.8456	641.3279	667.5310	470.4352	454.3998	387.4960	483.4782	783.2037	303.1851	393.0103	444.8170	549.2648	695.4070	580.4798	642.4814	423.1245	416.3719	565.9938	490.1383	349.4190	461.5350	469.3548	365.6623	984.5717	266.7513	847.5387	385.9464	326.0835	407.3111	1441.3821	777.2492	517.6514	634.6981	587.8693	496.0839
131.PE(34:0)	1578.8231	1307.6099	1397.3201	1087.2839	1418.2329	1617.1630	1663.4312	1305.4450	1442.5680	1390.4611	1076.8680	1039.8126	1476.1413	1745.7382	953.3700	1519.5578	1624.3970	1307.6316	1205.3279	1539.1234	1157.8307	1358.5192	1297.2143	1147.4116	1411.6144	1295.5896	1584.5005	1219.2108	1017.3564	1422.3066	792.6763	1185.0124	957.9473	1210.8616	1142.1358	1406.9501	893.8483	1525.8701	1290.2525	1260.2732	1416.0092
132.PE(34:2)	1907.0913	1956.2439	2189.5315	2606.2359	2073.0649	2353.6762	2305.1588	2508.6993	2226.6671	2364.1812	1712.0883	1438.9575	1853.8302	2401.0871	1157.3095	1612.7345	1416.0046	1599.5475	1748.2180	2016.9701	2379.8195	1907.4986	2183.8096	2737.1995	2532.8908	1909.1908	2001.4903	1995.3725	1488.9675	2154.3647	1126.3721	2158.3328	1851.5927	1689.6971	1617.9060	3076.5430	3143.5799	1783.3090	2015.7002	1951.0712	1833.5952
133.PE(36:4)	2934.1475	1487.5274	2337.1523	2484.2257	1704.6642	2756.2595	1607.5467	2499.8525	3056.7022	2043.4287	2156.3682	2037.9276	2656.7115	2755.3401	1736.6242	2360.2059	2509.9847	2491.7040	2835.1993	2128.4122	3004.4445	1588.7604	1952.5070	2131.9191	1912.8549	1642.3281	2182.9771	1916.9886	1833.3882	2816.1078	1681.7308	1901.5602	1926.8351	1436.1040	2114.2411	3386.1995	3843.1528	2092.9281	2781.4402	2061.4868	2299.7322
134.PE(36:4)	3057.8558	7.5444	2562.7390	39.1478	1896.7272	2982.1801	44.9368	7.2713	9.6345	106.0723	8.9315	2164.0380	84.8085	6.0849	3.7487	15.5830	2596.2269	2630.3024	17.3536	12.4543	3107.8455	102.0912	6.4032	2411.0456	2172.9441	49.8363	2381.0574	2126.6940	4.5066	17.5952	4.8111	6.7350	11.6237	46.5043	2229.4060	31.5485	39.3541	2205.8730	17.5369	2234.2946	25.1892
135.PE(38:4)	9978.8244	6277.6577	7330.3431	5659.5812	8083.1761	6162.6283	8899.7353	8804.0268	10631.7553	10746.4459	7967.8191	7805.2432	7494.4464	7836.0684	5526.5503	7744.2592	8086.9727	6206.1008	7488.6382	7015.0950	7053.9181	5680.2193	7271.1220	7780.3963	8522.7253	7757.5662	9720.8676	8262.3742	6762.3606	6415.2942	5570.0232	6532.5542	7447.9689	7956.8519	5471.0795	7710.8034	10056.5353	7312.7918	6883.2734	7033.4425	7524.3413
136.PE(38:4)	38.6062	6455.7976	132.9383	6474.2383	47.2172	107.1758	66.6169	104.5171	121.0772	71.2834	104.3279	84.3065	39.8873	28.3054	14.7193	7948.4374	18.1159	88.4339	66.7065	42.5702	66.6477	34.2046	71.1796	87.8294	56.5601	46.7462	68.4184	40.5654	6885.4692	153.3677	36.5415	145.1601	7618.8496	54.4310	69.5745	8735.7277	102.9052	18.4539	64.3288	109.7509	87.9384
137.PE(38:6)	127.5182	86.8057	154.0175	234.9497	134.3875	298.8064	110.2339	125.1782	195.8694	146.2014	116.6112	121.6182	93.0843	80.8217	50.8482	79.0950	104.2786	121.3439	98.4492	66.5831	102.7405	53.0348	99.9790	70.9141	102.6777	55.8872	87.7750	68.6379	89.0146	157.5460	52.1785	97.9852	75.3218	61.3233	172.4469	263.6921	227.2310	131.9236	154.2690	135.0913	146.8108
138.PE(38:6)	13694.2448	6113.5836	8150.9215	7956.5961	7455.4093	9491.4537	8190.1798	9294.7242	12020.0498	9325.4716	8339.2115	8637.5138	9321.5005	12740.1857	8352.6726	11442.5585	11603.6641	8582.8047	9831.4792	11012.3293	10365.3862	8741.1511	8246.4845	8039.7033	7944.4669	7727.7335	9201.5860	7934.6264	7523.5728	8674.6037	5446.9517	7517.3250	7628.1253	7357.8241	7901.0221	10590.1230	14347.9842	9234.8672	10118.6554	7800.8724	9641.4281
139.PE(O-16:0/22:6) or PE(P-18:0/20:5)	14.9061	17.9248	26.8852	7.3691	19.4904	21.5658	22.3741	25.0841	43.3318	36.7776	35.2407	32.4154	13.2678	16.0983	58.1751	16.4326	11.2742	11.0144	3.7516	115.3368	13.9705	9.3163	24.5087	32.9212	23.2427	25.1081	24.5736	19.4821	25.0385	16.5782	24.9602	35.9683	30.2587	33.7862	12.2041	19.7122	272.7205	4.6885	15.0417	33.2926	27.8007
13.CE(20:5)	256.3985	73.1404	136.2454	148.0068	93.4132	54.0892	108.8192	316.2377	214.0345	143.5541	809.1564	256.7923	308.5266	296.8525	321.3358	269.8972	364.7478	196.5274	250.5000	189.4421	271.3670	214.2291	161.4530	136.4151	89.6201	77.9302	85.7467	69.7761	306.8259	113.4920	444.3176	256.9155	773.9449	145.6429	188.1128	178.0398	217.4962	120.0562	217.6135	127.3019	295.1176
140.PE(O-16:0/22:6) or PE(P-18:0/20:5)	294.6680	199.8550	250.8874	98.0741	309.8467	252.5374	289.9234	251.3723	445.5873	378.3063	318.2147	433.0498	202.8220	216.7825	52.1333	252.0493	97.8841	128.5403	250.9702	191.9098	159.0828	89.0015	215.7845	150.4399	285.8024	361.0244	532.0219	4.8931	244.7983	271.5397	34.2941	92.2291	115.9669	367.3714	128.4775	359.0441	156.4976	235.1261	265.3088	282.0663	271.2040
141.PE(O-38:5) or PE(P-38:4)	135.0560	68.4821	103.8868	75.7900	89.8379	112.2990	104.6400	118.4214	189.6847	118.6610	119.6011	169.4270	92.7660	92.3443	43.0700	118.5530	79.8297	87.6413	125.1008	70.1987	97.3120	52.6996	91.9901	101.1572	86.8968	98.1581	101.6685	73.9444	99.2537	117.8405	72.8614	4.5053	85.7124	137.7895	85.8442	4.1382	3.4208	67.3483	138.0379	139.5285	121.2659
142.PE(O-38:5) or PE(P-38:4)	590.0047	378.9311	395.9118	127.4257	634.3901	306.5986	652.3093	413.4001	760.5468	764.5351	445.2784	551.3548	192.1724	418.5376	171.0704	456.2905	348.6421	255.5303	306.0689	261.1809	212.0439	187.8955	398.1131	390.4619	438.4359	601.6018	590.1352	467.9116	378.1771	236.8776	193.7456	314.9749	295.2066	612.9115	202.0977	281.3289	289.7837	295.9975	331.9597	499.6243	524.8030
143.PE(P-18:0/22:6)	79.5534	61.4517	65.8202	20.7318	114.7720	57.5712	94.8548	68.7563	136.5907	142.8453	101.4323	129.8006	33.9936	58.3527	40.3302	87.1771	64.8362	67.2171	64.5215	44.5718	48.2679	34.9440	63.3582	57.9424	66.2225	143.9435	124.6168	104.5025	87.7797	36.6134	46.2842	52.7464	59.1195	109.6646	51.8598	45.0327	90.7095	42.2642	59.5414	90.2229	94.4772
144.PI(18:0/20:4)	4.9365	1.2699	1.8735	45.0935	0.3809	76.3002	1.3399	5.1347	4.4500	0.8839	2.3694	2.1630	6.8878	1.3956	885.4855	1.3374	1093.2019	32.3284	917.4223	2.1550	4.6081	3.0721	3.9386	8.1003	0.5786	1.0155	0.4699	0.9919	1.1659	61.4344	2.8741	9.6741	5.1156	0.2965	691.3554	3.3934	28.2046	1.5478	14.8102	0.4547	1.3414
145.PI(18:0/20:4)	1408.5888	644.8872	695.4544	14.1469	793.1120	7.1750	734.7407	857.5638	1051.0065	898.9507	737.8221	810.3572	891.9038	1143.0443	885.4855	1088.8532	1093.2019	706.4109	917.4223	1099.7853	930.9184	1055.8171	650.1585	724.9986	730.7043	730.2429	846.4389	764.7533	714.7018	4.4806	606.3027	792.5842	713.3275	760.5355	688.9805	5.4079	1274.5214	1139.8881	857.8023	722.8534	833.8282
146.SM(d16:1/18:1) or SM(d18:2/16:0)	5.8376	7.3112	7.3926	3.2810	14.2318	5.6246	5.5415	9.9285	15.1544	11.9421	11.3460	13.2511	5.4840	4.7689	1.9401	3.9575	3.3990	6.8294	7.4671	3.9122	2.9250	2.4070	4.5637	5.2360	5.9652	13.7594	11.1442	9.7100	9.5452	3.8874	6.4502	9.4969	6.4885	3.8146	4.8660	6.1894	4.5690	5.3522	10.1039	8.7834	14.5659
147.SM(d18:0/16:0)	45.5485	33.3836	39.4369	27.8196	66.1016	49.6345	56.9398	49.5810	105.7196	94.2080	66.1604	81.9042	28.6194	45.1594	19.2842	62.5572	43.3213	37.6905	50.6376	35.6998	36.8659	27.6462	37.6954	87.6286	33.4436	75.5012	65.7292	57.7583	54.6197	33.4143	26.8787	37.9737	33.7483	63.6764	45.8479	33.4322	56.6868	33.4390	78.8137	60.1653	85.3580
148.SM(d18:1/24:0)	536.5409	992.7005	647.7325	186.0225	1906.3372	296.5445	2035.3361	784.7809	1342.9940	2197.0333	851.8705	572.4128	408.8508	1651.4637	172.0382	446.1674	952.2911	329.7235	407.3740	1102.9377	314.8902	933.8926	529.0168	880.8284	1456.1048	1657.6576	1931.8176	1558.7123	421.9596	404.5156	404.9511	1079.6576	541.9626	1758.2383	236.4299	440.5263	377.6639	577.6481	323.0450	916.2570	880.6426
149.SM(d18:1/24:0)	408.5480	18.3289	12.6999	70.5184	275.1386	22.6044	8.0276	43.2625	221.3311	348.2297	20.6059	15.6599	172.2505	500.6409	179.0477	311.1760	391.9914	106.0565	11.9181	328.3175	203.3909	25.5110	335.5200	249.0100	230.7949	292.3221	335.5597	281.2137	155.2374	184.8748	5.4393	200.2395	122.4300	305.5758	3.2550	176.2657	13.1447	237.2680	21.5156	297.3485	331.9086
14.Cer(d18:1/14:0)	5.7050	2.4449	3.8374	3.0048	5.0137	2.1682	4.4764	4.4372	6.6272	4.2269	4.6836	5.0409	3.0288	3.6281	3.7324	6.0764	3.4095	3.0133	5.6263	3.9992	3.6218	3.5331	4.4224	4.6422	4.2207	5.9589	5.8303	5.8922	3.7970	3.1306	6.0060	4.7260	4.7828	6.7612	4.0279	2.7001	8.7544	6.3562	4.7755	4.0390	5.7250
150.SM(d32:1)	6.9999	4.3619	8.8586	0.5857	13.4991	8.0200	8.5095	8.3912	17.8298	16.3769	14.4244	5.1192	3.3134	4.4222	0.4450	5.4412	1.6959	7.3997	9.8238	3.3809	5.0870	1.9577	2.5635	4.7817	5.9790	12.4701	11.9618	12.7729	8.3297	3.3067	6.2894	12.6811	2.8162	4.0559	5.0627	6.2391	5.9701	4.2855	8.7376	14.8458	17.0746
151.SM(d33:1)	23.4062	16.7084	34.5197	15.4344	56.9253	41.2648	27.7812	34.8026	110.8575	79.1323	83.8092	60.7144	19.9943	16.3316	9.9164	30.6751	18.9364	42.1880	56.9352	14.2496	26.9278	10.8043	22.0198	25.6119	25.8017	46.8365	31.0795	43.5481	46.4696	20.3005	14.3259	57.4864	34.0535	32.3041	33.6558	23.3960	54.3306	19.9483	39.6073	72.6088	79.1013
152.SM(d34:1)	525.5537	344.6357	505.8009	353.0118	852.3026	506.7441	482.0446	529.9919	1407.2913	1154.4982	1012.7152	1113.5724	312.3104	356.8047	230.7500	523.1561	377.8392	528.9512	729.5751	285.3601	364.2965	210.2248	420.9056	424.8524	435.1694	811.4201	959.6246	825.7678	730.2031	383.5343	425.0956	681.1526	493.7182	653.5905	519.2677	446.1802	907.2675	468.8630	769.1256	983.7105	1017.8107
153.SM(d34:1)	529.1077	3.1586	5.6052	357.7844	8.4366	515.7718	5.9131	5.5354	14.1721	10.6086	13.4433	9.5584	317.1030	2.8473	232.0540	1.8294	382.8067	4.4033	6.4904	288.3230	3.8979	213.0998	4.1584	4.9878	6.2960	6.3036	9.4677	6.2238	6.7809	387.1329	8.0060	14.9609	7.4024	7.4064	4.1759	4.5448	7.8366	3.5260	5.3314	12.3755	11.0496
154.SM(d35:1)	8.9065	9.1268	9.5433	15.3454	11.5000	9.2618	5.0545	8.7464	11.6366	4.5921	5.9228	13.7386	10.2351	10.5998	12.5826	13.2013	11.1909	2.6824	5.1081	12.1323	9.8952	11.0087	9.2307	10.3287	4.2851	13.8836	7.6984	14.2701	11.4868	7.2434	15.5082	12.2087	12.5312	12.9191	11.0789	8.7449	17.1284	13.5208	9.2572	10.8800	12.3259
155.SM(d36:0)	19.7155	17.1234	14.0158	2.3951	36.1449	8.3420	43.6781	18.5324	39.7410	53.7164	21.9483	30.0525	7.8207	19.1064	6.1422	22.7736	17.7457	10.6559	11.6950	12.2414	9.7666	12.0702	14.7167	49.6445	17.6107	40.1330	34.6800	31.9161	18.9527	6.7505	11.5761	12.1667	16.2960	38.0279	10.2878	8.3640	10.5146	13.6213	16.5500	21.1625	34.6714
156.SM(d36:1)	217.1435	187.2050	201.4202	75.8995	496.8068	128.4513	370.2808	213.3656	526.8016	663.0784	343.7159	384.4800	77.3833	192.6367	80.1201	258.6120	141.4255	136.0985	197.3551	118.3790	91.9750	84.6114	171.1710	170.4588	212.1367	436.4953	409.9589	371.7282	258.9726	100.7671	144.1310	243.2492	182.5712	450.4568	128.2201	120.4550	164.3398	260.7072	226.0161	358.9368	411.0799
157.SM(d36:2)	6.3090	5.1541	5.2211	2.9542	19.1335	3.2071	10.8801	3.3022	20.3639	24.2062	7.1779	12.9509	0.7533	3.9731	2.5981	3.9398	3.1454	2.2327	5.7187	1.7753	3.2083	3.1341	6.1614	3.2160	6.2451	8.6502	7.0783	9.9195	8.3415	0.3904	2.8052	6.8201	5.5548	14.9843	2.3269	2.3204	7.8880	3.5052	5.6058	13.1967	14.6160
158.SM(d38:2)	4.1605	12.6039	15.3768	0.5192	3.2467	5.1249	5.1522	14.9563	20.0638	20.1146	14.4099	17.5410	3.3209	5.9061	1.1821	9.3016	1.6828	5.3856	5.3969	3.2522	4.3778	3.3591	2.5822	9.3546	4.1383	15.1886	3.8097	5.5466	10.2913	3.2057	5.1083	12.0354	10.7937	19.6078	2.6018	5.8082	4.0238	3.5890	10.5175	17.9244	9.3567
159.SM(d39:1)	14.9088	49.5111	70.2101	1.2387	67.1735	17.9955	98.7907	75.6933	88.7269	74.5962	64.0771	44.3463	14.3269	6.3824	4.7441	11.5630	1.4714	17.9818	22.2369	7.4953	11.6853	8.2382	45.3823	63.5955	67.3712	54.6956	71.7855	48.1910	41.3060	8.5086	44.6095	73.5933	55.2126	73.8676	12.7972	10.1398	18.4516	11.1334	17.2920	56.9092	57.8339
15.Cer(d18:1/16:0)	165.8203	102.0699	92.2125	211.3928	95.0522	152.8489	86.2517	97.1939	161.2491	72.5998	130.4618	158.5629	155.9600	118.9276	118.3297	141.2272	117.2323	123.6513	191.6611	138.3585	166.5030	126.9013	128.4927	148.0313	103.8951	137.9560	107.6182	97.1934	133.7783	204.1855	124.6500	98.0110	113.2660	120.2455	187.3006	158.1752	426.5123	186.8042	238.4140	111.2890	118.7381
160.SM(d40:1)	0.9946	5.6576	1.8902	2.5261	2.4674	2.8603	3.6479	16.3044	1.9913	3.0681	3.3752	1.9637	1.0446	2.0380	0.5563	0.6648	0.4354	2.2981	2.2890	0.3964	0.9266	0.6104	1.4966	3.9722	7.4638	3.3859	12.5842	6.8365	4.8125	0.4121	1.4077	2.5079	3.9135	1.2889	2.9828	3.1233	0.7082	0.4199	2.5165	4.3665	1.3597
161.SM(d40:1)	777.7020	1697.3616	2172.2111	190.1092	2541.9377	726.7662	3511.4037	2635.9546	3096.8304	2413.9567	1983.0974	1558.2576	585.7984	751.9282	257.2824	649.4845	517.6383	721.6884	992.3509	432.5045	539.0581	352.2645	1875.5886	2332.2027	2660.3922	1866.5744	2356.1186	1518.7601	1307.1116	432.2301	1091.0072	1997.7862	1589.9747	2326.4527	497.9453	700.6772	616.7304	619.2809	786.7243	1985.2413	2012.9449
162.SM(d40:1)	17.6103	49.2963	37.5757	2.5666	272.6309	82.2774	53.9839	48.4574	186.8556	261.6751	132.8278	138.5819	14.2320	19.3042	46.0387	118.4639	92.8728	52.7814	14.1350	105.6740	13.1517	14.2616	212.0352	35.4967	40.2474	172.3726	252.9115	171.3767	25.8658	11.7068	12.2720	176.4904	23.5207	38.7154	7.4602	8.3461	8.8307	20.9579	87.7984	33.1275	46.6511
163.SM(d40:2)	20.8923	88.4751	153.8820	13.1751	87.4324	35.4593	106.9874	137.5866	123.0092	101.7873	61.7261	63.1057	29.9420	34.9253	6.0516	39.0907	21.0975	24.8557	33.2994	16.9040	23.4768	20.3548	83.5505	97.7822	111.7264	76.4384	98.8477	46.6185	44.9728	24.2719	43.9422	87.4361	64.1177	91.2893	21.3742	68.7353	20.1653	21.0642	28.0194	83.9571	94.9137
164.SM(d41:1)	157.7156	483.9301	426.6831	95.0523	1123.4511	288.6071	1053.8281	455.9688	1087.8719	1060.8347	665.0393	508.8508	125.6328	172.6725	52.0932	168.8519	113.6178	261.8804	308.7527	120.2255	169.3493	104.6380	276.6696	493.3355	608.0180	859.1449	1019.6336	648.6142	489.3462	172.0965	227.3539	651.3424	321.6096	670.1637	203.1539	230.0339	323.9265	181.1124	326.8722	654.6779	798.5607
165.SM(d41:1)	13.9533	423.4557	385.9805	2.2477	911.2149	22.0825	889.3221	26.6833	44.2344	942.3792	27.8515	23.8113	10.4676	162.4396	53.6017	187.0960	10.4548	232.7135	286.6711	151.2124	153.6657	8.9582	27.8569	416.6352	556.9399	714.2818	81.4733	65.6080	30.3198	158.7958	13.7867	570.3414	25.9182	630.6422	7.3771	10.6433	274.9997	13.9765	292.0798	50.6515	61.8393
166.SM(d41:2)	19.1347	19.7327	90.4617	22.8054	74.1042	43.9192	55.6292	78.2095	170.7052	90.4448	105.3627	82.6938	32.3725	14.7624	8.4453	23.0379	14.4397	47.3663	53.3265	15.0268	38.5801	10.2448	42.5249	56.8153	47.0429	43.4979	81.5440	56.9092	66.0403	25.2364	46.5100	139.8993	60.4268	53.8751	38.4255	53.8825	51.4312	16.3599	39.1056	62.6874	79.2633
167.SM(d42:1)	73.4997	34.2728	89.8690	38.2633	26.9595	23.6165	57.8182	85.5917	35.3628	44.8572	115.3967	106.8803	75.9844	1.9315	30.0272	43.5639	14.2536	88.2469	99.0189	11.6649	16.1666	28.2495	1.5914	79.1253	46.9161	28.0007	29.4770	21.8174	16.8194	78.2905	43.9494	3.9177	4.1290	57.1260	66.8365	19.8393	21.2764	8.8420	107.8108	5.8647	142.6552
168.SM(d42:1)	47.4373	21.2263	60.6884	40.8494	48.6920	180.0547	40.9549	58.5456	173.1821	131.4750	117.0431	99.8793	47.3513	21.7533	16.4960	43.9892	34.0221	90.9380	65.8448	41.7928	51.2466	16.7016	58.5594	76.4129	37.4368	134.7415	151.0793	59.8929	68.4629	46.2371	69.9621	181.3061	44.3006	43.8442	67.6429	151.8035	85.5328	47.4717	70.5887	81.0031	80.5667
169.SM(d42:2)	312.3854	152.5655	424.7445	502.9335	430.9813	531.0440	256.6245	400.1300	1236.6373	572.5578	748.5146	630.2835	315.1031	213.1053	141.5170	280.4637	248.5756	627.8819	453.3254	167.8939	327.4359	124.6169	260.8131	313.7185	250.8301	455.4233	508.7741	408.4005	469.8595	319.3508	276.7612	712.0177	311.4655	291.6211	429.8608	578.7576	559.1929	236.5041	465.0653	569.0884	551.1608
16.Cer(d18:1/22:0)	7.2600	6.5315	10.0276	1.6729	8.3992	6.5315	9.0622	10.8883	19.3778	7.6197	13.0205	11.1359	7.4634	6.4787	2.4410	5.8391	3.9574	5.3714	7.8825	3.3805	6.2760	2.1592	13.0561	13.2646	9.3171	8.0499	7.4962	6.3859	10.2332	5.2458	11.1519	9.2331	10.4313	6.6633	5.7050	5.6572	7.9758	5.7577	9.5001	10.6245	16.6732
170.SM(d42:3)	53.6295	37.9533	61.7473	37.1803	98.3551	39.2708	56.3744	49.8100	187.4255	131.6034	129.0137	114.0033	10.0222	44.2750	18.7536	36.8179	34.2514	42.9857	60.7788	28.3825	9.5944	8.3233	35.3749	59.4703	50.9663	107.1486	107.0189	84.5360	91.4820	44.8770	48.6251	116.7981	58.9637	65.2327	35.9023	41.7739	50.6248	40.1441	70.1037	75.1853	116.6288
171.TG(14:0/16:0/18:1)	1040.4711	1256.5465	477.6079	1345.0941	1107.6970	576.5042	596.6083	277.3706	634.4673	1863.4275	41.2181	2036.5777	1202.8594	1267.5080	553.1003	903.1078	1329.8896	429.3497	472.4551	855.6523	653.9422	509.4564	511.8118	112.3266	648.3401	1815.4211	1341.6028	1422.7961	153.9696	503.5709	145.4883	129.8795	47.3164	951.2659	590.0409	1234.4805	1356.0805	1019.0613	769.1735	402.2935	462.7750
172.TG(14:0/18:1/18:1)	7890.9298	8632.0590	2879.7098	11719.5452	6065.9294	6338.5568	4471.1451	1854.7300	3717.6640	8791.1060	357.6483	5670.7840	9258.1438	9366.6577	3737.3442	6293.3880	9014.0426	4118.5517	4349.8274	6728.6421	5752.7165	4082.6193	3556.5596	1034.6312	5363.9726	8671.4102	7611.0176	7217.1169	1269.0691	4846.7263	974.5651	985.9337	442.5154	5416.7743	4792.4806	10896.9168	11026.4306	7229.6933	5511.5254	2077.0349	2417.7526
173.TG(14:0/18:2/18:2)	1477.0853	2301.7256	662.6804	2358.9343	1811.7197	1718.5188	1128.7668	317.2353	885.4057	2412.6496	39.5720	1112.2001	1570.6726	1133.0785	846.7009	1124.3930	1688.5341	895.0562	899.8520	1363.2064	1061.5882	769.0921	853.8196	148.0074	988.4835	2793.1936	1696.6524	2625.2235	195.5169	1082.1648	71.1062	128.3724	110.3876	1605.6815	917.9894	2704.0644	2733.1480	1790.2068	1030.2230	497.1402	597.0415
174.TG(14:0/18:2/18:2)	93.7969	78.9761	21.0462	140.8662	120.7378	59.6779	900.9886	13.2584	33.8609	199.6412	22.9845	19.7561	133.9613	85.4747	39.4819	91.8618	114.0728	50.4383	58.6599	70.9577	101.5830	36.5263	17.7347	9.8374	726.2528	164.4274	111.8174	151.8741	9.0086	60.5466	4.7648	3.1704	5.0542	94.2189	46.1609	195.6047	88.3498	1216.0169	58.9266	18.9561	25.3747
175.TG(16:0/16:0/16:0)	565.2520	539.0612	147.1404	355.6769	469.9601	134.6323	315.8659	78.1632	176.8137	778.3012	22.4774	1058.7544	376.4214	780.4162	349.8974	473.1313	697.3618	121.0354	156.0553	449.7899	254.1617	473.4259	145.9146	46.5314	335.7940	675.0724	514.5128	596.4414	35.3019	135.0114	40.3610	42.4036	15.1795	712.1292	179.6925	260.3733	332.3530	527.7588	258.9831	172.6740	127.5078
176.TG(16:0/18:0/18:1)	5021.9721	4616.6244	1354.1093	3321.0163	3336.3308	1608.1524	3116.9398	930.9018	1670.9936	4843.7474	177.4633	2851.2660	3324.8812	6256.3040	2776.8374	3906.0398	5844.8778	1504.0708	1794.7884	4233.5372	2373.2214	2419.8028	1442.5164	491.6383	3725.2943	3948.8639	4403.5174	3776.0420	512.3792	1352.2978	345.9624	304.4195	174.0679	3729.8413	1722.3841	2672.5184	3069.0478	4827.8282	1968.2793	821.7250	1086.4189
177.TG(16:0/18:2/12:0)	83.8800	233.3146	50.2086	163.3855	231.4714	75.8399	116.4092	18.0527	76.7479	406.0950	2.8268	436.2777	100.3452	60.2923	51.7551	100.5992	119.7435	38.8889	36.7084	81.2397	47.8470	50.3232	77.4686	10.0392	90.5244	388.1617	225.1931	324.5484	11.6409	47.8012	8.5165	11.0622	6.7109	170.3688	50.0699	137.5456	136.2596	131.1608	70.9666	47.0712	46.4654
178.TG(16:0/18:2/18:2)	14812.0086	18457.6180	5395.8908	9982.9093	11251.0146	10543.3550	11294.2974	3774.2695	6695.6215	15277.8327	724.7238	4790.5425	9873.6366	17704.9381	8074.9575	13405.5433	16034.0654	6302.6702	6601.9905	15248.0179	10293.9533	7230.3504	6307.5233	2477.0197	14053.6123	14915.5498	15284.4993	14299.0068	2781.6516	7573.8704	1419.3421	1856.3697	1954.6616	11678.7743	6525.9021	14723.1793	17128.2824	12750.9832	6221.4796	3640.8297	3856.9965
179.TG(16:0/18:2/18:2)	215.4432	286.8281	1946.6149	4073.2153	259.6764	3040.7590	180.7819	45.9733	2648.4422	312.5552	11.0697	45.1514	3621.9560	323.7226	147.8212	162.0685	158.3985	2799.5934	2800.3752	311.5526	136.1208	3138.4722	3492.6520	37.9637	202.7876	277.9090	217.5138	252.1581	24.0017	2375.9799	18.6304	24.8339	19.9963	230.6080	2186.7221	4693.6703	11.9049	147.5097	2219.9462	37.2254	54.1220
17.Cer(d18:1/22:0)	283.6008	590.1086	212.4556	116.0640	283.5033	124.3088	500.0381	250.4641	126.8277	128.8030	119.4361	82.8102	147.4673	379.3507	117.6447	208.8960	147.5243	88.2549	119.7158	293.6934	157.9310	454.5793	359.6116	379.4588	596.6078	270.9650	237.5966	193.4766	104.1652	112.8486	169.0390	135.5032	184.8451	386.6954	97.2682	115.1252	161.1762	267.4955	143.0806	101.9317	132.3844
180.TG(16:0/18:2/18:3)	3381.0306	6776.0521	1830.7240	3819.1074	3980.5479	3873.5358	2904.7488	1022.5913	2397.7415	2846.6199	86.0854	1468.5167	2351.7897	3793.0678	2955.2888	3594.6849	5957.5332	2715.5822	1888.3003	4868.2552	3455.1602	3030.4996	1531.5329	392.2890	2440.9164	5756.5416	4033.8547	5565.1220	557.2786	2509.0100	172.6071	322.2979	358.1833	4236.1485	2199.5752	5606.3569	6351.1478	4757.8397	2466.4407	607.1567	1517.6483
181.TG(16:0/18:2/22:6)	1740.0730	2962.5498	644.0912	120.2811	2432.9289	253.3589	2457.9335	555.0575	392.9532	3916.4962	39.8580	90.7929	364.4692	5238.0402	1886.6182	2096.3716	1117.1930	312.3365	227.2737	4289.2580	1029.3102	1973.6769	1055.7666	431.8498	3281.3258	2007.3463	2596.4893	4602.1747	142.6688	625.7703	53.1053	136.4810	172.6737	2209.4961	166.6112	744.0222	402.5418	1814.3625	196.3999	388.9543	370.8131
182.TG(16:0/22:5/18:1) or TG(20:4/18:1/18:1)	2640.3886	4502.8066	1153.9946	429.6959	2488.1816	569.5807	3169.4419	911.7212	842.6374	2610.6794	169.1129	246.8565	757.0017	4880.6249	1931.6247	1637.1776	1629.7946	788.3246	758.0115	4218.7081	1707.3381	1900.2829	1784.4380	761.5430	4087.3964	2020.4263	2675.2506	2552.4294	390.3108	1648.2140	195.1705	408.4384	419.9646	3417.9782	425.0488	1699.8899	1343.3344	2755.5923	587.1189	703.6524	701.2011
183.TG(16:1/18:1/12:0)	107.0492	200.8902	54.9533	144.9553	193.7553	56.9470	88.3011	24.1092	78.5968	364.5713	4.6801	611.1819	105.7789	113.6467	56.1516	95.6450	128.8277	36.5855	40.0956	82.3495	48.0143	50.6181	64.5774	12.7383	75.1940	353.2599	208.3403	285.0852	18.5004	43.3596	16.6944	15.5957	8.2081	150.5016	60.4999	106.9377	140.5999	118.1684	80.3605	57.1590	58.5023
184.TG(18:0/18:0/18:0)	19.0442	98.8962	4.7442	7.9544	14.9023	2.5675	44.6228	3.8693	7.5869	19.9956	5.6814	7.4196	4.5219	59.8205	5.4784	6.2955	22.5522	4.1940	2.0391	20.9205	1.7225	51.9250	5.6236	3.5446	70.7290	14.8188	30.7010	12.9661	0.6137	1.0369	5.8089	10.6018	1.4385	26.9347	4.9098	7.7670	7.3380	12.6569	0.7254	0.6968	3.5042
185.TG(18:0/18:1/20:4)	989.1285	1488.1971	349.7684	147.0475	1116.6722	220.1068	1448.2029	304.5895	350.4537	1103.7376	60.7139	81.0501	266.7341	2181.6293	736.3865	765.3028	608.0134	303.4669	322.8889	2183.0699	678.9167	987.9406	636.8200	270.2756	1521.0557	940.2499	1174.4280	1067.9175	226.0306	430.2908	53.2612	121.0941	126.4362	1331.5142	162.5464	439.5211	573.1970	904.3589	198.9054	223.0854	322.9092
186.TG(18:0/18:1/20:4)	281.1313	4848.8941	142.0863	46.5144	335.6349	694.9728	376.2984	142.4741	773.8734	436.2870	39.4558	26.0101	117.9887	623.7269	167.2320	178.2175	192.6261	828.3005	772.7121	610.8939	324.1396	203.6425	265.0184	116.2411	684.4488	268.6696	389.1304	302.4844	62.0152	231.5752	70.3011	119.2894	101.2004	399.7142	300.0301	274.5909	927.6561	168.0751	33.3912	75.1607	583.8152
187.TG(18:1/12:0/18:1) or TG(18:2/16:0/14:0)	908.8901	1452.8234	425.2738	1681.4448	1279.4837	795.8151	717.1968	223.7873	599.3846	2156.9694	33.9570	1744.1718	1117.4632	1001.2316	440.8072	816.0728	1085.8691	418.8770	425.3790	767.8601	533.8222	449.1189	562.9509	113.0398	661.5396	2102.9375	1459.6082	1777.1593	161.4907	499.9372	108.5102	121.9987	71.9455	978.6888	579.3266	1593.2445	1436.7365	926.8393	686.4756	350.7685	412.6017
188.TG(18:1/18:1/16:0)	20110.0274	19640.0184	8250.8280	23016.1647	12532.0103	15252.9261	10971.8690	5727.6366	11669.3183	16912.2915	2270.7934	9932.8313	20172.5012	21035.5872	11026.3602	16524.4218	14604.9758	13465.3316	15392.7696	18343.0814	18079.3690	9815.6841	9197.2935	3485.3577	14610.2379	16327.2551	17610.1606	14258.7867	4276.3575	13871.5615	3771.8902	3613.6645	3023.4271	11667.4329	13064.1755	21310.6367	31356.7605	16101.1450	15228.6066	5319.9072	6112.7953
189.TG(18:1/18:1/18:1)	17519.2852	19810.7504	5798.2617	16299.7316	12262.0315	13558.0462	12210.7214	3835.5224	7427.5332	16527.1131	1648.5335	7213.1975	12502.1930	17097.1192	8845.6971	12897.7971	14629.1466	10432.6668	11026.0218	14273.0955	9452.3509	7571.5883	5457.1965	3339.4618	13877.1387	15245.0054	16855.9594	14248.1119	3569.9361	11138.5223	2250.3884	2749.6737	2050.0419	13070.7820	9386.5617	15197.8314	22707.1714	18579.5048	9936.9009	4441.9262	4414.4153
18.Cer(d18:1/23:0)	233.5566	257.9984	131.9719	75.5679	207.4934	114.8852	222.4911	103.4848	103.3704	136.7872	88.5206	56.4511	77.8355	236.6942	105.2706	211.3874	121.0558	72.5736	96.4825	255.7339	123.7426	381.2816	195.3522	167.2496	276.8974	263.6449	224.8817	181.6392	74.3087	117.6609	75.4727	106.7521	86.0048	288.8709	76.6954	102.3924	160.4581	282.6510	114.1502	96.5996	104.4124
190.TG(18:1/18:1/18:1)	1911.6013	111.6179	659.0964	60.4060	139.0412	499.9755	121.4603	316.6280	51.2701	172.7331	3.0653	765.0834	326.3469	89.5820	57.5501	1846.4609	1731.8910	77.3878	871.0392	35.9885	599.6066	1034.4331	874.7177	393.9461	3144.7227	141.4885	133.7781	151.9261	335.2735	893.9767	341.9698	409.7354	4.8943	177.9987	751.9106	120.9463	203.0045	135.0579	583.0913	342.6041	292.0359
191.TG(18:1/18:1/22:6)	1388.4514	2711.2264	713.1868	92.4311	2704.6032	180.8625	3610.5785	437.4993	413.2001	2498.9003	90.2453	114.3934	240.0023	1762.0048	1134.0240	803.9556	899.8603	262.8739	176.0154	1701.3967	421.7201	730.1709	776.0757	435.6319	5043.7733	2101.7978	2705.4439	2902.7600	150.9814	521.2948	42.3577	105.9354	97.5595	3274.1972	133.3904	440.2119	237.2229	1785.3679	125.8535	456.2800	336.6974
192.TG(18:1/18:2/18:2)	11125.2681	15970.8188	3774.9695	3328.9192	9538.6139	5069.6019	11339.9851	2327.8326	4010.9018	10656.2035	611.8849	2830.3220	3489.8315	14116.0903	6845.1837	9040.2301	10842.6109	3903.2844	4097.2735	11275.1291	4061.8148	6315.8323	4580.2149	2636.5629	13128.8428	11936.6069	12700.1462	12325.2037	1955.1114	4046.3004	801.1945	1347.3351	1415.3067	12407.6692	2883.7556	5308.4293	8230.8568	12339.3626	2871.3999	2762.0147	2418.7484
193.TG(18:1/18:2/18:2)	2060.7639	2464.2299	935.6186	628.4047	1940.3728	656.6239	1654.7770	783.1382	711.3363	2179.6331	107.6628	289.4077	1208.3048	3800.9560	1491.9540	1606.8172	1677.3988	894.7262	891.8993	3294.1178	2223.3398	1542.9558	1455.1614	447.0511	2206.4613	1761.3843	1906.0977	1904.4255	313.1042	1503.5673	167.7286	292.1959	281.3266	2093.9837	440.0454	2185.1012	1317.0259	1735.3307	658.7771	549.3461	671.6538
194.TG(18:2/18:1/16:0)	19837.7709	22738.4395	9352.5115	21057.1693	14025.9571	15293.8583	13948.7884	6464.3174	11397.2509	18522.6422	2132.2059	9633.7754	18273.5633	20762.6274	12544.8656	17007.8966	11475.8842	12919.6577	14875.1404	19031.0654	17550.9725	9956.0497	11784.3966	3987.7556	17822.2756	17963.8316	18560.5885	16576.1069	4552.2189	13463.6794	3482.5123	3731.7610	3401.5579	14596.1079	12154.8102	20928.9569	30206.6870	15806.2028	13974.2212	6060.7934	6909.9247
195.TG(18:2/18:1/18:1)	16073.8282	22638.4584	6155.3411	9605.8298	12633.8361	10541.9221	13906.6988	3790.0678	7166.2444	16650.8609	1543.8962	6104.1784	8748.5509	17936.0704	10144.8152	12755.8423	14850.0640	8516.9215	8954.5633	14574.7719	8417.8852	7462.8539	7210.3393	3706.0518	15682.7782	15494.5615	16686.5802	15209.5151	3374.8240	9112.3419	1942.5643	2639.2261	2350.9809	15064.0940	6879.0332	11373.1333	18040.0999	16294.0637	6975.4648	4549.7956	4323.5415
196.TG(18:2/18:1/18:1)	246.3052	497.9506	378.9981	427.5216	407.6751	380.2030	398.7929	58.8879	451.4918	452.1063	25.7224	41.0909	488.1142	543.7755	157.6396	177.6665	885.8835	461.5067	439.8305	463.3830	683.9704	246.7613	100.4333	51.5080	310.1918	433.6937	1442.7164	392.1929	39.9845	596.0766	152.6869	243.6582	33.4051	397.4204	267.1764	891.9726	760.0967	219.5898	279.1846	282.5917	79.4538
197.TG(18:2/18:2/18:2) or TG(18:3/18:2/18:1)	2568.0081	2618.8251	965.9911	571.2827	2223.7180	826.9010	1517.8363	703.0587	600.5732	2521.7457	65.5478	189.2665	1129.4793	3255.7199	1573.2351	1985.2773	2043.4102	781.1723	711.7441	3249.0122	2108.2195	1653.7996	1319.8132	1031.5129	2184.5905	2229.4602	2428.5573	2561.9095	186.4103	1436.3367	118.8069	229.0281	259.8296	2600.3584	405.6639	2529.7950	1099.1389	1935.7305	650.1252	536.2170	657.9064
198.TG(18:2/18:2/18:2) or TG(18:3/18:2/18:1)	4111.5891	9135.4987	1617.3903	975.6483	3150.9778	1577.3766	5774.9152	865.2753	1581.0253	1945.4302	101.1666	802.1550	1064.0352	6395.0748	3306.1784	3809.8076	4426.5511	1291.3685	1391.4138	5092.2302	1727.8031	2759.4007	3050.0731	1043.3544	3788.6073	5543.7684	5489.7250	6068.4377	551.2853	1523.5017	126.0578	304.0795	375.9459	6681.1613	865.1197	1788.6573	2772.0057	5083.5255	890.5487	1142.8738	1099.7905
199.TG(18:2/22:5/16:0)	1365.4478	2602.0237	567.7488	435.4993	2377.7630	183.9402	1984.1459	555.8256	303.4325	2540.3331	92.5488	81.5634	346.7041	6588.5722	911.9455	1021.6688	936.5003	263.0564	755.0459	2679.6017	1047.8490	2488.3965	1691.6767	344.4917	2959.8078	1898.4470	2411.9226	2265.3138	166.9453	1775.2698	147.8691	306.1471	299.5879	2211.8136	111.1764	695.8648	332.7366	1008.7214	147.8381	326.6169	305.5326
19.Cer(d18:1/24:0)	817.0865	265.3404	415.7520	316.5524	186.7859	402.3300	274.2338	333.3102	270.9459	112.1131	176.2249	126.1346	506.8682	888.6961	549.5943	671.3462	657.3083	228.0560	279.5234	714.0627	657.4309	1077.6295	505.0608	515.6147	373.5426	238.0391	234.1845	178.6910	171.5991	532.9183	178.4058	245.5781	208.6718	280.0316	209.3604	498.8740	337.4375	522.6053	327.7174	241.5968	321.5009
1.CE fragment	3242.0763	3522.8043	1098.6170	795.2292	4889.2406	493.7378	4755.7821	1459.3487	1519.6671	5142.0717	1737.4393	929.0261	967.7367	2848.5447	2043.8846	2993.2059	3483.4351	685.4139	948.5784	2336.6427	715.1583	3461.5385	1337.0031	2105.4558	3780.5161	4142.1095	3720.8654	3761.4080	1611.9489	413.3718	476.4188	1013.1578	921.6785	4427.0180	738.5911	536.4666	681.7161	3726.7878	982.6804	1304.3521	1376.6145
200.TG(18:2/22:5/16:0)	2272.6963	4083.9656	1024.7454	342.6305	2274.4336	556.3417	2323.4989	643.5084	677.9819	2183.8112	101.3282	187.3150	640.1959	7939.1278	2163.1296	3059.6298	1761.8026	614.5917	607.4900	3119.9167	1323.2471	1483.1823	2025.2596	1136.2924	3947.6712	1859.9534	1704.0533	2589.5198	201.4749	1351.5882	97.0728	223.9049	296.7729	3500.5867	319.0668	1496.2971	854.0485	3181.2630	479.9544	623.1337	577.9226
201.TG(18:2/22:5/16:0)	5148.5979	6622.5211	1967.5458	72.4446	5819.4002	862.0543	6640.2786	200.7029	1152.8620	5843.2430	19.2035	53.9157	140.1458	7953.9160	3706.9143	395.2611	3320.5958	1027.4866	115.6741	7061.3566	2694.7110	3171.8773	2025.2596	1137.8312	9454.6997	4863.9509	1036.5425	6312.1349	202.7430	2327.2214	30.8617	88.1794	88.2602	7387.0813	502.1597	275.5009	217.0266	416.6817	705.8424	191.0968	137.3167
202.TG(46:0)	63.4603	107.4921	27.8828	30.5013	96.6308	13.7148	55.7476	17.0381	33.5287	194.6255	9.3616	289.5020	31.2136	98.5083	41.7134	58.7500	87.6622	11.9413	15.5364	58.5924	19.5380	50.9153	23.1406	9.1400	55.2487	184.4071	114.7352	141.4744	12.0966	15.0373	17.7979	16.6974	8.4706	134.9411	19.1814	25.5472	44.8403	69.5475	32.3192	44.8602	29.7219
203.TG(47:1)	15.8501	34.0681	9.6135	8.6900	30.5949	11.3331	16.6195	5.6616	2.0399	53.6351	1.4107	55.7083	20.2155	22.0901	10.4953	18.4292	20.7506	2.8165	7.3510	16.6783	12.5363	9.8842	11.1453	1.5501	18.1729	28.6229	21.4384	44.7680	3.6190	9.2179	3.4745	2.9239	2.7072	26.7040	7.2133	22.8262	4.2436	13.8532	8.8055	7.7821	3.9573
204.TG(47:2)	20.8764	36.0183	11.5872	34.6906	46.3251	22.2437	16.1091	4.4462	15.3984	71.6263	0.9705	53.1449	28.5959	22.4669	10.8881	23.4161	29.5203	9.6428	8.5824	19.4929	13.2227	12.2953	9.8490	2.6484	15.3826	72.8796	45.1576	68.3097	2.3823	15.4336	1.1366	3.9930	2.5763	36.1468	11.5604	41.4201	36.0306	20.1023	16.9708	8.2565	9.5057
205.TG(48:0)	89.0152	78.2228	25.6312	59.5838	76.7254	20.4194	49.2538	18.5000	35.1229	126.8219	10.8476	195.9307	61.7078	122.3003	57.9296	75.4995	113.7478	19.8018	25.5897	70.9773	38.6501	82.6153	22.5467	12.4085	48.9970	117.4133	89.4086	91.6561	13.3154	21.6716	17.7351	12.8639	8.5518	112.1003	29.9455	38.6379	64.5160	83.3194	42.1007	39.9379	30.0411
206.TG(48:1)	178.7303	213.0362	84.8943	277.7204	199.4840	104.5015	107.5646	48.1389	114.5518	323.1221	11.4391	428.4196	217.3983	194.4235	97.2892	159.2644	227.4114	76.1992	83.9244	129.1597	117.8362	79.4458	89.4167	22.1009	112.7290	342.9739	251.6305	278.7597	27.5056	92.2286	38.6337	28.5209	17.5699	174.4241	119.6491	225.9424	253.1731	193.4656	147.1140	70.7522	79.0672
207.TG(48:3)	411.8957	768.8042	209.4562	796.4033	759.0820	433.0187	416.6877	87.5290	303.3792	1217.0591	15.2888	772.0317	440.7268	279.7411	223.4664	403.1295	474.6186	210.7179	208.0840	348.8158	249.2840	184.6389	277.7864	43.2682	306.4984	1204.7186	561.5020	1060.7189	60.4295	268.3732	27.9308	45.8958	33.7996	555.9047	259.0017	799.6507	718.5635	523.3302	308.4135	182.9032	204.2224
208.TG(49:0)	13.8450	22.4229	5.3315	10.7997	9.8236	1.6327	11.2917	2.1886	5.7246	20.9743	6.3799	17.4692	1.7450	26.4413	6.6927	9.8311	18.6020	2.9593	4.0135	16.5698	11.0479	20.9312	3.2381	6.2079	15.9077	16.9835	18.9458	14.6512	9.1216	4.1015	6.0881	6.6448	8.0082	17.1033	1.4919	6.0978	20.0883	12.1233	9.1418	5.6735	13.8638
209.TG(49:1)	114.2591	142.3468	33.2187	68.1097	110.0523	46.5827	67.6607	31.6771	32.1559	162.9788	8.7553	135.3108	93.8327	194.8139	52.5724	105.0311	163.5267	29.8194	32.8597	125.3959	63.3221	88.8207	49.3562	17.0883	93.2683	168.8461	153.4166	132.7648	22.6369	40.7318	25.7985	18.6483	20.1987	89.0419	36.8145	82.3141	95.4279	74.6339	42.6808	32.3680	40.3199
20.Cer(d18:1/24:1)	718.0280	386.1154	438.5513	651.7214	405.6921	741.7719	413.1250	458.1544	657.5963	254.5242	498.2832	363.4798	686.4539	536.0859	275.8550	474.0442	444.3018	574.3379	638.0567	469.5010	671.1192	409.0789	496.2910	639.5006	438.3948	465.2106	413.9386	304.5777	432.5734	690.5347	297.4434	493.2195	333.6499	379.4442	679.6347	707.6948	776.5389	637.5531	712.6804	406.2439	512.5573
210.TG(49:2)	203.0999	307.6986	119.0418	394.7243	254.1662	244.7745	157.7496	66.3161	156.6123	391.6716	7.4174	330.5226	297.4369	288.7150	120.0422	214.0901	280.4240	146.8711	147.3846	206.2715	171.2405	129.6135	144.0573	26.4764	178.8921	388.9139	307.8014	347.6704	32.9753	165.9359	26.4711	30.3064	19.0368	209.3014	172.3284	412.0693	480.6378	181.9764	210.1385	88.5242	98.9578
211.TG(49:3)	105.9355	83.6015	62.8180	175.8657	142.3958	151.4809	96.9658	26.2706	69.0780	221.4737	2.8806	99.2700	134.2543	105.3496	60.3829	125.9087	148.1535	60.6359	61.3246	101.8829	81.8274	58.8133	78.1607	11.2719	95.4665	223.1647	170.3941	226.6095	11.5106	86.0079	4.9401	10.0863	5.9814	133.5500	65.6040	240.4252	176.9957	114.6367	81.2542	40.6951	43.5831
212.TG(50:0)	873.8622	663.4115	122.0134	197.0175	546.8661	85.4983	474.5662	74.2074	175.0520	938.8449	47.6760	4.4923	286.5550	1317.2704	320.9437	657.8262	1180.4128	81.9377	101.6349	713.1529	145.6676	749.7243	116.1133	80.6283	492.8790	689.7020	694.2294	589.5416	48.8476	73.9009	21.5720	52.6084	25.7007	673.1355	101.1472	125.6748	150.6109	748.8969	153.5866	114.6801	111.9461
213.TG(50:0)	251.7338	284.7495	87.8415	221.9201	175.0682	181.3349	172.3405	62.2425	117.4211	230.5817	17.4474	91.3914	217.0672	297.4459	137.7299	220.5063	287.2786	139.8937	143.2922	257.2733	190.8433	141.6948	122.2752	36.5900	236.9420	229.5357	249.5935	217.4824	43.9012	136.4379	30.4031	35.9021	31.1469	180.2777	128.1139	266.9750	299.1345	214.8141	134.9073	57.5828	69.5022
214.TG(50:1)	281.0151	371.5336	96.4831	148.1940	221.1759	162.6708	242.3749	67.2497	120.3790	300.8357	9.6625	80.9024	168.5287	393.1813	139.2960	268.5990	326.3060	114.2169	101.0986	323.0257	172.9742	176.1054	155.4972	41.6633	290.4130	287.3383	316.4404	290.9657	46.2016	102.9400	19.3269	30.6857	28.4172	235.6588	100.2418	240.5643	270.0950	241.6410	94.8691	62.3135	78.8730
215.TG(50:1)	6793.1316	5909.7799	2190.4707	6879.4191	4175.8533	3227.9732	3015.6657	1599.8514	2744.0989	6198.4985	284.5187	4713.3355	6710.2496	8377.6944	3178.3190	5124.1708	8285.9106	2735.6650	2920.1941	5701.8459	4148.9245	3692.4153	2215.0807	810.2213	3933.0142	5837.0805	5541.5946	4711.5272	990.7809	2836.7038	868.1845	737.4953	433.6555	3975.3356	3034.4880	5890.6867	6682.9983	5803.1675	3573.3408	1516.0142	1911.6416
216.TG(50:2)	1428.5458	1617.6966	557.6217	2375.9906	1155.7927	1156.0441	876.6395	346.9827	730.3488	1724.0131	91.2424	1300.4703	1712.8529	1812.8032	744.8242	1176.4998	1714.5321	770.5146	792.2684	1205.9124	1005.6812	755.4808	665.7339	193.9720	1031.9957	1706.6771	1507.6306	1493.1139	234.7231	868.1701	209.1206	188.0978	148.1929	1095.4891	970.6900	2227.0511	2210.4711	1433.4150	1041.0263	392.2505	461.7644
217.TG(50:3)	4595.5623	5656.9590	1776.5571	7107.2544	4330.3023	4708.9121	2922.8643	999.4385	2302.4486	6343.3929	168.6633	3296.9376	5235.2211	4443.1543	2132.7355	3925.2203	5123.4863	2464.0259	2550.9700	3777.6766	3250.2832	2123.7073	2554.3438	557.4556	2986.8113	6412.1382	5256.0968	5890.5364	785.0333	2983.3050	444.5716	539.7114	390.8615	3574.6026	2839.6691	7847.5820	7208.0654	4663.7341	3102.3823	1323.0191	1561.5364
218.TG(50:3)	700.9765	771.9112	308.0434	1395.5541	634.9782	789.2987	410.2977	172.1416	424.7876	962.2223	36.8878	709.5263	882.3069	632.4985	361.2634	601.6343	807.2331	447.1674	442.8939	507.0856	522.0311	300.2251	405.7969	92.4827	401.4353	1026.0817	797.4850	942.8719	134.4162	488.2731	91.8318	94.2123	71.0970	542.9987	532.9004	1392.3064	1406.1892	732.6908	543.8518	227.2086	270.3720
219.TG(50:5)	535.8037	1119.1538	140.1461	191.3678	260.8146	205.1657	701.5120	38.6462	105.0299	496.8629	1.3438	2.9799	205.1606	35.1247	199.4772	557.9700	643.6881	74.5375	8.4461	77.3047	184.9230	60.6686	481.4150	9.5719	545.3941	442.4087	1046.6700	1467.1542	0.9062	142.7717	4.7162	4.0517	5.2131	895.1746	41.2462	452.7049	161.8425	700.2816	100.1051	81.7193	93.8614
21.Cer(d18:1/24:1)	6.7994	0.9579	1.9589	4.7273	3.7490	9.0145	0.8606	2.2502	4.4567	2.3181	6.9305	5.4935	6.7836	5.3997	4.8253	4.1141	4.8322	4.6875	5.1254	3.3535	5.2003	5.2776	2.5981	6.4156	0.6482	5.3992	3.0658	4.0599	5.5678	5.4410	0.9400	1.8053	2.2906	2.7979	6.0297	7.2066	10.8703	5.5697	8.0186	5.7168	6.5268
220.TG(51:1)	384.3234	365.0177	111.7673	161.1796	336.2786	89.2736	207.5714	103.9421	159.9547	504.3580	22.6770	343.6989	224.5289	795.5188	226.8215	576.7192	787.7051	96.3656	137.5918	587.2965	204.3984	359.4374	123.5704	47.1373	279.8909	391.4917	399.4292	338.3004	55.7080	75.3243	56.7311	37.7442	32.5089	299.3904	116.0358	134.7362	269.8655	254.5086	151.9122	71.3820	117.8656
221.TG(51:2)	401.8137	426.9071	231.4721	663.9998	294.3082	580.5651	234.0680	122.7101	381.9481	406.2680	24.5477	244.4574	519.2225	492.5495	190.9362	380.0664	537.7342	371.8075	367.4654	371.4716	357.2259	227.1502	214.1638	74.4820	337.3030	505.3642	552.5609	467.2793	98.6864	374.0305	48.6122	65.1231	33.0579	284.9020	409.4427	720.0570	1014.0774	409.5006	480.0043	197.5680	168.2767
222.TG(51:2)	1536.4371	1542.1406	788.3736	2142.9978	1075.5006	1743.1148	774.6771	498.7154	1205.1011	1484.9857	89.4888	963.1124	1867.1769	2041.4114	756.9908	1381.8846	2043.2686	1234.6775	1314.6810	1541.6303	1307.9183	930.8590	802.5073	205.9869	1065.0430	1631.0629	1649.1564	1414.4788	337.8659	1232.9388	191.4040	221.0160	145.9166	943.8654	1232.6325	2353.7625	3235.5241	1350.0164	1475.5279	565.0796	623.2790
223.TG(51:2)	9.3248	10.9704	6.2472	8.8320	12.7157	5.6977	4.5075	4.3041	10.6430	17.5156	0.4491	12.5071	10.8353	17.2444	6.7261	12.5843	16.4664	5.1918	5.8599	15.7306	8.3716	7.1719	5.5518	1.4500	9.2885	19.6062	17.3099	13.3357	1.3397	5.2003	4.0841	2.1829	1.1338	7.8843	7.3359	13.6275	10.4943	4.3890	6.7548	3.8531	5.2480
224.TG(51:3)	1105.4440	1279.8401	569.8988	1533.2462	835.9030	1282.9022	687.3121	357.9808	747.0293	1162.0635	35.3100	690.6157	1236.0402	1443.1341	722.2538	1166.1722	1513.3861	850.7724	883.7307	1132.1440	875.7426	681.1642	689.7140	169.2180	917.6618	1246.8246	1227.6392	1239.6880	204.7615	805.0225	88.4681	129.8701	93.9932	836.3399	819.2881	1609.0829	2324.9940	1012.1265	860.6621	391.7214	421.6968
225.TG(51:4)	363.2766	563.1881	179.2893	327.8755	313.9801	377.4750	329.2982	95.9395	185.9032	435.7609	6.7806	134.2714	318.0770	449.1834	245.6247	414.2698	533.3492	188.3641	208.3461	401.3603	266.0428	239.4036	227.3872	44.6889	393.2560	494.8254	400.8672	512.2126	36.5329	221.6854	17.2486	31.9897	25.3937	358.0389	167.1650	473.7790	435.0579	333.2352	191.7490	105.8017	111.3585
226.TG(52:0)	226.1428	368.3882	17.2652	13.1172	118.5179	5.4458	200.0750	10.0025	17.1756	208.8974	8.2986	20.2937	26.5097	530.8604	36.8924	97.3569	343.9679	6.0617	4.4919	197.5610	10.0782	370.4251	20.6191	14.2396	248.2823	124.4148	220.3846	103.5521	7.2297	3.4006	10.3832	11.3215	5.1571	152.6696	6.5692	15.5932	14.5717	197.4598	7.3333	8.4674	11.7946
227.TG(52:2)	4656.2455	4215.3494	1871.6979	6665.9458	2850.0937	3903.3018	2408.5121	1267.3353	2795.0661	3919.2867	461.4028	2386.2731	5333.0119	5343.0760	2445.8466	3754.0235	4112.2372	3454.9564	3474.5817	4319.3691	4229.8953	2327.2121	2070.8605	670.4139	3315.6868	3771.6918	4125.2538	3377.9343	916.6412	3281.3725	712.9101	665.1259	561.6479	2655.5364	3506.5636	6521.4578	7956.4773	4097.4012	3651.1714	1207.9652	1444.8627
228.TG(52:3)	4764.6338	5101.5842	2074.7628	5416.0284	3311.2873	3831.5830	3141.3553	1469.9321	2802.1184	4438.1612	430.1969	2356.2063	4570.3307	4849.0582	2821.2329	4144.2729	5331.3523	3117.9899	3281.6181	4706.6405	4067.7021	2535.9252	2654.7666	828.8674	4170.3200	4374.3918	4750.7934	4118.5493	1011.4302	3034.7025	684.7406	712.2843	638.5900	3423.4069	3025.0253	5827.2174	7408.6468	4129.5642	3117.2593	1379.6247	1648.0387
229.TG(52:4)	2853.7485	3233.0471	1054.1499	2649.1750	2086.2956	2180.0122	2038.9883	715.3056	1399.9713	2954.1482	155.6294	1096.1246	2259.7350	2780.1255	1611.4969	2660.1778	3344.6859	1559.6983	1550.9774	2912.1062	1988.5805	1527.1302	1176.1165	438.1997	2576.3673	3022.3676	3031.5617	2935.3571	513.8601	1459.8959	293.0058	339.5202	340.7991	2244.9921	1452.5906	3242.1836	3883.4960	2576.0435	1455.8945	712.4011	862.6278
22.Cer(d18:1/25:0)	6.1367	13.2823	5.6063	14.8670	5.7219	15.2949	5.8692	9.2611	19.0504	4.5249	18.4696	10.3012	4.4887	21.5623	5.8268	7.9915	5.9762	15.8617	17.3318	6.7882	10.9826	13.6352	22.3611	15.8436	7.1821	8.2372	7.5770	7.8556	15.1612	16.6516	11.3017	17.6476	10.5968	7.3871	15.6424	11.3465	43.3730	9.3549	19.1943	11.0447	15.5451
230.TG(52:4)	947.5725	1346.4737	10.9831	805.9080	839.6025		35.4598	12.8881	11.6491	1102.6856	3.7321	10.7256		1113.5823	20.9375	40.4366	1242.9985	468.0474	437.5884	63.4510	26.4757	626.1913	526.2562	8.2694	1023.9550	1171.3758	48.9016	61.1755	176.6830	372.5195	3.3497	6.8603	7.3311	45.6850				999.2500		219.2405	13.1955
231.TG(52:5)	930.7516	1094.3620	282.8967	878.1393	826.0506	756.5899	462.9430	196.8938	471.6580	1290.0102	37.5812	352.9599	683.0427	719.1910	504.4116	698.9506	1172.4878	540.1458	328.7687	954.9371	654.6682	540.3328	541.4195	117.2974	742.1357	1316.5645	1076.0757	1255.0823	40.5315	501.8349	83.8609	99.0302	20.5544	853.6753	486.2997	1152.3544	1512.4604	981.6165	408.5799	96.6824	81.1137
232.TG(52:6)	495.9210	2874.3281	347.2235	64.9296	1132.9808	107.6216	808.7108	44.5923	67.1038	3135.6534	4.6046	5.2130	110.2823	456.5007	184.8117	1452.2418	1692.0734	58.7013	62.9700	593.1792	228.8050	335.9318	1147.7115	29.2052	616.9890	3090.3024	2394.5852	1516.0938	12.7381	162.9808	0.7778	6.1924	21.3031	1095.4140	32.3272	433.3426	96.8342	1718.3292	192.0055	89.2132	96.6588
233.TG(52:6)	914.8746	1652.5632	183.8735	152.5457	931.4719	240.4602	957.2408	42.0034	45.1122	3178.8320	4.6046	54.5054	188.2314	1873.1846	389.1000	876.8567	1071.7006	73.6941	62.5468	1029.5289	244.2615	571.5460	716.8102	15.8636	787.4637	1437.3181	2419.7699	1516.5739	14.7902	158.8573	2.7231	8.2093	21.3031	1118.1485	67.3706	396.6784	170.5433	1213.4174	92.9933	72.9778	83.5289
234.TG(52:6)	403.8183	762.8802	109.6191	22.8701	756.2115	116.3528	62.0918	3.8173	34.5266	1233.6363	3.0723	9.4218	12.6424	493.6532	161.2996	35.5617	447.0790	69.9070	74.1283	62.2901	175.6864	235.2037	216.7510	2.4415	455.7536	1105.7474	814.9071	4.7155	3.2977	22.5813	3.4522	7.1726	7.8223	89.7845	10.4686	300.1749	38.4417	47.9237	7.1236	57.6769	66.4045
235.TG(53:2)	1846.4285	1818.6768	741.1922	1634.8161	1297.8422	1460.8750	1132.7455	384.6394	982.0663	1747.5609	25.7208	718.9925	1694.7128	2152.4846	900.7974	1658.8483	2171.0148	1211.9351	1193.1960	1916.5727	1417.6164	914.6803	736.2587	174.7659	1525.2261	1604.1419	1908.9930	1631.7929	134.1006	1147.9254	86.7351	105.0657	43.1058	1328.9067	1032.1079	2025.4453	2079.7432	1692.3021	1016.6149	420.8254	368.4910
236.TG(53:3)	1682.3934	2271.6328	884.8965	1534.4908	1297.4628	1712.9979	1322.8420	581.5188	1168.6201	1774.5124	104.5195	715.9393	1336.0573	2331.5445	977.6149	1539.3922	2066.1130	1324.0711	1274.3176	1857.8106	1143.4737	1001.1559	826.7006	354.6369	1860.0002	1813.7644	2140.3307	1772.1753	255.3851	1297.0772	191.2763	260.5436	171.4578	1493.2418	1057.3557	1886.8740	2869.9552	1855.4030	997.4570	644.0405	564.2600
237.TG(53:4)	824.3854	1235.5303	446.2186	666.2265	665.0623	830.2316	680.1152	261.0060	517.2483	920.9331	34.2658	376.2384	591.4511	1073.7186	557.3771	806.7483	1026.4211	590.7637	605.0316	904.6345	520.6089	509.5325	447.7846	169.4504	874.8557	946.9751	1007.1424	981.2560	161.5191	569.2415	68.4175	103.1561	77.6561	808.5994	483.4990	825.7983	1346.8419	921.3159	437.9480	299.4089	272.6394
238.TG(53:4)	73.2170	185.6001	34.0218	48.6824	6.8200	35.0368	8.7034	7.1243	10.9260	8.4741	6.3630	7.1861	60.4897	11.6841	42.9649	2.9423	96.5374	40.9372	35.5164	115.3024	54.4274	4.1551	48.2388	16.4119	8.1547	6.7075	7.9068	6.6764	3.6929	43.1883	11.7373	17.6315	9.4588	7.3124	38.1220	92.6463	94.6043	89.1259	34.0723	8.6154	24.3798
239.TG(53:5)	305.6951	336.7580	140.8514	162.3718	234.4387	231.0519	163.7602	72.9732	126.5187	319.3578	5.8033	73.3823	175.4364	436.6369	197.0692	276.8516	381.5118	136.8558	139.2532	310.7898	176.0179	183.1129	104.0756	54.3923	283.6659	342.1991	334.2111	398.7584	39.3079	167.6758	7.0489	24.4689	17.7715	298.6401	104.6911	254.1183	260.8877	189.2349	104.3619	85.8103	75.3367
23.Cer(d35:1)	1088.1468	1107.2604	1080.2817	1130.8538	1125.4232	1098.4385	1147.4597	1050.2797	1097.0594	1128.7195	1090.8335	1100.9183	1084.1823	1063.5215	1077.5836	1063.2197	1102.3487	1107.6603	1113.3990	1090.6892	1096.1662	1088.6489	1110.3981	1036.4610	1117.3283	1144.7532	1117.6775	1097.8483	1045.7034	1058.0144	1058.2206	1068.7914	1034.7273	1119.5352	1054.8220	1094.0814	1041.1156	1115.4797	1072.7473	1075.1365	971.6908
240.TG(53:5)	121.6855	259.8670	56.7653	68.9989	143.0637	74.0383	134.3361	27.5513	2.9920	189.8897	2.1146	30.3599	72.5338	182.6816	79.0168	136.6876	155.6764	2.7733	51.5322	175.9924	90.4023	12.5212	12.0305	23.5937	7.1624	2.7581	183.4488	183.0244	2.5910	78.6381	4.2659	6.1932	3.2279	19.3939	44.3770	2.7912	105.3986	135.1200	50.2121	37.2950	1.2067
241.TG(54:1)	2035.1161	3459.6006	527.7554	372.4058	1466.9539	175.2323	2053.7659	308.2743	240.1176	2057.5441	32.5285	247.5211	1019.3907	3202.3464	635.0481	1247.7983	2321.7967	139.5125	158.9966	1996.7076	341.2828	1187.8250	608.4098	281.4934	2780.4605	1737.4313	2326.0067	1689.7201	70.5819	144.7502	57.8321	64.5935	31.9019	1897.5552	148.8483	504.1414	188.3053	2392.8735	182.7698	135.5869	118.4592
242.TG(54:2)	8366.0015	10075.8988	3130.9188	6108.0756	5858.4605	4553.4002	6276.2951	2337.5673	3629.4785	8201.1220	656.1890	3914.2847	5953.6842	9045.5964	4290.9556	5936.9135	8555.5374	4067.9365	4008.5274	6577.8062	4635.6890	3664.7771	3043.5651	1611.2968	7710.8545	7224.8365	8878.8311	7161.2071	1549.5802	3990.8250	975.1076	1131.4727	779.5596	6694.0834	3604.1622	6775.0035	8698.2827	10618.1957	3626.6680	2171.7448	2139.2001
243.TG(54:3)	3995.0442	4444.1168	1424.8228	4144.0239	2991.8097	3469.5781	2992.5949	806.6946	1959.6641	4034.3220	374.1828	1773.8930	2850.3870	4103.9477	2137.5645	2940.2174	2911.7483	2714.4685	2589.0125	3226.4046	2173.5552	1736.0817	1325.5111	681.4420	3345.9177	3868.5745	4219.9512	3723.6870	704.4295	2680.1663	474.1046	510.3285	390.6460	3329.5860	2471.6420	3968.9324	6149.8844	5027.2259	2409.6762	1115.9182	994.1151
244.TG(54:3)	13.4213	1011.2984	7.6090	10.3235	21.8678	129.8142	894.3572	4.3577	6.5596	966.9087	63.1826	5.0878	115.1791	683.7839	392.1572	446.6493	638.1186	302.1763	217.0784	473.8690	75.8494	246.8678	233.3484	3.5010	806.1643	939.3710	1117.9579	902.1585	85.5289	211.0988	80.6678	87.4141	76.3332	933.3950	4.2327	14.8675	21.5391	758.2598	228.6663	1.7457	84.7020
245.TG(54:4)	3807.3850	5176.2626	1448.9232	2300.6521	3035.2395	2552.8681	3256.8540	813.8651	1745.8209	4068.3416	324.5533	1491.8132	1930.8150	4287.4358	2292.3080	2993.6800	3629.3727	2031.3164	1982.3048	3348.7831	1840.1141	1741.3437	1651.9490	752.4472	3628.1221	3920.4698	4204.5691	3866.4625	681.2773	2027.9802	395.2727	492.6136	411.3578	3739.0606	1724.2592	2820.6082	4450.4940	4480.1883	1566.1517	1052.3105	998.0465
246.TG(54:4)	89.1217	201.4065	124.7972	137.3964	161.9409	133.2304	163.1704	90.1300	76.0933	178.7912	8.2043	11.5368	150.1436	187.1815	46.0535	55.9727	312.3178	152.9022	140.1865	161.0468	220.3221	85.0934	38.2564	46.2565	179.5724	170.8493	193.0603	171.7827	52.8051	200.8691	8.4612	66.3810	50.0111	163.4786	84.3184	294.4914	121.8804	94.3587	7.1573	18.6704	25.9868
247.TG(54:4)	976.4762	1975.2380	58.2998	70.8519	1141.9623	69.3329	1534.4605	42.8967	605.9676	1313.7514	6.6280	17.1521	93.5883	1061.5821	16.0964	897.6138	107.6210	82.7087	80.0404	1132.2946	123.2711	580.8996	43.9066	242.5867	1494.9323	1285.8662	1473.6191	1311.2952	204.2431	110.4776	17.1038	37.0954	165.0093	1341.6255	35.8952	192.9212	1045.1705	1497.7359	40.6755	31.2621	30.3153
248.TG(54:5)	505.3810	643.8214	195.2574	142.3566	468.2142	156.8238	404.4359	159.2099	173.6245	545.0225	41.9173	70.8051	269.3175	916.4531	284.4929	383.0775	426.8547	191.1908	188.7974	774.4346	489.0443	372.7729	303.2511	100.1990	538.8546	475.1017	534.3403	530.2445	77.0736	305.3482	67.4256	84.3506	87.8745	488.9640	99.9548	540.8983	324.8093	419.6681	134.3944	125.2840	142.9971
249.TG(54:5)	2226.4012	3179.0417	784.0637	854.5911	1883.3859	1164.2956	2255.1812	458.0230	856.6602	2096.4877	144.2607	654.2356	801.6028	2719.9668	1432.9033	1843.3594	2289.2510	912.6360	877.8160	2173.4269	880.1614	1251.9820	941.1174	479.0134	2423.8773	2572.1567	2636.5633	2656.1953	370.1548	888.6568	192.5386	259.9450	250.3402	2658.0295	678.5627	1281.3346	1955.4127	2766.3069	631.8900	551.3233	536.0201
24.Cer(d42:1)	908.1462	357.4874	355.2121	328.2781	256.0316	378.8699	351.6594	328.2327	300.8993	160.7363	193.6674	125.9797	460.2216	1113.0909	515.3424	707.4236	701.7347	239.0835	250.0222	855.3267	544.9102	1298.3081	546.0375	501.1894	470.3289	314.0234	314.4352	267.3151	167.1507	490.9478	186.3988	297.3211	221.9686	427.6204	213.4353	561.7581	378.1190	663.4566	305.3515	216.5148	301.1831
250.TG(54:6)	824.2680	1637.7658	269.3174	256.4903	607.9652	334.5841	1060.9701	159.8084	337.1744	1856.9467	42.5843	204.6504	256.3136	1271.1842	627.1522	819.9913	955.5962	287.4610	200.8226	1012.6444	290.3033	321.9056	570.3642	32.9988	657.6598	1285.7530	1133.5676	1330.6529	129.5476	221.3345	65.8093	97.8256	100.9026	1371.8063	212.6067	433.9913	687.6207	1129.4037	187.0282	205.5576	213.2321
251.TG(54:6)	472.4574	1283.1389	184.9444	144.7729	449.0021	167.9421	296.8444	156.3586	144.3837	530.0535	30.7306	70.2985	208.3712	1567.0888	262.8705	370.2048	388.1273	185.6286	167.9337	650.5640	387.9410	333.6476	211.7698	91.8542	399.1844	459.0912	488.5583	513.1492	63.5148	267.3735	57.0958	72.9732	81.4210	491.9298	105.1699	485.5045	361.6119	351.2477	128.7330	114.3639	145.6332
252.TG(54:7)	720.8915	891.1247	225.6902	29.4221	501.8376	124.1307	3036.6137	60.4420	236.9023	3709.3872	13.7173	6.3105	62.6706	2653.9160	310.2330	1507.2432	1555.5412	30.3447	23.7419	887.5023	604.5275	462.4954	470.3042	123.7838	694.9256	3513.2083	639.5032	702.4927	5.0653	108.8905	5.6069	58.1483	9.3888	607.8668	13.0147	749.0340	48.8085	1951.4029	157.8630	55.1723	46.2862
253.TG(54:7)	1547.6740	2957.1863	233.5578	46.1940	909.2284	115.5737	2264.8251	65.3663	87.5059	4556.7898	4.8392	44.7123	79.2373	2174.0378	542.1759	1469.6027	1603.1750	50.5041	29.5893	2242.6904	164.7675	1157.1310	809.0582	23.8016	2462.4625	4356.4933	2144.0576	2042.1413	24.3700	63.1317	6.3770	14.7506	17.9733	1457.9934	31.4173	169.0423	90.6163	2605.9903	39.4283	92.1242	85.4676
254.TG(55:5)	139.8242	370.2404	105.4336	40.9244	101.4228	80.0936	139.2304	46.8660	52.1566	138.8930	7.8424	34.9396	39.6453	156.1626	107.2281	82.9698	148.7895	59.7176	72.7807	135.4943	48.6096	62.9954	65.3315	47.2112	306.9074	119.1565	163.9711	155.1329	23.9231	74.8540	11.5388	23.2506	18.0233	162.4040	39.2845	71.9348	135.4967	146.3566	26.9379	43.1554	33.9630
255.TG(55:5)	8.3109	3.9519	1.9179	37.6116	16.2643	48.0297	18.4898	49.5054	53.4875	21.1198	4.6486	32.4331	49.2590	180.4755	7.6648	92.3587	98.5574	54.4831	47.3306	22.2827	79.1569	13.2046	82.7866	3.4623	30.1634	14.6134	16.2603	79.6820	19.9595	85.5980	12.7129	12.2297	8.1879	23.1974	31.3606	101.1024	88.5872	7.0036	27.0737	41.7044	2.6166
256.TG(56:2)	1977.2606	5641.1875	735.6323	745.1318	1138.6685	450.7847	2620.0530	383.1478	210.5822	1633.0764	28.7999	203.0513	1551.7139	3770.6671	604.7052	996.2755	1293.8630	337.5771	248.7549	2333.1615	578.2008	1184.5961	838.3260	358.8886	4331.8745	1384.2163	2066.4104	1342.3297	61.5229	502.7487	91.8631	92.5958	63.0485	2118.7582	257.7366	1535.5565	358.6156	2547.5093	190.4907	136.1772	85.5912
257.TG(56:3)	4472.0021	8502.5842	2503.8526	3689.5107	2918.0733	3176.2876	4503.7404	1567.9207	1597.4409	3700.3697	312.3187	1341.9830	3339.4913	5393.0012	2674.8887	2899.9416	3770.1126	2853.4015	2465.4972	3961.7113	2667.8939	2116.2622	2470.1669	937.4190	3607.8971	3346.2417	4238.7209	3667.6408	636.4615	3395.9439	587.4269	717.1122	533.2063	4405.2748	2064.3774	4835.9566	5136.0908	6010.6655	1618.6886	973.2115	727.0747
258.TG(56:4)	119.7694	201.7643	14.1673	30.6012	166.6494	30.5811	204.9253	14.9597	20.7264	167.9465	9.0034	11.5792	38.9374	248.4585	69.1264	82.6838	92.6373	39.4298	38.2710	215.6468	11.5255	97.3280	33.0136	14.3957	205.3931	126.9060	127.9476	148.1443	9.3490	54.3526	17.7555	6.3364	17.9505	197.5058	20.9982	75.3801	31.6813	81.8291	5.7848	5.1573	15.0980
259.TG(56:4)	300.0036	778.8385	14.1783	22.6500	338.9284	17.6271	543.3527	11.8843	12.0675	381.9531	31.3142	2.4569	18.9032	589.8245	162.7764	180.9818	214.9438	30.5142	31.3725	447.2603	25.0549	205.1106	17.5500	112.4223	675.7558	298.6187	404.1971	347.4380	27.5123	41.0924	5.1086	7.6968	55.8918	467.2738	16.4539	39.6910	136.9368	218.8410	11.7821	17.4256	8.6826
25.DG(18:1/18:1))	382.6216	477.6827	286.0765	381.7049	428.6218	485.5373	458.7453	234.0631	364.3076	805.8001	144.3189	349.6163	406.6989	292.6893	272.3388	245.3689	505.5521	406.2904	418.7032	327.3977	340.6341	137.0092	276.6321	162.0630	333.9230	397.4921	471.2048	433.1284	175.7701	440.1547	56.6014	163.0587	134.3179	334.2543	314.0999	675.1198	613.6641	431.3147	292.5880	205.4571	209.2539
260.TG(56:4)	2692.1956	7911.7714	1615.6801	953.1278	2286.7406	1416.4862	3709.2836	1175.2749	1080.1494	2873.0020	314.4501	641.5543	1083.4166	4034.2665	1635.4206	1669.9988	2098.5873	1242.9577	1057.7670	2903.5933	1160.8202	1498.9103	1539.2491	1337.1430	6230.2010	3064.4897	3890.2009	3197.0813	576.4171	1811.4725	490.7897	778.5327	565.6230	3495.4183	722.5270	2000.4946	2029.2599	4055.3571	595.4640	872.4628	560.1159
261.TG(56:5)	1495.5946	3205.4864	814.6296	197.0885	1536.6423	561.1471	2326.1074	578.0975	471.6959	1898.6402	156.4732	286.3355	285.6432	3982.1978	1079.9593	941.6981	1116.7095	578.6061	306.6791	1805.0455	385.1456	882.7201	768.9836	668.0875	3563.0078	1710.7593	2337.7102	2169.1384	285.1122	482.6061	253.3267	445.2208	348.4742	2374.7475	288.9507	452.8335	871.9166	1688.5180	156.6194	463.0439	294.5729
262.TG(56:6)	729.8161	1347.5150	264.0060	152.5904	789.0003	181.7779	895.1352	207.8408	202.9560	856.5270	67.3897	70.9205	235.2500	1436.4700	466.6533	502.8402	506.1893	196.7150	179.5593	1246.0706	481.5511	575.0514	468.3053	173.4554	1117.6644	696.6395	880.0555	861.9190	105.9875	423.3056	70.7649	110.7487	127.9257	1023.3608	113.8028	561.4320	343.7425	859.2459	151.7735	165.4183	163.2066
263.TG(58:6)	490.9058	2042.6120	131.0002	11.3961	694.2362	14.2443	1120.1014	31.2253	17.5960	781.9161	62.9374	38.2685	18.1835	1050.0968	110.9283	47.4204	62.7136	16.9819	12.2136	867.0844	231.0742	337.5162	98.3023	207.8423	648.6666	200.2715	750.0367	701.2782	59.4375	62.8607	4.7807	204.4223	195.4257	374.0146	8.0212	41.4899	32.9967	92.2639	10.3407	25.6255	10.7539
264.TG(58:6)	110.5156	1500.2425	56.2383	10.7001	160.5418	16.3550	283.7200	62.4003	23.1945	154.5467	15.8243	23.2726	25.9680	207.7783	58.8206	54.5674	60.4888	23.8070	21.6270	227.2666	59.2189	94.0759	90.8720	72.9735	431.3875	99.9859	170.9779	115.5356	19.9913	65.5591	34.2908	58.9877	29.0029	264.4954	7.2412	64.7722	26.5188	102.2077	12.0700	28.8826	19.8449
265.TG(58:9)	286.1572	818.7699	31.0485	39.9881	343.1062	133.3574	639.8639	9.1876	273.0432	224.1535	30.7371	57.7520	153.0056	530.2078	186.7130	159.7706	1320.7340	162.0217	115.4479	407.3485	428.6879	141.2031	123.1391	9.8527	814.7118	243.5400	352.1554	288.2860	85.0020	428.0363	23.0880	1.6415	104.5917	639.4092	81.7209	423.9922	149.9587	280.3127	101.9589	374.3748	268.6016
266.TG(58:9)	1930.5748	5399.5373	604.3190	37.9936	3137.6373	115.0940	3952.4299	289.8491	255.3824	2184.2826	27.9037	51.8568	135.2978	3200.9794	1274.4966	1142.7183	854.9339	141.6498	99.5246	2142.8354	360.1924	1027.8084	1078.2910	321.1952	5221.5600	2660.3096	3418.2472	3617.1409	75.4514	374.7777	19.8833	78.9838	93.9980	4413.3279	72.0233	358.4755	135.0987	1857.0829	88.4154	345.0238	236.6482
267.TG(60:7)	117.3297	765.3176	8.1307	5.3094	197.1207	10.6919	437.2392	36.3078	25.8030	17.1312	17.1578	6.1146	6.6674	10.1495	2.9034	4.2580	2.8253	1.3750	9.1221	11.3633	2.7077	79.0849	84.2970	7.9777	811.1975	20.1614	218.6400	20.5974	12.8151	15.1325	9.9014	18.8766	50.0673	380.5681	5.7341	10.3479	12.6301	74.7273	6.1642	34.0718	12.0072
268.TG(60:7)	15.2638	137.2891	13.6834	1.4452	45.4205	3.6338	84.9115	12.6618	11.2873	56.8409	10.7470	1.9490	4.4007	16.0470	11.3547	3.8848	7.0369	5.5105	5.5748	18.5950	14.5783	9.5409	20.5986	27.0794	156.4402	30.3966	49.4881	46.4262	8.9180	8.4271	17.6580	15.9481	4.4602	79.4457	1.0618	5.5582	1.3563	7.9590	1.6763	6.8177	5.5819
269.TG(O-50:1) or TG(P-50:0)	5.9589	5.5519	5.0731	3.9741	7.7202	5.6696	8.4334	5.5853	10.7142	5.8643	3.9336	8.2264	4.3471	2.8884	3.3101	2.7719	3.2302	5.1361	6.3120	2.8330	5.4026	1.9790	4.9341	6.3505	7.0908	6.7428	6.9464	4.5309	2.4972	6.5285	2.1766	8.7970	3.1464	5.4871	3.1849	5.7511	5.8645	5.4799	5.4442	7.2537	6.5249
26.HexCer(d18:1/22:0)	41.6517	35.4040	47.6553	8.4216	41.5008	37.2554	41.9643	62.8089	111.3291	45.1282	78.9618	76.0007	29.0048	26.1121	13.8692	23.5463	14.3553	24.0551	33.9424	14.2272	24.8853	9.1564	69.4127	65.0532	47.8553	36.2537	34.8812	33.3382	49.3295	22.1159	65.1958	56.0247	60.3520	33.7128	19.8465	22.4370	35.0590	31.1035	35.4372	61.9910	89.8167
270.TG(O-52:1) or TG(P-52:0)	4.6581	4.7426	3.7690	1.0684	8.0596	2.0994	14.4588	2.0376	4.4354	8.1040	1.9309	2.5991	2.8348	7.7581	0.6644	2.3702	3.1786	1.1178	3.1746	3.5928	1.0298	1.8921	5.8544	3.6086	12.6673	4.7045	9.8471	4.5348	0.9707	1.4858	1.0411	1.7941	0.3756	6.1976	0.8155	2.7399	2.2450	4.0219	0.8806	2.5721	3.3997
271.TG(O-52:2) or TG(P-52:1)	7.9021	8.4633	16.1542	6.8014	9.6490	13.0077	12.0891	6.4185	7.8490	14.8740	1.8643	17.4767	5.5675	5.2281	6.9889	5.9858	4.4336	8.4678	17.4891	4.3441	1.2276	0.2993	10.4394	4.8575	11.8768	6.9738	11.6480	7.2739	4.1386	16.1985	2.8133	10.7718	6.0521	9.5720	1.6081	12.4794	14.9070	11.7859	10.0138	17.6390	9.0722
27.HexCer(d18:1/24:0)	25.9768	17.9227	11.7203	7.0830	22.7101	14.1450	20.8737	14.5457	36.7562	27.8823	30.6001	20.0398	8.9100	31.6728	7.5426	13.9643	11.3810	7.4260	7.3536	16.1740	7.9747	12.7374	17.0530	16.4534	22.7971	23.2589	23.3869	19.8968	14.0668	9.3591	15.3884	19.0753	14.2419	19.1585	7.1406	9.6076	16.7907	13.6883	9.7274	20.1971	34.2619
28.LPC(16:0)	2508.1846	1529.2808	43.1224	48.2773	44.2756	62.7365	62.5469	43.6402	103.2227	80.1120	58.0654	77.4201	73.5508	35.4935	1969.2932	34.4219	2661.7182	44.4220	81.2083	2935.3442	40.6304	36.1617	48.3306	37.8024	29.3682	35.3147	2990.2144	52.2271	35.9916	74.2144	18.3833	56.8141	44.0319	55.8434	41.3667	67.1502	73.0260	34.9083	4959.2597	42.6541	71.7014
29.LPC(16:0)	2466.0945	1493.8827	1993.6739	3668.7183	1995.8511	3733.5874	3158.6512	2197.6084	4471.3030	3261.5231	2427.8748	2613.7624	6776.3257	3315.4143	1937.1694	2324.0686	2632.3609	3822.5704	5668.0376	2896.4233	3038.0415	1700.8937	2008.0192	1690.6732	1898.1179	1471.6610	58.2495	1841.8032	1186.2789	4307.7383	855.8599	3825.7576	1951.9734	2903.6090	2790.4336	5445.5654	4186.0858	2519.4014	4874.3588	1852.1156	2775.0554
2.CE fragment	3237.7826	1734.2879	1698.9723	2600.8516	2977.7536	1133.0806	2565.3960	3820.9107	1647.3984	2961.9690	7466.2138	4633.9323	3118.4922	3357.1910	4513.7599	3265.8914	3848.1921	1855.4203	2630.9820	2617.1864	3951.0877	3336.5143	3368.3936	1696.1679	1842.4622	1929.4821	1439.4535	1598.6732	3362.9339	1545.7130	7289.8575	2585.8845	9618.2963	2564.4011	1819.5687	1716.7958	1115.3696	2128.7418	1726.0299	1366.5879	4083.2810
30.LPC(16:1)	34.5246	45.4029	77.7084	169.3193	74.2782	171.2307	108.5813	52.4110	112.0713	114.3670	61.5061	97.3756	180.8974	32.0053	32.1877	25.7690	34.4169	110.2319	176.7969	31.1151	54.2975	16.7515	58.4777	56.2129	34.5370	44.7369	10.5866	67.0928	32.6438	205.3168	9.6729	110.3526	44.1231	107.0672	69.2646	179.6765	107.5176	33.6857	145.1906	66.5959	86.7125
31.LPC(18:0)	4367.6734	1207.9100	1243.6289	2132.6592	2354.7630	1688.6870	3168.2207	2015.4513	4228.6227	4020.5745	1903.3380	2072.5684	4665.7314	5438.4747	2691.0987	4103.4627	4460.6074	1911.6398	3278.2315	3855.3532	1545.7082	2579.7957	1435.6439	1043.4656	1737.3019	1654.9232	3405.0686	2170.7979	971.8664	1785.7976	834.2118	2672.5885	1513.0830	3338.4906	1770.5756	2310.3642	2319.5861	4797.5522	2715.8279	1384.2154	2371.5409
32.LPC(18:0)	36.5380	19.3079	24.8220	28.0765	32.0740	26.2681	31.9454	27.4365	59.1029	49.0166	34.2088	35.8859	40.9249	45.0214	25.0713	44.4116	38.2389	18.3821	36.2782	37.4874	18.2663	34.9725	22.5730	7.8682	14.7304	26.5724	3422.0531	30.2991	21.1745	29.7425	13.9813	46.8811	21.6072	42.8434	22.4644	31.1686	33.5133	37.5765	36.0009	25.2289	37.6718
33.LPC(18:1)	179.3570	204.6016	381.5882	648.7731	326.3910	525.5913	633.5428	419.9273	571.8214	552.1387	431.3841	492.9401	373.9574	161.8778	115.8948	114.8709	177.0016	325.8559	489.8907	145.7497	280.2415	86.8443	307.9417	285.5022	198.9816	209.1545	666.3111	245.2281	156.7885	585.7585	138.9989	430.5141	268.5133	292.7985	245.8412	589.3639	528.5780	150.8991	362.0858	252.1920	338.5291
34.LPC(18:1)	421.1054	287.1144	518.4268	1228.5152	462.1359	1240.7468	687.1379	529.0977	1122.6871	754.1192	669.5837	776.2661	1557.0481	393.4325	329.8369	386.7734	426.0264	1022.8108	1499.6242	407.2899	574.1464	251.3544	422.3148	415.0301	348.8203	305.0494	518.1468	376.3841	300.5422	1212.1130	222.6840	1151.2398	430.8636	645.7764	769.8169	1462.2118	1021.5845	465.0706	1198.2604	507.1652	593.8963
35.LPC(18:2)	408.9792	431.0701	769.8407	713.1081	801.5853	755.1383	2238.4568	1107.7467	1001.9092	1459.7764	909.1138	1048.5027	585.6683	335.3098	284.7050	314.6046	383.5232	560.8783	789.3748	281.2088	371.6357	136.2486	781.3285	780.0755	632.7181	427.5506	262.9351	538.5041	324.4830	818.6753	362.6530	977.8808	671.0103	795.9161	415.3682	799.0358	810.5442	428.9948	510.9283	514.0177	655.5693
36.LPC(20:3)	70.1972	34.8289	100.1949	356.8458	41.6294	316.4427	96.1424	166.9471	163.0679	71.0484	142.4043	158.5779	261.4468	53.0046	37.0439	46.2039	81.1790	258.4621	282.4578	41.1721	143.4819	14.4802	64.8913	74.7114	55.1630	17.7995	23.2727	35.2528	40.0232	370.6788	56.9749	143.4652	76.0753	39.8086	179.0777	289.9482	324.9238	42.7552	208.7928	67.9004	74.4061
37.LPC(20:4)	387.5971	291.6659	758.9946	336.3535	745.3261	477.0112	1423.4699	1064.4307	1302.9140	1236.3323	1078.7710	1280.8961	496.4115	228.7930	242.1313	304.5621	376.8451	521.8996	850.6357	223.6699	271.0040	77.5972	649.9735	555.0167	508.2348	374.6947	103.2049	561.2646	371.9838	603.6426	342.6539	762.9976	686.3067	656.0419	331.2516	581.4479	529.5456	372.2483	439.1377	587.4608	812.8648
38.LPC(22:5)	18.1893	11.1870	12.8821	23.7042	10.1552	17.1798	31.9818	31.3051	17.4098	14.3973	15.4772	14.9769	22.2540	15.9435	9.8302	16.1634	18.7760	9.3197	21.9286	13.0316	14.8366	5.3425	14.6391	17.8476	7.0601	10.4671	20.4766	32.9730	13.0084	23.4613	24.6338	14.7441	10.8873	14.6456	10.0519	20.1197	36.4548	11.9567	19.1027	17.8120	28.5501
39.LPC(22:6)	364.4084	177.7728	400.7078	321.3752	394.4857	401.0643	884.6961	553.2975	857.7861	715.2896	572.9009	813.2283	395.8157	264.9371	219.2779	271.1043	327.8228	331.1912	596.6942	241.8483	265.3382	109.4102	495.3257	297.5710	251.0774	224.0355	7.6884	364.1784	229.8669	416.3250	154.0754	360.6555	364.1080	415.1912	268.9171	357.4255	509.3712	208.7854	435.2309	289.5955	517.1136
3.CE fragment	3324.0868	5554.0247	170.1166	2673.1858	7974.4736	184.6048	7806.5626	175.6474	2028.9363	140.1326	104.5865	4749.1042	231.5297	3406.0625	143.3847	3502.0858	3937.2619	214.1613	213.5246	2739.8281	4069.0516	3336.5143	3625.1576	268.8357	6089.7007	6282.0937	5611.7049	5568.3183	3374.1967	161.9020	7289.8575	2868.0519	151.5998	7239.4057	196.9985	1984.9197	1448.6231	5969.6045	160.6471	180.7360	4257.5438
40.LysoPE(18:1)	432.7764	299.2151	398.0860	1040.8515	378.6426	1127.4944	605.0723	436.2365	967.4286	477.0901	497.3477	459.3156	1345.8785	480.2814	353.5033	358.7217	431.5101	864.2609	1311.0470	418.8463	685.0698	224.4652	296.2475	388.1821	372.7865	259.4200	450.8498	295.8468	213.2665	1244.3084	137.1877	1300.9785	370.1581	565.8562	600.4464	1538.0964	1103.3716	495.5003	1051.7763	385.9995	465.5994
41.LysoPE(18:1)	10.3578	11.8967	14.6752	18.2555	11.8426	18.8450	20.3251	12.9692	22.9311	19.2836	10.8682	18.9076	1345.1156	12.0789	355.0160	6.7869	6.9012	13.3650	25.6867	9.1612	8.4193	6.0246	9.0471	13.2618	6.7543	6.1243	553.9286	13.2917	6.2147	1249.2300	144.1620	25.2197	12.1855	16.2844	8.3901	30.0606	21.4419	10.4477	17.6565	14.9689	13.5497
42.PC(16:0/16:0)	1644.2602	807.8220	1627.2537	911.0442	1458.2806	2028.3805	1245.9822	1366.7917	3199.0724	2074.1982	1978.5998	2466.4432	1025.4018	1003.1433	692.5439	1298.8086	991.7183	1338.5018	1928.3282	814.3090	1216.2575	634.1520	1326.1780	1153.0466	1001.2435	1838.7381	1811.9713	1749.1662	1738.8556	1771.8622	986.4902	1507.9115	1387.7555	1790.1518	1329.3516	2115.7273	2627.6346	932.1502	2042.9415	2101.2842	2386.5981
43.PC(16:0/18:1)	19403.1713	12092.4670	16685.5969	24405.6122	13468.3145	25641.4378	13260.1798	15682.1172	21212.1669	16415.0610	14992.9568	14796.3613	21394.7966	18406.9410	10556.6995	13315.9914	16148.7607	19763.1486	21573.8749	16497.5972	23692.5853	13932.4656	13159.6761	15571.6171	13404.8147	14810.0694	14046.3812	12624.6806	12798.9570	23625.8137	10909.1432	15579.3689	12411.9704	12853.5700	16977.3161	27692.4265	32562.7378	13153.0040	21422.8047	15222.9436	15365.4473
44.PC(16:0e/18:1(9Z))	312.0855	99.0720	146.5723	106.2968	178.7823	255.6890	183.1884	140.8980	329.8451	278.1339	130.7793	200.7156	137.2413	152.0305	67.1647	154.3344	139.7300	126.4630	174.6457	96.5549	133.8728	79.9039	129.1221	145.1357	141.4882	183.3148	189.4799	148.6690	138.3973	190.7531	53.4799	140.6285	89.7362	141.3553	121.1478	282.9332	172.9013	149.1779	226.9404	179.0624	193.7753
45.PC(18:0/18:0)	48.5260	14.2614	26.0033	15.8556	39.2763	23.5195	40.0434	31.6869	76.6943	61.7196	38.7711	43.2583	17.0135	29.9094	16.3301	29.2332	28.6303	17.9057	25.9348	22.2410	13.6263	17.3229	26.5189	23.5956	23.0309	29.8699	47.7218	39.4673	26.8245	17.3478	19.9903	30.8378	26.8184	36.2155	18.4974	20.3634	24.1113	34.9229	20.0211	29.8805	49.1157
46.PC(18:0p/22:6)	10.5858	7.3447	1.1384	3.9447	12.5681	15.4969	13.1733	7.0675	20.0395	17.6280	12.3055	13.7386	4.3041	6.6115	6.2000	10.6240	6.9228	13.2326	12.7845	3.0172	9.5372	2.1257	3.1405	2.7311	8.2676	15.7577	17.7389	5.5993	9.8432	4.6815	3.5656	7.3110	5.3580	10.0923	10.1727	4.5739	17.3819	5.3380	8.7781	10.7824	9.9346
47.PC(30:0)	141.6328	104.0496	104.4565	63.7444	181.3335	85.9043	218.2641	131.7550	250.5891	353.1761	186.7909	183.1284	58.7695	91.8272	57.7231	148.8822	115.8468	96.8171	124.6863	91.6757	87.8987	75.1095	82.4376	101.8024	138.3342	197.8721	194.2711	222.9663	108.3909	81.0101	111.3976	157.7042	121.3043	239.9052	96.4098	98.7823	144.5631	83.3542	107.9310	119.1703	173.3908
48.PC(31:0(OH))??	10807.2031	7990.1643	9798.1936	17543.1722	13327.1613	9335.1729	11339.8689	9381.7611	17471.5729	15729.1243	13421.9617	17167.3074	8802.9520	9413.3828	9320.7640	9060.1055	9296.6825	13139.6555	9510.3612	8741.7705	8254.6860	7823.7688	8158.0119	9657.3637	12565.3389	15945.4050	23267.8890	15817.3687	9422.0840	8554.5061	14477.2417	19487.7268	9556.2104	14642.1327	13507.1305	14998.6169	28381.9039	9948.1565	8248.7960	9638.7131	9714.9224
49.PC(31:0(OH))??	428.1129	167.3818	105.8630	11274.0644	137.6495	17788.2898	138.7027	68.5149	138.3700	204.9538	133.2719	218.7997	77.9839	43.9926	155.8699	92.3203	68.6825	130.4968	103.4485	68.1980	3761.6671	86.7089	106.7082	145.9394	198.8456	270.3581	326.6949	277.4919	110.3854	87.9808	298.9887	169.5060	157.6045	216.3658	180.7819	8481.7375	543.6352	69.3077	78.3887	46.1077	18814.4760
4.CE(16:0)	1709.7621	3005.9164	2956.1136	2216.9008	2791.0430	1897.1723	2950.0170	4843.6467	3658.8325	2731.7493	12420.1350	2831.6183	1538.1146	1727.5446	2606.2917	1709.9932	1716.7349	2412.8025	3297.0953	1370.6874	2288.2810	2247.3823	3466.9955	4455.1155	2847.4844	2897.4674	2309.2002	2591.6329	5709.0813	2303.4116	3149.2304	6588.4840	7427.7023	3399.3459	2272.5531	1969.7941	4859.7402	2490.3427	2734.2412	3244.0784	6551.9754
50.PC(31:0)	73.2756	29.3683	55.3481	30.1156	45.5599	93.0382	59.2405	57.8277	82.9432	78.9696	63.8561	56.4499	38.7981	57.0778	28.7042	54.6138	38.7886	50.4208	64.9499	40.6764	51.5060	34.1336	42.6011	50.3291	46.0688	50.1552	54.2341	51.8170	44.7100	63.9680	31.9870	57.0301	42.0404	59.4948	37.1960	66.4945	69.4944	31.9391	69.7550	67.1710	71.7310
51.PC(32:1)	1447.7690	1700.8904	1970.8030	2766.1328	2149.7630	3204.7903	1886.1380	1371.5182	2354.0750	2387.2135	1232.1012	1431.6959	1827.5453	1132.8691	629.9316	1022.9451	1098.8614	1862.3060	1945.0786	941.4952	2077.0587	896.0229	1605.5280	1502.0201	1194.9612	2372.5613	1880.2771	2322.8146	1378.1311	2816.9552	821.6860	1491.3826	907.4401	1733.8339	1636.8943	3569.4356	3342.4038	984.7345	2375.0679	1763.1919	2238.7718
52.PC(32:2)	211.7960	225.4857	269.8354	190.2506	284.3798	412.9368	392.7561	176.8252	217.3353	340.4530	145.6342	116.3012	134.3936	187.8517	76.6110	133.5114	135.4168	158.7568	169.9666	130.1081	167.4976	128.1307	163.5566	228.8459	254.9065	250.4772	266.1960	311.3335	139.5825	293.6399	111.1720	190.3135	126.4897	234.5471	135.8474	321.9722	173.7126	106.0691	204.7526	196.9776	269.2748
53.PC(33:0)	145.6523	12.6524	109.3171	51.3860	94.0922	136.5741	106.3177	111.9801	183.1711	135.6168	120.4875	96.0007	84.7203	29.8790	51.6282	30.0136	84.7646	90.8440	98.5267	23.0180	98.8285	54.0037	74.7132	92.5688	24.7444	85.3468	113.2177	48.7841	77.8229	20.2809	60.1020	124.4481	13.5959	96.6060	74.0632	142.5321	105.5456	65.4996	96.7323	113.5462	38.2698
54.PC(33:1)	336.8571	231.4356	337.4564	389.7109	263.4770	703.0740	297.3920	298.2300	381.7293	296.0363	267.7928	209.4567	425.2381	359.6533	136.4450	208.2146	245.0319	403.2278	398.1997	284.9062	525.1288	238.9229	249.1332	329.9234	272.7813	232.2506	229.3123	208.0192	198.1836	598.3577	159.2176	306.1598	196.6090	239.0948	309.5017	723.8294	457.8498	168.2042	410.9137	292.9494	280.2970
55.PC(34:3)	820.5787	584.7682	444.6439	446.0588	1100.1332	962.8743	1313.5474	407.9366	550.3303	1808.9784	283.8501	250.8280	492.7398	723.6059	310.0487	540.0591	622.5990	596.6356	714.5297	622.6012	633.9673	534.5261	374.2167	572.0607	597.4943	883.5635	651.8383	755.8232	265.5830	846.2908	179.9144	397.2537	338.1036	906.2731	420.6792	896.8963	701.4033	390.5135	530.7463	496.7580	758.5963
56.PC(34:3)	1170.5211	1110.8216	1542.7392	1646.1380	1119.8044	4122.4357	1635.4735	1050.3055	1202.5739	1193.0795	753.5431	839.4577	1283.1123	1063.8679	523.0625	635.8037	906.7598	1451.4211	1430.4619	674.3664	1411.1436	773.6206	982.6031	1415.8990	828.8568	857.1479	925.1816	929.4040	825.9610	2557.9227	410.8331	982.7381	645.3251	1153.7785	1103.8099	2653.9997	1715.0182	655.8938	1574.3593	1118.6986	1144.1339
57.PC(34:3)	2073.3948	1098.0812	2021.8106	1577.8833	197.4875	3761.8673	3069.2000	121.7633	1272.8816	122.3863	90.2031	54.5619	1212.8846	1873.6335	55.0070	92.8950	1499.4077	1380.0960	1354.2056	82.0461	1350.2449	1294.0771	179.3978	1486.9356	1592.8267	211.3853	249.7377	236.7398	89.7897	2329.2134	678.4099	1366.7760	1000.1068	2010.0578	1045.4033	2561.4950	1678.0986	756.8616	1530.3950	1145.0995	109.6121
58.PC(35:1)	380.2317	181.5296	194.7817	206.5239	205.5850	362.8060	286.0056	248.3025	317.9638	302.9144	351.3586	180.7201	296.0546	457.2369	165.1358	257.8192	298.7854	227.5363	258.3506	433.8448	352.6601	296.8333	241.4362	337.6566	254.5156	200.0068	223.6446	183.7128	202.0636	277.3010	121.7519	268.0772	165.5171	199.1401	189.6504	401.8242	239.4006	268.2485	229.6646	224.6498	201.0097
59.PC(35:2)	308.0528	198.1847	383.6959	407.5226	228.5809	833.8281	320.5223	412.7701	426.9095	256.1363	342.2581	261.4139	363.2819	370.0297	162.8733	245.6684	243.4910	481.7934	409.1065	301.4362	491.7027	223.9377	219.5522	400.9521	316.8441	213.1115	228.0924	211.5313	216.2083	628.0775	313.3015	526.8690	255.0375	213.6952	392.7370	730.3749	494.6607	203.1269	352.9384	361.7972	226.2845
5.CE(16:0)	10447.7815	6352.9637	7032.6359	10734.2603	9265.6630	5442.0729	7816.8512	14010.1254	10187.4424	10931.9863	33391.3729	18667.2846	8623.4393	9165.0409	13808.3189	9794.3534	11457.3689	8271.6515	12404.8961	8366.5243	11145.2068	11626.2067	10149.4601	8411.1319	6674.5212	7285.5896	5493.2925	6360.0179	15481.6090	6581.1095	16414.2310	12462.5712	29177.6336	9155.6133	7839.3798	6924.9149	13359.7858	9101.9592	8149.0579	6627.4095	16807.7368
60.PC(35:2)	963.3492	425.3166	461.6846	275.7232	450.8712	660.6972	667.4652	676.1598	568.9030	579.8907	484.4475	348.0443	513.3850	1141.2923	454.6756	717.6380	669.3439	475.0943	504.9397	868.4125	677.6276	646.9257	450.9854	647.7389	706.2386	419.8865	465.8354	417.6805	359.0447	516.2011	340.6414	598.9138	459.3069	477.8348	406.1953	564.6032	590.7341	608.1209	463.0384	460.6368	416.8678
61.PC(35:3)	93.5911	98.6292	160.7583	129.4387	101.1157	293.7202	148.8872	152.5621	148.3678	110.5755	125.7709	114.9439	130.8047	118.7626	61.9910	88.5193	98.6958	150.7300	174.8612	101.9152	199.8258	111.2104	118.1496	178.1485	134.8350	84.6868	108.6369	86.9127	77.2048	198.8930	73.6636	121.2917	98.8043	103.8126	154.8191	261.2903	163.1562	65.1306	127.3417	141.9011	97.0134
62.PC(35:3)	9.0272	9.6797	9.7281	12.0157	19.2531	238.1054	164.3453	23.7088	8.0011	39.0033	20.3874	10.3320	35.2780	13.8101	67.8445	11.8836	15.6508	17.7853	19.5334	28.8724	26.8106	11.6938	94.2530	18.2942	20.8166	107.9773	10.1979	17.7182	80.5432	200.6891	14.6288	9.9706	5.9450	35.4588	19.0719	213.6514	72.8594	6.6676	135.6083	113.5990	6.5272
63.PC(35:4)	128.5562	58.7533	100.6818	31.8202	80.8394	116.1140	103.5438	104.8773	110.3425	87.2302	93.8674	68.9482	70.8849	120.5078	56.8591	85.1250	89.3394	82.6990	95.9058	105.1400	89.2093	69.3179	69.2171	99.7739	110.7582	59.0085	86.1643	76.6809	63.2543	100.8264	51.5212	89.6748	73.5095	72.8182	57.1746	101.5354	79.0135	56.0507	83.7569	88.0090	91.6224
64.PC(35:4)	64.6153	41.9635	48.5902	37.7710	58.7215	89.7103	92.7209	87.9786	60.4854	46.9130	69.7813	46.5180	6.5040	68.4473	39.5008	66.8402	74.1274	65.4334	75.6587	6.3794	69.2647	47.8909	48.1918	78.2437	91.0586	47.1769	59.8863	59.5088	2.1382	8.2438	1.8597	46.2228	4.6567	4.2673	34.9503	75.3827	68.8410	37.3635	73.2660	67.4361	63.2947
65.PC(36:1)	9221.9281	2186.4511	2718.7915	6500.8640	3783.5669	5202.6955	4321.0990	3490.5119	4947.3040	5438.4843	2764.7695	2574.0090	5374.2949	8005.4140	2975.3974	5164.7629	6427.8161	3546.1844	3726.1037	5472.9425	4582.0172	3963.3347	2419.2258	2450.4301	3053.5104	3360.6435	3547.5337	2787.7498	1749.3328	4152.6354	1889.4906	3597.3566	2075.0560	3255.9769	3566.2147	5950.5949	3609.4113	5861.7188	4014.1691	2718.1246	3034.6438
66.PC(36:1)	6571.1697	1691.5450	2139.9094	34.4959	3014.4392	54.5674	3353.8282	38.7385	3657.0726	4095.5542	2170.0045	24.0215	3922.2624	6179.4253	2487.6536	3918.4955	4437.6722	24.7641	24.0406	4396.7295	32.3177	44.4415	24.3910	1804.2607	2270.0415	29.3172	35.3584	24.6538	13.0179	3145.1613	1529.8755	2817.8510	1616.2521	2620.2637	2328.9876	3861.7123	23.6217	4238.5636	2963.0712	1796.7247	1984.7359
67.PC(36:1)	6172.1137	2078.5183	2168.8244	2895.1857	2830.9683	3203.3401	3215.5363	3099.9936	320.9388	3589.0979	2269.4612	2247.0423	2488.3651	5209.7285	3333.5384	4520.0833	4530.0265	2465.5557	2638.3974	4004.2707	2755.2236	3182.5662	2096.3037	2499.7217	2912.7673	2733.8906	3004.7252	2673.7264	1908.9977	545.7514	2199.6110	2786.0922	2201.5945	2737.2823	2447.2278	2953.9197	3790.1405	5037.3546	330.3942	2304.6970	2203.2422
68.PC(36:2)	248.2999	205.3917	230.9636	116.4942	209.1453	321.1652	359.1912	220.1005	206.2991	241.8534	180.1005	127.9169	156.0969	327.8698	131.1828	178.3304	174.2794	174.8471	177.7573	256.0660	216.0315	221.4407	201.2840	286.7258	308.0390	169.4663	176.1596	204.9665	143.2895	250.9928	113.4838	210.8611	165.9230	217.8489	137.1923	261.2788	218.2144	130.6157	176.3606	197.5789	192.3952
69.PC(36:2)	35713.8099	14818.0943	16012.4181	15461.7084	18781.1094	16642.5678	19900.3989	21026.0080	19917.4390	23782.8501	16142.4904	16336.2738	17228.8433	29850.6416	21638.1906	27617.0611	13370.5915	14314.7433	16653.6617	24952.5466	19587.0513	20696.1588	14743.6917	17787.7834	19081.5016	19113.9369	20367.9107	18559.6809	14074.2087	13784.3381	15558.4577	17232.6478	15843.4989	18774.7540	14442.1650	15959.2622	24030.4601	29317.8277	15000.1546	16612.8601	15986.6657
6.CE(18:0)	55.1198	2621.8669	62.1755	467.3762	37.2169	56.5529	436.3455	18.4075	1067.8828	20.1109	152.7449	592.8499	584.0939	1561.2405	1066.9397	1946.2901	2098.2269	21.5626	23.0120	1407.3160	29.1380	46.4933	836.6831	52.6655	2946.3573	27.0855	43.0522	2160.2842	997.3061	14.3497	232.0529	764.0358	640.2913	60.3854	454.9103	71.6910	431.0370	2503.6042	595.0793	36.9050	761.2465
70.PC(36:3)	8224.6598	1909.2511	4090.0182	12785.4422	7319.9687	16164.0968	2167.5612	5094.4547	5506.1953	9034.4034	3922.8456	2926.5017	14512.3522	7252.3711	3164.5534	5306.6064	6626.9032	13522.2134	12663.7926	5357.8692	15369.8426	3786.4815	2543.8477	4452.4459	3648.4008	6589.3284	2425.3163	1798.3874	2578.4708	15191.9822	3235.5647	5487.0316	3018.6267	7036.8202	11379.3310	16688.9190	16999.1848	4027.4303	12533.2511	3871.2592	3458.5540
71.PC(36:3)	5986.4303	4141.5529	6580.3324	9143.4877	5664.5373	11696.8096	6002.2871	5799.7225	7715.6011	8294.1033	5641.3931	6175.8610	6547.8598	4416.7129	3324.7016	4175.1410	4419.7473	7984.1984	7119.5256	4023.2888	6591.4229	3735.7532	4615.4505	6234.8130	4495.4318	4980.2810	5372.3436	4787.6820	4667.5338	8220.2353	4472.2525	6635.0214	4196.5246	5456.0263	7327.1955	10067.0020	11072.4060	5311.8356	6586.2898	5954.9188	4821.2279
72.PC(36:3)	403.0016	83.4120	174.7236	842.5129	1146.1510	1084.9234	454.5021	197.7501	248.4563	806.3490	165.1928	114.7766	945.1514	360.3310	144.3309	213.2896	320.7702	841.3249	751.9155	238.7925	937.5637	152.5005	103.7784	140.9262	126.8366	1314.9396	93.8360	1278.0557	107.1097	1154.2510	124.3774	216.8965	120.7579	1086.6705	537.8863	1316.2705	573.4235	171.2126	636.9974	201.8994	160.4105
73.PC(36:4)	1504.0364	1144.3016	2003.3264	1576.7959	1276.0637	3069.7662	2562.7842	2038.8468	1521.7201	1308.2755	1648.8949	1095.1039	1310.1225	1587.9572	717.5026	968.9134	991.6762	1557.2274	1384.7477	1034.2765	1529.0102	926.2063	1328.0218	2297.1329	1801.5377	903.9441	1298.4112	966.5776	1040.0146	1986.2549	1323.3739	1881.7346	1456.3500	1437.7078	1309.4633	1958.9401	1791.2309	846.2140	1444.7181	1311.4893	1292.8435
74.PC(36:4)	167.3532	1101.4488	1890.6309	1486.4124	228.4758	414.3014	278.9826	104.2694	193.0867	397.0528	1396.4445	72.2089	217.0043	128.0828	653.6720	98.8840	118.5171	212.0214	222.9469	105.2535	188.9127	109.0389	1207.9027	2054.9904	1700.9504	159.0763	184.8509	150.6941	927.9644	265.9442	1082.3171	1852.3268	1246.8450	186.1689	160.9931	287.8076	1695.8744	85.6580	195.7597	1187.6579	153.2668
75.PC(36:4)	31180.4887	15662.0962	21183.9895	17227.8983	18181.9397	23202.6332	18087.8154	23282.6582	27501.1096	21610.3321	19942.7540	21127.3280	22722.4411	25748.9444	18751.1813	24518.8658	25742.4838	22296.3833	25796.8036	23587.5336	24604.3044	18631.4735	18065.4353	20552.5131	20005.2983	19594.4109	21807.8577	19166.1937	18635.6361	22155.2688	16596.7758	19768.8406	19448.5323	17988.6029	19024.7923	26032.3737	34881.8516	22854.0965	22565.9896	20197.8895	21432.8826
76.PC(36:4)	1995.1305	1638.0037	2200.5648	2759.2865	68.5374	2470.3605	1781.9533	1998.6443	2515.7780	91.0326	1905.2719	2118.0379	2200.0668	2129.5619	1536.6264	1680.4615	122.0610	2079.9709	2249.3515	2005.7428	2290.9856	1779.2015	1538.4350	2008.5482	1816.1226	2232.2901	2086.9606	1932.2560	1694.2087	2533.8923	1742.3729	2045.6918	1762.0799	1954.9675	1780.8187	2866.8993	4588.0582	1676.9520	2064.3406	1873.1158	1797.0988
77.PC(36:4)	76.8403	16219.1818	73.3301	77.3833	60.6871	24614.7012	74.3061	97.3018	101.5459	82.3775	77.8857	21679.5119	78.1217	77.5644	19253.8794	25105.7059	58.8148	112.2196	81.2388	56.6568	90.9467	19180.9582	46.8859	70.9600	83.7490	19963.7075	61.4174	61.1764	53.0640	146.5965	83.1293	101.7380	59.1488	53.7609	73.9102	157.9842	107.5512	23406.0756	82.2829	71.3042	78.3535
78.PC(36:5)	375.8151	205.4859	571.2514	432.0004	316.9364	1056.5885	328.5335	384.4083	597.7675	304.3999	317.2773	344.2194	578.8686	259.1382	166.2504	205.9338	261.7511	569.3903	626.5910	231.1669	410.4360	170.5587	250.0780	316.0056	211.1803	246.6007	339.1396	286.5164	280.5380	894.7025	153.2392	297.6207	225.2978	256.9119	383.7347	814.5471	579.7610	194.7937	590.3961	396.9539	476.1630
79.PC(36:5)	1448.2843	367.8288	653.8015	683.6359	516.4966	1559.0397	643.9650	670.0049	685.0613	479.9688	355.5144	438.9264	572.9062	949.0936	527.0515	775.6886	912.5154	795.5790	781.6819	556.0515	731.9072	437.8221	603.1929	413.4247	557.6566	370.3041	566.7840	403.3352	346.0747	834.5172	311.6778	480.1093	258.9503	379.8793	767.8104	1219.9513	909.2276	788.9187	877.0126	502.1932	655.2880
7.CE(18:1)	102.1118	55.0743	40.7242	138.7212	128.2561	36.3257	115.3211	150.5171	35.8528	123.7628	441.9530	271.7074	94.1749	76.3958	135.7710	88.7323	114.5971	28.3448	108.6340	82.5738	117.3937	116.8297	96.4250	78.3631	80.5290	81.2439	69.1651	46.3186	148.3297	55.5547	352.2497	39.7188	166.3809	72.3350	101.0974	55.5530	121.3403	42.2782	59.3760	60.7044	35.5236
80.PC(37:1)	1.6922	1.7547	27.1663	5.7408	10.3723	16.2994	8.6028	5.2687	20.0347	16.4267	9.2322	14.0192	8.8032	3.6907	1.5862	1.6450	4.7233	2.3714	11.1113	2.6237	3.1487	3.9237	5.9463	6.7705	3.2550	12.9094	13.3345	18.5581	7.2787	5.9316	6.5431	10.7889	3.6733	13.5682	2.1864	51.2880	10.8634	13.3334	5.9680	8.9078	11.1210
81.PC(37:2)	106.9912	72.4460	216.5504	95.1690	49.8066	180.8319	80.0455	215.2367	145.5328	64.3746	96.6669	72.5588	132.1891	138.2213	45.8123	74.1633	81.8317	100.3977	77.8540	107.8280	119.2303	71.4151	108.5479	213.2891	131.3223	48.2440	66.7035	45.6836	52.8013	136.9662	138.0105	232.7557	95.5899	50.1770	85.3427	223.7320	87.2067	51.0123	78.2818	91.3667	64.3546
82.PC(37:2)	230.7489	204.2654	158.4519	87.5709	156.5028	193.5106	395.7844	261.1242	153.4005	206.2651	98.2552	91.3007	142.8154	316.3912	82.5423	199.4313	166.7724	117.0984	112.1762	245.4316	159.1312	220.5017	179.6379	248.3241	389.3754	147.0596	193.0538	153.6841	70.3647	173.6929	106.0400	284.9742	146.2977	225.5005	97.0931	245.4522	127.4023	138.5188	101.0930	129.7015	103.9037
83.PC(37:3)	186.5046	74.3247	155.5917	79.9864	62.7966	148.5563	26.1879	61.5308	68.1697	14.3445	157.1570	45.1632	305.1870	84.8778	39.1176	138.6906	155.7948	136.9686	132.2413	77.4772	156.4115	56.0583	28.5576	53.4683	45.9880	27.4108	96.0853	36.3201	58.9870	142.7411	53.7774	91.3471	49.6707	24.9038	106.5415	139.1055	141.5441	52.0467	282.8817	151.5167	105.5218
84.PC(37:4)	678.8332	275.4067	450.4365	117.1199	386.7074	270.1771	455.7503	594.7355	654.5114	439.8735	480.0882	398.6455	261.4287	569.4948	287.8141	516.4102	518.1719	312.0284	390.9818	548.3265	315.4599	388.1645	338.3948	448.0083	517.5545	337.7349	483.8836	355.8298	356.6049	249.7022	280.5658	457.4420	397.2610	330.9075	228.7824	289.6690	348.3380	423.5451	268.8741	437.2850	409.0433
85.PC(37:4)	175.6479	87.3909	204.8770	74.0177	106.1511	173.4857	114.3749	228.1046	272.6923	121.0754	219.6337	200.8135	131.7550	145.6849	100.8068	155.0501	132.4889	166.3938	185.9775	144.0742	169.1402	82.6262	111.1784	156.8251	150.3999	88.4340	174.1848	135.0269	163.4408	169.6479	167.9513	234.3539	170.7988	110.9511	124.9491	191.8205	162.2555	110.9737	137.3475	217.0251	148.9244
86.PC(37:4)	82.6610	183.5729	294.9886	64.8727	46.1499	54.9545	299.5606	60.4728	60.0262	250.1277	322.9921	47.7424	51.1770	364.4531	47.2084	71.8961	333.1519	48.1536	49.4379	59.7071	220.5217	231.2834	192.3154	53.2858	72.8391	197.3655	50.5609	42.2250	8.6204	51.0671	185.7661	15.5428	260.0735	237.8652	42.2632	76.7722	67.0061	64.8778	149.2328	46.1674	47.7060
87.PC(37:5)	65.2791	34.5845	129.0740	74.1177	37.4882	134.1302	49.1321	83.7302	90.1180	21.5127	72.2804	60.7622	76.6431	55.2345	31.9012	41.1975	51.4879	129.5724	98.2573	48.2059	74.8208	34.7173	58.2011	55.2883	55.4444	23.8222	82.2070	16.3721	51.3206	104.1528	23.2202	83.1051	55.9912	34.4789	61.0906	114.1317	78.9263	69.9401	73.9000	65.7926	53.4889
88.PC(38:1)	104.9057	42.0836	53.1212	70.5178	15.7395	47.3618	58.5310	70.3527	64.9669	42.2226	46.5755	40.7154	77.4812	104.5711	42.4851	55.3596	61.2088	42.1582	34.9036	56.8792	56.1015	43.2497	35.9880	58.8651	62.2848	31.6297	42.1976	33.8235	29.2092	49.6240	44.9635	63.0030	41.8691	41.4035	34.7523	99.8137	38.7230	73.6188	34.8917	33.5869	37.5369
89.PC(38:2)	979.2264	309.9320	480.5392	795.2821	243.2234	796.4363	482.1851	706.8550	562.0598	311.0752	418.1790	312.3165	878.4172	936.4566	310.2737	542.0584	621.8104	534.6285	431.0516	532.2999	698.2280	357.5486	322.0975	607.3139	605.5438	213.1848	335.0387	237.4808	228.3310	638.8465	467.3797	696.8895	391.6859	267.5860	503.8402	1036.6336	434.1119	424.5160	485.6992	308.3184	269.1791
8.CE(18:2)	60.5838	95.2690	109.6731	62.0980	48.4133	69.6014	81.6441	250.0308	132.1704	76.9933	605.7109	72.2069	28.7041	64.6529	38.1160	128.0804	68.9246	70.3687	109.3497	63.1982	53.5814	34.5422	99.1764	347.0287	105.1238	72.8734	61.7007	67.5118	343.3010	93.6423	113.2436	395.1402	307.3664	77.2271	57.0806	61.0613	176.6281	74.5851	54.7074	196.3847	149.7619
90.PC(38:2)	1099.8294	192.2942	255.9248	795.7868	201.0687	899.5403	273.6653	406.0599	470.7854	240.7520	305.4989	242.8861	1084.6063	868.5346	383.2281	705.2672	902.5941	727.5852	792.5401	553.4899	873.1442	384.9871	212.8563	334.0462	292.9292	195.1015	285.4971	214.5301	204.9095	755.0954	220.6657	378.0159	275.9882	179.5033	758.8208	821.9825	791.4178	650.6700	801.5758	286.2596	258.8619
91.PC(38:3)	6274.9247	2005.2202	2814.1432	1933.6755	3235.9079	2797.9674	13.8825	3550.4278	4358.9721	14.1147	24.4927	3105.4616	2954.0803	4378.4891	2956.5340	4436.5316	4760.4986	2621.9622	3033.5783	3651.9189	2740.6808	2639.7803	2412.8605	2570.3484	3129.8857	3010.6979	3805.4642	13.4128	2459.1335	2346.5079	2106.0577	30.2674	2482.3774	2830.2530	2227.9373	3060.1130	20.4170	4513.3825	2531.5345	2732.8633	2819.7168
92.PC(38:3)	8235.6814	1117.4539	1828.2978	5853.1332	1250.2208	5882.8923	1610.4819	2952.1321	3519.1246	1414.6268	2176.8837	1727.8629	7847.8973	6379.0701	2633.1205	5175.1799	6397.7451	5398.3410	5515.5739	4016.2485	6514.4687	2658.5942	1196.1876	1892.6504	2109.1410	1125.7291	2008.8426	1324.5989	1448.6607	5553.8213	1580.4213	2784.6582	1631.5978	1086.7495	5126.4143	6058.6636	5052.9098	4574.2656	5978.7989	2035.8571	1933.6232
93.PC(38:3)	329.1271	36.2317	91.0314	343.6827	56.8240	311.1984	71.8908	107.7907	182.2478	80.2568	94.1518	91.1885	400.7778	234.2841	85.9812	172.7635	270.7236	262.7882	272.8289	165.0894	310.8264	102.7951	58.4605	71.4435	76.5259	49.4242	76.0669	54.3758	59.0104	336.9060	58.0512	127.2777	61.9336	46.9047	200.6584	407.4471	173.0269	158.9369	261.0229	117.0490	104.5212
94.PC(38:3)	14845.2566	2009.9946	2736.0662	727.8331	3242.8059	8774.1883	3249.0190	3468.5584	4343.7291	3885.2581	376.3482	3081.8401	11043.9611	10914.5613	2913.8982	9777.4370	11358.6046	8122.4244	8411.8778	7819.8180	9375.2655	5411.3190	2405.5752	498.5553	3129.8857	3010.6979	3807.1144	3029.5995	2457.2417	8038.9556	413.6957	547.2848	2210.4679	2828.8860	6888.2836	8880.1771	722.8616	9246.4889	8627.7809	2729.7962	2809.6579
95.PC(38:4)	1092.2852	327.7889	1028.8521	3890.5175	206.7291	4701.4483	401.8148	1095.4975	1439.6379	141.8269	1046.5072	910.2082	3038.6652	798.5632	356.7540	710.0468	955.0587	3379.5748	2759.2281	644.0435	2713.2023	436.7455	494.4905	905.9005	589.5612	178.0308	512.7438	201.8993	677.9083	3866.8646	1234.6927	1396.7748	688.4335	221.0667	2789.8514	4378.2409	3406.8378	459.7515	2701.1781	906.9068	662.7394
96.PC(38:4)	31458.7910	11992.0663	14599.5054	6908.6805	17847.9619	11044.9474	16752.9815	18801.9908	22780.4874	21504.8222	15350.3538	16837.4039	13833.3081	23026.1141	17443.4217	24034.9948	24993.2382	12084.8862	16034.6248	20585.8111	13232.4708	15613.3429	13595.1957	13828.0264	16715.1076	17721.6104	21053.8447	17855.6508	14335.0533	10094.1272	10871.0731	14128.9728	14366.9583	16430.9279	10463.2782	12255.9706	13736.0580	24139.1858	12960.9848	15429.2045	16602.3048
97.PC(38:4)	2247.0777	847.3230	2098.0982	5158.5838	104.2743	6483.1459	1198.4380	2085.2332	2985.1873	112.3513	2114.3647	1972.3578	4458.9736	1705.8530	111.3883	1585.7864	1825.9767	4806.0288	4130.3737	1478.9496	4267.8340	1038.7140	1119.8841	1784.0078	1421.7585	115.5653	1276.6878	130.4164	1430.1645	5452.0759	1558.1855	2540.0295	1527.3784	1051.2067	3811.7130	6263.3733	4668.8691	151.1524	4017.4380	1916.4380	1501.7461
98.PC(38:4)	679.4965	480.0564	1021.1311	927.9876	753.6275	1326.3511	716.2058	1053.2318	1430.9759	866.6683	1012.2992	1083.8830	957.7182	638.1786	477.3789	669.8362	751.5738	1091.4928	1175.0762	636.0032	913.7009	524.3834	683.7453	856.3489	745.3933	383.5071	865.5461	379.4203	790.3448	1083.0478	656.8808	994.3843	764.3737	707.8313	912.6681	1332.8548	1287.0726	676.3041	1005.9120	985.2934	869.6304
99.PC(38:4)	601.2112	135.7028	233.1819	730.1948	155.6082	1169.7083	198.3924	208.3352	298.3945	219.8465	271.2045	260.0411	894.1524	536.7948	168.0070	309.9729	290.7556	608.5271	547.1579	277.9989	1091.2119	186.8554	171.8913	209.1857	213.9190	155.5367	184.8882	155.7386	151.4124	993.1496	12060.6009	15894.1471	205.4836	202.0617	493.3545	1270.3312	416.9256	178.3233	759.9133	240.8685	226.7685
9.CE(18:2)	91.1686	30.7278	74.4658	47.9412	104.3063	22.1131	124.4233	167.4139	83.6290	108.4367	540.5737	125.6712	39.0300	68.0432	141.8737	68.4377	78.6801	61.1368	76.2533	65.8333	71.5492	100.5989	93.4535	62.0535	92.0686	79.8741	64.3680	45.3606	84.4542	38.4822	335.8821	162.2830	438.0758	81.4172	69.2545	28.9373	86.2625	53.6825	43.8236	58.7521	100.7353
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	pubchem_id	inchi_key	kegg_id	other_id	other_id_type	ri	ri_type	moverz_quant	
100.PC(38:5)									
101.PC(38:5)									
102.PC(38:5)									
103.PC(38:6)									
104.PC(38:6)									
105.PC(38:6)									
106.PC(39:6)									
107.PC(39:6)									
108.PC(40:4)									
109.PC(40:4)									
10.CE(18:2)									
110.PC(40:5)									
111.PC(40:5)									
112.PC(40:6)									
113.PC(40:6)									
114.PC(40:6)									
115.PC(40:6)									
116.PC(40:7)									
117.PC(40:7)									
118.PC(40:7)									
119.PC(40:8)									
11.CE(20:3)									
120.PC(40:8)									
121.PC(42:6)									
122.PC(42:6)									
123.PC(O-32:0)									
124.PC(O-34:2)									
125.PC(O-34:3) NH4 adduct									
126.PC(O-36:3)									
127.PC(O-38:5)									
128.PC(O-40:6)									
129.PC(P-18:0/22:6)									
12.CE(20:4)									
130.PE(16:0/18:1)									
131.PE(34:0)									
132.PE(34:2)									
133.PE(36:4)									
134.PE(36:4)									
135.PE(38:4)									
136.PE(38:4)									
137.PE(38:6)									
138.PE(38:6)									
139.PE(O-16:0/22:6) or PE(P-18:0/20:5)									
13.CE(20:5)									
140.PE(O-16:0/22:6) or PE(P-18:0/20:5)									
141.PE(O-38:5) or PE(P-38:4)									
142.PE(O-38:5) or PE(P-38:4)									
143.PE(P-18:0/22:6)									
144.PI(18:0/20:4)									
145.PI(18:0/20:4)									
146.SM(d16:1/18:1) or SM(d18:2/16:0)									
147.SM(d18:0/16:0)									
148.SM(d18:1/24:0)									
149.SM(d18:1/24:0)									
14.Cer(d18:1/14:0)									
150.SM(d32:1)									
151.SM(d33:1)									
152.SM(d34:1)									
153.SM(d34:1)									
154.SM(d35:1)									
155.SM(d36:0)									
156.SM(d36:1)									
157.SM(d36:2)									
158.SM(d38:2)									
159.SM(d39:1)									
15.Cer(d18:1/16:0)									
160.SM(d40:1)									
161.SM(d40:1)									
162.SM(d40:1)									
163.SM(d40:2)									
164.SM(d41:1)									
165.SM(d41:1)									
166.SM(d41:2)									
167.SM(d42:1)									
168.SM(d42:1)									
169.SM(d42:2)									
16.Cer(d18:1/22:0)									
170.SM(d42:3)									
171.TG(14:0/16:0/18:1)									
172.TG(14:0/18:1/18:1)									
173.TG(14:0/18:2/18:2)									
174.TG(14:0/18:2/18:2)									
175.TG(16:0/16:0/16:0)									
176.TG(16:0/18:0/18:1)									
177.TG(16:0/18:2/12:0)									
178.TG(16:0/18:2/18:2)									
179.TG(16:0/18:2/18:2)									
17.Cer(d18:1/22:0)									
180.TG(16:0/18:2/18:3)									
181.TG(16:0/18:2/22:6)									
182.TG(16:0/22:5/18:1) or TG(20:4/18:1/18:1)									
183.TG(16:1/18:1/12:0)									
184.TG(18:0/18:0/18:0)									
185.TG(18:0/18:1/20:4)									
186.TG(18:0/18:1/20:4)									
187.TG(18:1/12:0/18:1) or TG(18:2/16:0/14:0)									
188.TG(18:1/18:1/16:0)									
189.TG(18:1/18:1/18:1)									
18.Cer(d18:1/23:0)									
190.TG(18:1/18:1/18:1)									
191.TG(18:1/18:1/22:6)									
192.TG(18:1/18:2/18:2)									
193.TG(18:1/18:2/18:2)									
194.TG(18:2/18:1/16:0)									
195.TG(18:2/18:1/18:1)									
196.TG(18:2/18:1/18:1)									
197.TG(18:2/18:2/18:2) or TG(18:3/18:2/18:1)									
198.TG(18:2/18:2/18:2) or TG(18:3/18:2/18:1)									
199.TG(18:2/22:5/16:0)									
19.Cer(d18:1/24:0)									
1.CE fragment									
200.TG(18:2/22:5/16:0)									
201.TG(18:2/22:5/16:0)									
202.TG(46:0)									
203.TG(47:1)									
204.TG(47:2)									
205.TG(48:0)									
206.TG(48:1)									
207.TG(48:3)									
208.TG(49:0)									
209.TG(49:1)									
20.Cer(d18:1/24:1)									
210.TG(49:2)									
211.TG(49:3)									
212.TG(50:0)									
213.TG(50:0)									
214.TG(50:1)									
215.TG(50:1)									
216.TG(50:2)									
217.TG(50:3)									
218.TG(50:3)									
219.TG(50:5)									
21.Cer(d18:1/24:1)									
220.TG(51:1)									
221.TG(51:2)									
222.TG(51:2)									
223.TG(51:2)									
224.TG(51:3)									
225.TG(51:4)									
226.TG(52:0)									
227.TG(52:2)									
228.TG(52:3)									
229.TG(52:4)									
22.Cer(d18:1/25:0)									
230.TG(52:4)									
231.TG(52:5)									
232.TG(52:6)									
233.TG(52:6)									
234.TG(52:6)									
235.TG(53:2)									
236.TG(53:3)									
237.TG(53:4)									
238.TG(53:4)									
239.TG(53:5)									
23.Cer(d35:1)									
240.TG(53:5)									
241.TG(54:1)									
242.TG(54:2)									
243.TG(54:3)									
244.TG(54:3)									
245.TG(54:4)									
246.TG(54:4)									
247.TG(54:4)									
248.TG(54:5)									
249.TG(54:5)									
24.Cer(d42:1)									
250.TG(54:6)									
251.TG(54:6)									
252.TG(54:7)									
253.TG(54:7)									
254.TG(55:5)									
255.TG(55:5)									
256.TG(56:2)									
257.TG(56:3)									
258.TG(56:4)									
259.TG(56:4)									
25.DG(18:1/18:1))									
260.TG(56:4)									
261.TG(56:5)									
262.TG(56:6)									
263.TG(58:6)									
264.TG(58:6)									
265.TG(58:9)									
266.TG(58:9)									
267.TG(60:7)									
268.TG(60:7)									
269.TG(O-50:1) or TG(P-50:0)									
26.HexCer(d18:1/22:0)									
270.TG(O-52:1) or TG(P-52:0)									
271.TG(O-52:2) or TG(P-52:1)									
27.HexCer(d18:1/24:0)									
28.LPC(16:0)									
29.LPC(16:0)									
2.CE fragment									
30.LPC(16:1)									
31.LPC(18:0)									
32.LPC(18:0)									
33.LPC(18:1)									
34.LPC(18:1)									
35.LPC(18:2)									
36.LPC(20:3)									
37.LPC(20:4)									
38.LPC(22:5)									
39.LPC(22:6)									
3.CE fragment									
40.LysoPE(18:1)									
41.LysoPE(18:1)									
42.PC(16:0/16:0)									
43.PC(16:0/18:1)									
44.PC(16:0e/18:1(9Z))									
45.PC(18:0/18:0)									
46.PC(18:0p/22:6)									
47.PC(30:0)									
48.PC(31:0(OH))??									
49.PC(31:0(OH))??									
4.CE(16:0)									
50.PC(31:0)									
51.PC(32:1)									
52.PC(32:2)									
53.PC(33:0)									
54.PC(33:1)									
55.PC(34:3)									
56.PC(34:3)									
57.PC(34:3)									
58.PC(35:1)									
59.PC(35:2)									
5.CE(16:0)									
60.PC(35:2)									
61.PC(35:3)									
62.PC(35:3)									
63.PC(35:4)									
64.PC(35:4)									
65.PC(36:1)									
66.PC(36:1)									
67.PC(36:1)									
68.PC(36:2)									
69.PC(36:2)									
6.CE(18:0)									
70.PC(36:3)									
71.PC(36:3)									
72.PC(36:3)									
73.PC(36:4)									
74.PC(36:4)									
75.PC(36:4)									
76.PC(36:4)									
77.PC(36:4)									
78.PC(36:5)									
79.PC(36:5)									
7.CE(18:1)									
80.PC(37:1)									
81.PC(37:2)									
82.PC(37:2)									
83.PC(37:3)									
84.PC(37:4)									
85.PC(37:4)									
86.PC(37:4)									
87.PC(37:5)									
88.PC(38:1)									
89.PC(38:2)									
8.CE(18:2)									
90.PC(38:2)									
91.PC(38:3)									
92.PC(38:3)									
93.PC(38:3)									
94.PC(38:3)									
95.PC(38:4)									
96.PC(38:4)									
97.PC(38:4)									
98.PC(38:4)									
99.PC(38:4)									
9.CE(18:2)									
METABOLITES_END
#END