#METABOLOMICS WORKBENCH efahy_20230425_000048 DATATRACK_ID:3943 STUDY_ID:ST002626 ANALYSIS_ID:AN004298 PROJECT_ID:PR001020
VERSION             	1
CREATED_ON             	April 25, 2023, 7:56 am
#PROJECT
PR:PROJECT_TITLE                 	Molecular Transducer of Physical Activity Consortium
PR:PROJECT_SUMMARY               	MoTrPAC is a national research consortium designed to discover and perform
PR:PROJECT_SUMMARY               	preliminary characterization of the range of molecular transducers (the
PR:PROJECT_SUMMARY               	"molecular map") that underlie the effects of physical activity in humans. The
PR:PROJECT_SUMMARY               	program's goal is to study the molecular changes that occur during and after
PR:PROJECT_SUMMARY               	exercise and ultimately to advance the understanding of how physical activity
PR:PROJECT_SUMMARY               	improves and preserves health. Preclinical and clinical studies will examine the
PR:PROJECT_SUMMARY               	systemic effects of endurance and resistance exercise across a range of ages and
PR:PROJECT_SUMMARY               	fitness levels by molecular probing of multiple tissues before and after acute
PR:PROJECT_SUMMARY               	and chronic exercise. This program is the largest targeted NIH investment of
PR:PROJECT_SUMMARY               	funds into the mechanisms of how physical activity improves health and prevents
PR:PROJECT_SUMMARY               	disease. The MoTrPAC program is supported by the NIH Common Fund and is managed
PR:PROJECT_SUMMARY               	by a trans-agency working group representing multiple NIH institutes and
PR:PROJECT_SUMMARY               	centers, led by the NIH Office of Strategic Coordination, National Institute of
PR:PROJECT_SUMMARY               	Arthritis and Musculoskeletal and Skin Diseases, National Institute of Diabetes
PR:PROJECT_SUMMARY               	and Digestive and Kidney Diseases, National Institute on Aging, and National
PR:PROJECT_SUMMARY               	Institute of Biomedical Imaging and Bioengineering. MoTrPAC Steering Committee:
PR:PROJECT_SUMMARY               	Wendy Kohrt, Chair, Russ Tracy, Co-Chair; NIH Program Manager, Concepcion
PR:PROJECT_SUMMARY               	Nierras. Euan Ashley and Matthew Wheeler are the PIs for the Motrpac
PR:PROJECT_SUMMARY               	Bioinformatics / Data Coordination Center.
PR:INSTITUTE                     	MoTrPAC
PR:LAST_NAME                     	Ashley
PR:FIRST_NAME                    	Euan A.
PR:ADDRESS                       	300 Pasteur Dr Rm A265. MC 5319. Stanford CA 94305. USA
PR:EMAIL                         	euan@stanford.edu
PR:PHONE                         	(650) 498-4900
#STUDY
ST:STUDY_TITLE                   	MoTrPAC: Endurance exercise training study in young adult rats, Rat White
ST:STUDY_TITLE                   	Adipose Powder - Targeted Oxylipins
ST:STUDY_SUMMARY                 	The goal of the endurance exercise training study in young adult rats (internal
ST:STUDY_SUMMARY                 	code: PASS1B-06) was to perform exercise training studies in adult (6 month)
ST:STUDY_SUMMARY                 	F344 rats, and from these rats collect as many tissues as feasible in order to
ST:STUDY_SUMMARY                 	provide high quality samples for detailed analysis by chemical analysis sites.
ST:STUDY_SUMMARY                 	Tissues were collected from 10-12 rats sedentary control rats concurrent with
ST:STUDY_SUMMARY                 	the collection of the 8-week training groups. The 8-week training group and
ST:STUDY_SUMMARY                 	controls were from the same cohort and same age at euthanasia (either 8). For
ST:STUDY_SUMMARY                 	the older age group, an additional set of controls (n=5-6) were collected with
ST:STUDY_SUMMARY                 	the 1-2 week training group. Rats were either sedentary or underwent an exercise
ST:STUDY_SUMMARY                 	training program. Rats were exercised on the rodent treadmill 5 days per week
ST:STUDY_SUMMARY                 	using a progressive training protocol designed to exercise the rats at
ST:STUDY_SUMMARY                 	approximately 70% of VO2max as outlined in the Table on the next page. Training
ST:STUDY_SUMMARY                 	was performed no earlier than 10:00 am and no later than 5:00 pm over 5
ST:STUDY_SUMMARY                 	consecutive days per week. Training was initiated with the treadmill set at 70%
ST:STUDY_SUMMARY                 	of VO2 max (see tables) and 5 degrees grade for 20 minutes. The duration of
ST:STUDY_SUMMARY                 	exercise was increased by one minute each day until day 31 of training (start of
ST:STUDY_SUMMARY                 	week 7), when a duration of 50 min was reached. Speed and grade of each training
ST:STUDY_SUMMARY                 	session increased in larger increments due to treadmill parameters. The highest
ST:STUDY_SUMMARY                 	intensity and duration of training began on day 31. This intensity was
ST:STUDY_SUMMARY                 	maintained for the final 10 days of the protocol to ensure steady state had been
ST:STUDY_SUMMARY                 	achieved. If any rats were unable to perform at least 4 days of training per
ST:STUDY_SUMMARY                 	week they were removed from the study and euthanized. It is important to note
ST:STUDY_SUMMARY                 	that the starting treadmill speed varied depending on the sex and age of the
ST:STUDY_SUMMARY                 	rat. The initial and maximum speeds were based on VO2max measurements obtained
ST:STUDY_SUMMARY                 	during the pre-training testing of the compliant rats. Rats assigned to the
ST:STUDY_SUMMARY                 	control group followed a schedule similar to the training group. They were
ST:STUDY_SUMMARY                 	placed in one lane on the treadmill for 15 minutes/day, 5 days per week. The
ST:STUDY_SUMMARY                 	treadmill was set at 0 m/min at an incline that corresponded to the incline
ST:STUDY_SUMMARY                 	being used by the training group.
ST:INSTITUTE                     	Emory University
ST:DEPARTMENT                    	Biochemistry
ST:LABORATORY                    	Integrated Lipidomics and Metabolomics Core
ST:LAST_NAME                     	Ortlund
ST:FIRST_NAME                    	Eric
ST:ADDRESS                       	1510 Clifton Rd. NE, Room G235, Atlanta, GA 30322
ST:EMAIL                         	eortlun@emory.edu
ST:PHONE                         	(404) 727-5014
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Rattus norvegicus
SU:TAXONOMY_ID                   	10116
#SUBJECT_SAMPLE_FACTORS:          	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	-	QC_prerun_1	Group:QC-PreRun | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_prerun_2	Group:QC-PreRun | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_prerun_3	Group:QC-PreRun | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	G_QC_1_4	Group:QC-Reference | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_blank_5	Group:QC-Blank | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	G_QC_2_6	Group:QC-Reference | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_7	Group:QC-Pooled | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	07AF7369-F082-4CA7-99D5-D973F4A162C9	90252017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	9F3E1040-D409-421E-B635-2572DC20ED89	90283017010	Group:Training | Timepoint:4 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	4E974304-21EB-42E8-A729-A7FB6B406E64	90439017010	Group:Training | Timepoint:2 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	A9CE3E3D-31A0-4443-8A7F-8FD831D79248	90410017010	Group:Training | Timepoint:4 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	90CFE5A4-76FE-4458-A2B1-A66F0B60118E	90232017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	BC49E4EF-E2FE-4269-BAF0-461F768BD95D	90217017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	69FD4884-786D-4F2A-97B1-6174FBD25D60	90248017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	6A013AA1-4D1E-4B75-B691-6BA22D928E51	90571017010	Group:Training | Timepoint:1 week of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	AEB1611A-F29E-43F8-B9F3-A2BC4F9EB504	90444017010	Group:Training | Timepoint:2 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	3D5BC47C-BB3D-45A2-8DB8-D7ADCD51997C	90412017010	Group:Training | Timepoint:4 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_18	Group:QC-Pooled | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	DC8B35E8-4AA8-4829-8569-F223D069620C	90578017010	Group:Training | Timepoint:2 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	E4271AF1-899A-4A65-9D8D-BF18CEE3F1CF	90292017010	Group:Training | Timepoint:4 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	F65955CE-E49F-48C7-B861-02A2FDF6F9B8	90227017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	1628FB23-6F66-47D4-8D82-63C87726F0FD	90245017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	0A4A7935-3AF4-463F-84E3-DCF07671509D	90258017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	8904857C-2073-4BBA-AC7C-1EC239E5BFF7	90581017010	Group:Training | Timepoint:2 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	68083256-8DAA-4185-B446-0CAF600474B5	90567017010	Group:Training | Timepoint:1 week of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	1F9BD644-303F-43E7-94BE-FF6654306F5E	90585017010	Group:Training | Timepoint:2 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	0645F621-878C-4C9B-84A6-58862BAA17D9	90564017010	Group:Training | Timepoint:1 week of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	B73AB139-7210-4498-9CCF-E1DBE6EBA71C	90559017010	Group:Training | Timepoint:1 week of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_29	Group:QC-Pooled | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	569A9229-04E8-414A-A195-FE9E8F1B66AB	90289017010	Group:Training | Timepoint:4 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	53F914B0-FD4F-4340-84A6-48341EAB3798	90422017010	Group:Training | Timepoint:1 week of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	2E37478F-525F-4E5E-A882-EE75FD0CFB29	90406017010	Group:Training | Timepoint:4 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	A77AC89A-1D9E-4516-9DA4-2BE99C8126EF	90266017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	0409BED3-F9FE-4C06-9920-74F5E5CA04A3	90587017010	Group:Training | Timepoint:2 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	955498F4-70A0-4D50-A2BA-619A8FED8FEF	90222017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	0DBFEB04-1B58-43CF-BAFD-9AA9915B67F6	90426017010	Group:Training | Timepoint:1 week of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	1CA4210C-3CE6-4A5A-996B-673EBDEB3B81	90281017010	Group:Training | Timepoint:4 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	F0D83B29-8EFA-4CDE-B1AA-2358AC220ECF	90237017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	6527EC12-E7EB-4F17-BF0A-0AC7CD1819A0	90441017010	Group:Training | Timepoint:2 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_40	Group:QC-Pooled | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	0BD282C7-7832-4581-9089-08A32D557034	90218017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	0559B193-BED3-4170-B045-10A2B6441CB6	90229017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	89D6F615-D17C-4EB9-88EB-A602940FF179	90416017010	Group:Training | Timepoint:4 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	B137E81D-A9DE-4E3A-8E2B-AD6C22920B7E	90576017010	Group:Training | Timepoint:2 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	10E282EB-1DBA-406E-BD5D-81027083A01D	90430017010	Group:Training | Timepoint:1 week of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	2479BEE5-2A38-4D09-B15B-B1715F561A9F	90254017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	FDA87A8D-3634-4C42-9A1A-0EA03B58BB01	90449017010	Group:Training | Timepoint:2 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	6D680EA2-C62B-4A35-8B6E-2ED6A79CB017	90421017010	Group:Training | Timepoint:1 week of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	D350D633-8D95-4783-99F2-BB8294D2EC32	90423017010	Group:Training | Timepoint:1 week of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	FE012DC0-AF32-4C70-A4D4-F042B8BC4EC6	90420017010	Group:Training | Timepoint:4 weeks of training | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_51	Group:QC-Pooled | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	0D5071F5-D166-4CF1-BE8B-EB4DF6E04C0E	90251017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	3719CB62-B551-49BE-94A0-E51DFE13D30D	90225017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	EA5C8932-9325-4DA5-96BB-50CD49CEDD10	90560017010	Group:Training | Timepoint:1 week of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	CFE06932-9314-4BCC-B2D9-73883D5FCDFB	90223017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	2B969165-1A52-43AA-8FD9-39AFA62F094F	90267017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	04C84D7E-FC8C-422F-AE4B-CAFADB63407B	90259017010	Group:Training | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	F9BEE1FA-E2DB-4BE4-A79C-99D585D6FD17	90265017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Female	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	22D700B9-EDD0-4BC8-8155-EB9C39417F81	90280017010	Group:Training | Timepoint:4 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	FCE9ABE6-B60B-4934-BAE5-56AF8B11ECEC	90239017010	Group:Control | Timepoint:8 weeks of training or control time | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	CDCFA3F1-07ED-4737-A36D-15EFEC325AA5	90450017010	Group:Training | Timepoint:2 weeks of training | Sex:Male	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_62	Group:QC-Pooled | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	G_QC_1_63	Group:QC-Reference | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	G_QC_2_64	Group:QC-Reference | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_blank_65	Group:QC-Blank | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_SRM	Group:QC-Reference | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_67	Group:QC-Pooled | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_blank_68	Group:QC-Blank | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_blank_69	Group:QC-Blank | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_Standard_70	Group:QC-ExternalStandard | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_Standard_71	Group:QC-ExternalStandard | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_Standard_72	Group:QC-ExternalStandard | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_Standard_73	Group:QC-ExternalStandard | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_Standard_74	Group:QC-ExternalStandard | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_Standard_75	Group:QC-ExternalStandard | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_Standard_76	Group:QC-ExternalStandard | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_Standard_77	Group:QC-ExternalStandard | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_blank_78	Group:QC-Blank | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
SUBJECT_SAMPLE_FACTORS           	-	QC_blank_79	Group:QC-Blank | Timepoint:0 hour | Sex:-	raw_file=Pass1B_neg_Wadipose_V1-2020-04-16.wiff
#COLLECTION
CO:SAMPLE_TYPE                   	White adipose
#TREATMENT
TR:TREATMENT_SUMMARY             	-
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	purification of oxylipids with SPE column
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	Lipids were separated by liquid chromatography with 20 minutes gradient
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	ExionLC AC
CH:COLUMN_NAME                   	ThermoScientific Accucore C18 (100 x 4.6mm, 2.6um)
CH:SOLVENT_A                     	100% water; 10 mM ammonium acetate
CH:SOLVENT_B                     	100% acetonitrile; 10 mM ammonium acetate
CH:FLOW_GRADIENT                 	t=0 min: 90%/10% (%A/%B) @ 0.5 ml/min | t=0.5 min: 90%/10% (%A/%B) @ 0.5 ml/min
CH:FLOW_GRADIENT                 	| t=1 min: 50%/50% (%A/%B) @ 0.5 ml/min | t=2 min: 50%/50% (%A/%B) @ 0.5 ml/min
CH:FLOW_GRADIENT                 	| t=2.1 min: 25%/75% (%A/%B) @ 0.5 ml/min | t=5 min: 25%/75% (%A/%B) @ 0.5
CH:FLOW_GRADIENT                 	ml/min | t=7 min: 15%/85% (%A/%B) @ 0.5 ml/min | t=12 min: 15%/85% (%A/%B) @ 0.5
CH:FLOW_GRADIENT                 	ml/min | t=12.1 min: 90%/10% (%A/%B) @ 0.5 ml/min | t=18 min: 90%/10% (%A/%B) @
CH:FLOW_GRADIENT                 	0.5 ml/min
CH:FLOW_RATE                     	0.5 ml/min
CH:COLUMN_TEMPERATURE            	50C
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:ANALYSIS_DETAILS:             	Peak integration, concentrations calculated base on standards curves equations,
AN:ANALYSIS_DETAILS:             	in the result file data represented in ng/mg of tissue
#MS
MS:INSTRUMENT_TYPE               	Triple quadrupole
MS:INSTRUMENT_NAME               	ABI Sciex 5500 Qtrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	Multiple reaction monitoring mode (MRM)
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	ng/uL
MS_METABOLITE_DATA_START
Samples	QC_prerun_1	QC_prerun_2	QC_prerun_3	G_QC_1_4	QC_blank_5	G_QC_2_6	90252017010	90283017010	90439017010	90410017010	90232017010	90217017010	90248017010	90571017010	90444017010	90412017010	90578017010	90292017010	90227017010	90245017010	90258017010	90581017010	90567017010	90585017010	90564017010	90559017010	90289017010	90422017010	90406017010	90266017010	90587017010	90222017010	90426017010	90281017010	90237017010	90441017010	90218017010	90229017010	90416017010	90576017010	90430017010	90254017010	90449017010	90421017010	90423017010	90420017010	90251017010	90225017010	90560017010	90223017010	90267017010	90259017010	90265017010	90280017010	90239017010	90450017010	G_QC_1_63	G_QC_2_64	QC_blank_65	QC_SRM	QC_blank_68	QC_blank_69	QC_blank_78	QC_blank_79	QC_7	QC_18	QC_29	QC_40	QC_51	QC_62	QC_67	QC_Standard_70	QC_Standard_71	QC_Standard_72	QC_Standard_73	QC_Standard_74	QC_Standard_75	QC_Standard_76	QC_Standard_77
11,12-DiHETrE	1.77370258	2.034704337	2.092336589	0	0	0.580398613	0.527823696	0.563497727	0.59828292	0.582417067	0.572520923	0.560221754	0.547168254	0.532172942	0.557632226	0.56051939	0.572428076	0.599732743	0.539932142	0.584573382	0.5228891	0.571496084	0	0	0.535557071	0.555254319	0.5314394	0.577579714	0	0	0	0.595855542	0.578596662	0.604105706	0.509838311	0.6282885	0.573152459	0.557391708	0.537396283	0.538180937	0.546324546	0.540603006	0.511850319	0.574233415	0.548556486	0.524948689	0.55682998	0.566729396	0.549861889	0.653860389	0.517111835	0.588760813	0.544276726	0.531802632	0.522279769	0.521323625	0	0.536547643	0	0.522787763	0.507450999	0	0.6082509	0.526196959	0.57151885	0.583753377	0.554727825	0.516966072	0.548147295	0.576299819	0.538930705	0.15	0.3	0.6	1.25	2.5	5	10	20
11,12-EpETrE	3873.967076	4171.218088	4437.772955	146.089826	0	90.95976082	76.04283174	109.3794074	97.2425013	56.80093787	55.36994817	69.85572912	28.10423504	62.39384979	65.38971676	63.36633562	84.70672104	78.37822432	176.4893047	101.5901574	81.42106401	68.55449888	70.50157277	80.76433113	86.8605093	41.70712466	35.6750322	60.67313154	49.728163	55.67193084	109.2271918	97.44368404	70.65898692	90.7287309	54.98449001	122.1310358	97.22184733	63.79306426	48.96780504	96.47649886	44.85845093	99.34902764	73.99276572	97.31718904	61.03350382	52.8352474	45.9018202	94.18432151	51.66757431	93.56155553	47.3202577	71.44272568	35.27835808	67.50881275	57.0015813	70.65199046	75.62071923	50.14546479	0	0	0	0	0	0	30.61599672	36.87529914	37.58522735	38.56304305	25.9333618	19.10014635	25.44840036	0.15	0.3	0.6	1.25	2.5	5	10	20
12-HETE	137.8588398	146.0261314	156.2481399	4.731695118	0.521833856	2.6019306	3.934029636	6.869643405	8.233224643	3.971680158	13.6985329	5.450686947	3.075721878	11.02519638	10.53925177	4.48989315	7.277945634	10.35336857	11.79927543	6.601296205	5.168684384	11.59270737	4.054079948	5.826237512	5.35616018	2.696557793	3.744300327	8.383534844	4.974359375	8.38575218	13.24319096	3.71465979	12.54409689	8.764355894	4.655317234	7.425273562	5.078680046	6.17633229	5.894299078	4.383025527	5.795812267	10.0504304	5.785354605	7.810158845	4.754397401	3.011214449	7.45078615	9.104856184	2.68501133	7.562016957	4.019509258	12.69358904	4.236529627	2.689738511	5.556846411	4.57732721	1.999883686	1.693373118	0	0	0	0	0.264073444	0	11.41830002	10.89448969	12.59875559	11.98223706	11.20756106	6.708682334	11.75528953	0.15	0.3	0.6	1.25	2.5	5	10	20
13-HODE	468.0513264	512.1534274	498.3248145	51.54621914	0	43.53474909	71.23717044	116.7403585	100.1896566	47.18841658	31.62626218	75.23083998	57.64486192	93.88238127	67.67789304	58.7149511	55.14054268	57.86742399	84.9012621	82.70299249	87.11519893	72.20645083	80.1492564	96.2965059	104.4374161	78.09588976	43.91049657	74.56151379	60.29562035	66.99529037	94.38511851	72.45023046	95.91233156	89.93892175	56.5701643	123.9519598	74.4440604	78.166123	70.04289759	77.63145508	82.14208194	55.34979576	74.39388754	48.24967117	49.78424445	56.91573779	46.88323341	54.9979375	49.88438296	52.36256851	62.67747972	66.27590107	40.40599537	62.08597041	52.28780679	60.50514055	37.58350021	27.35061715	0	0	0	0	0	0	108.7424149	96.50108021	106.70328	131.4758691	100.5635595	84.37183537	104.6703357	0.15	0.3	0.6	1.25	2.5	5	10	20
13-HpODE	2600.289317	2871.55973	3045.492972	0	0	7.933569072	135.7741582	5.131558915	13.01780374	116.6400362	7.762887867	13.43303732	39.95887443	340.4280519	5.80057596	20.19639346	26.52842612	23.85823442	25.90144786	14.06817119	71.77197312	6.573830717	15.35783603	183.465321	9.810343189	0	158.5886543	18.34098428	182.9440422	204.6834707	155.7840332	51.66174919	2.59042875	26.21884008	7.039960823	14.92501019	123.8195996	2.882154904	231.0729597	8.00643948	355.372701	19.77168219	11.37773124	28.45777396	98.25695548	34.03905906	33.84375584	11.79178568	0.830244529	3.34906139	11.2288522	17.11633296	20.69080529	7.040046149	8.268428533	9.921217133	6.131418469	5.346862965	0	788.070504	0	0	0	0	18.0921722	8.502596127	30.4363318	57.38750446	14.14110787	23.70174317	17.10728432	0.125	0.25	0.5	1	2	4.16	8.3	16.6
13-Oxo-ODE	44.58540844	49.70230518	51.77152689	3.604337665	0	0.355153274	2.896109108	5.670059211	3.464775713	4.047437499	29.26162493	1.287660202	0.86431119	3.796890603	3.845971441	2.632994458	12.88300372	11.1554818	5.70023711	3.339853524	3.122903259	10.85313469	1.37241962	2.001443011	2.364648703	2.408897141	1.745721556	4.082543592	5.936258177	2.696048951	2.227889443	2.92198646	4.375839204	4.098803033	1.772502732	2.684343038	1.827474955	1.722775423	2.170399976	6.751919807	9.266350961	13.57643624	2.668608532	15.95921741	3.632939547	2.042340183	17.11255631	1.535741204	2.094230871	17.07945714	1.483227336	8.573912215	12.37313523	3.58182653	1.524976646	4.867644241	0	0	0	0	0	0	0	0	3.711192147	6.134014069	4.970800254	2.920658884	3.344474901	2.848576491	5.162581638	0.15	0.3	0.6	1.25	2.5	5	10	20
14,15-DiHETrE	2.028397858	2.095676406	2.079494676	0.236968208	0	0.228047317	0	0	0	0.216002882	0	0.210763471	0	0	0	0	0	0	0.283907253	0	0.292293607	0.332492693	0.194838358	0.259921067	0	0	0	0	0.303932328	0	0.243817485	0.418984866	0	0	0.196892372	0.270684455	0.226982444	0	0	0	0	0.348262178	0.21577945	0.30594022	0	0.235758817	0	0.170501179	0	0.29751196	0	0	0	0	0.233414672	0	0	0	0	0	0	0	0	0.185956964	0.277702546	0	0.270606571	0.214289097	0.189551016	0	0	0.15	0.3	0.6	1.25	2.5	5	10	20
14,15-EpETrE	126.0453637	108.5845529	129.9727289	4.86539708	6.005529644	8.856099528	1.921660429	0	4.088055737	2.974756257	23.88358135	11.15683487	3.943703115	5.035042538	3.135409368	0	6.567630076	9.714603177	9.737741612	2.377673717	3.332386473	10.58356953	5.372976122	3.250582282	4.822305029	5.392079632	2.738488302	6.65859852	3.037294336	1.68094741	6.335972119	6.140617292	3.351579033	0	7.616910617	8.208916739	0	1.914540744	4.861467689	5.814974033	7.56332516	6.121565951	7.859343031	15.80456209	12.59358561	7.082381038	12.95573577	9.207424559	2.890652499	5.513120027	5.10272151	8.269233634	2.378632297	2.004695461	3.29248735	6.868799093	0	0	0	1.758533053	2.453771968	1.180705174	0	0	0	7.063294765	6.119571454	8.455925554	4.282491855	6.317041857	4.234244673	0.15	0.3	0.6	1.25	2.5	5	10	20
20-HETE	10.41491882	9.501969568	10.69740297	10.16368941	12.34757187	9.826645799	16.12106708	10.1236848	14.53664627	8.687865911	68.463068	15.49202566	15.86808992	7.792892201	14.4729278	9.161027055	36.95849193	22.6880603	16.14732708	12.03086153	1.689320296	37.60421355	11.71526378	3.807492019	13.07822176	9.035015228	12.1750937	19.48149624	18.11315362	8.477923423	8.671664874	12.55323907	11.57767306	13.29541891	10.09840485	10.38499275	17.66683718	12.43717419	11.86628966	23.2963729	4.599198586	17.88915103	5.640019552	23.46366935	25.43788869	14.56794106	31.78961739	8.057367929	7.692133842	21.15144611	26.82297639	16.50142161	24.21099622	28.62664852	11.25246734	18.47946666	5.959369546	6.357375926	14.93690504	4.211497739	6.868704831	0	1.165071437	0	6.745629344	18.69740548	13.1530737	11.96844527	12.4546963	6.062949769	10.05051048	0.15	0.3	0.6	1.25	2.5	5	10	20
5-HETE	524.5929997	514.3092999	549.1725218	1.171424849	0	1.020422782	1.007598553	1.672606388	1.460450858	1.239769166	1.147699382	1.049122164	0.766219012	1.115623092	1.230906681	0.952683653	1.283740435	1.201687485	1.75841299	1.269624893	1.119203783	1.173996144	1.492286688	1.322910683	1.600142653	0.971604439	0.769796944	1.304879335	1.076080653	1.037393738	1.338139248	1.797544833	1.457316105	1.253499264	0.956024855	1.526220424	1.124141124	1.297582226	1.075192367	1.756207309	0.844826124	0.936202083	1.179607899	1.394672733	1.192983264	1.00552557	0.998843841	1.351254894	1.323151812	1.468090026	0.979591658	1.41097012	0.649789166	0.890863325	0.978352041	1.009891973	0.778602783	0.825729719	0	0.757203945	0.301010119	0	0.349785296	0.320580952	0.991695472	0.923473589	0.988497773	0.941520643	0.881045026	0.804760924	0.952393205	0.15	0.3	0.6	1.25	2.5	5	10	20
5,6-DiHETrE	1.515269389	1.173028525	1.30396434	0.162683804	0	0.228939147	0.174950217	0.190652975	0.196067182	0	0.169278259	0.162289157	0.169612639	0.159017889	0.172363671	0.161130636	0.156990924	0.189397531	0.254424099	0.159544897	0.197713	0.175272181	0.172809263	0.184604452	0	0.179647922	0.173651132	0.160228699	0	0.179745508	0.194356729	0.16306959	0.176142668	0.164227181	0.183414188	0.225719392	0.201591773	0.223579714	0.177501339	0.173607295	0.160860411	0	0.202612455	0.281240169	0.16696482	0.181409785	0.163700046	0.220504275	0.16628678	0.278556546	0.177595049	0.178976171	0.169551035	0.182804591	0.185621468	0.18126678	0.202783103	0.185872224	0.155486691	0.155404709	0	0	0.15988921	0	0.159478252	0.178069952	0.164532151	0.190466477	0.180362613	0.193955927	0.160310852	0.015	0.03	0.06	0.126	0.25	0.5	1	2
8,9-DiHETrE	1.971870907	2.132471692	2.193581258	0.049042328	0.027802527	0.058629921	0.037085773	0.047702422	0.038710275	0.032732628	0.321933376	0.030781556	0.029550636	0.06360037	0.177470444	0.038575955	0.180428847	0.123152388	0.062108343	0.065820403	0.038339467	0.137318457	0.036572944	0.040465543	0.032035216	0.05639233	0.032793757	0.040324457	0.080128323	0.041420354	0.022248989	0.081492982	0.049212977	0.032306302	0.033441491	0.050921468	0.028122683	0.050553144	0.021423148	0.084397705	0.092765015	0.168688189	0	0.190234678	0.045451545	0.026207789	0.192706163	0.060880265	0.03008554	0.189775363	0.037474577	0.091090728	0.187844478	0.066558133	0.052870938	0.084316827	0.029738996	0.033846262	0.023206523	0	0.021732901	0	0.024981961	0	0.027324495	0.050380397	0.054869298	0.027181494	0.026748654	0.06092946	0.053648586	0.015	0.03	0.06	0.125	0.25	0.5	1	2
8,9-EpETrE	162.6905915	171.7996229	181.8040729	0.738976837	0	0.666489078	0.572354622	1.310394885	1.468372525	0.550248955	1.053805151	0.878632323	0.344143438	1.270195169	1.299575127	0.501523781	0.77703184	1.408634286	2.135989099	1.061745569	0.92306079	1.140549921	0.677296767	0.773854546	0.80417118	0.583120808	0.455258449	1.243399245	0.656067486	1.121438192	2.075058011	1.197043576	1.849946479	1.641095087	0.746987692	1.362848434	1.157987685	1.227837186	0.740308525	0.563025592	0.709103492	0.799319246	0.802171144	0.988351678	0.911320148	0.53189278	0.287036421	1.663282406	0.397552746	1.088246496	0.542509555	1.399395531	0.263989717	0.531804222	0.683673751	0.701341857	0.346648195	0.263680815	0	0	0	0	0	0	1.426912878	1.189555192	1.335153345	1.490968472	1.219360064	0.782471856	1.27136921	0.15	0.3	0.6	1.25	2.5	5	10	20
9-HETE	3996.275787	4637.377386	4646.663747	134.7037674	0	93.76847706	78.12853778	118.194006	96.02882787	66.55278648	62.84442333	88.01504421	31.08423615	64.26716019	67.20268862	56.50874642	78.13863445	73.52300407	177.1807226	104.7024078	82.31328273	86.78302424	63.24920504	77.03314442	82.55452381	54.04429912	44.39072863	69.98323637	58.93043641	58.44770802	90.70944514	99.16458173	88.03942355	108.5287355	62.47586981	126.8203421	104.0654036	69.104909	51.37219207	90.24004222	44.31545684	88.81531585	89.48379973	101.9675138	73.53950145	53.05358583	56.68613995	91.73447031	54.01738688	95.95084202	55.21860859	81.98640586	35.53134733	76.65874835	54.17482854	69.8144057	81.5245489	49.00091698	0	0	0	0	0	0	32.49712732	29.47410938	35.27565804	34.02551593	30.93785202	19.23237498	26.14495464	0.15	0.3	0.6	1.25	2.5	5	10	20
9-HODE	392.8714484	412.1502608	414.470112	25.08822211	0	20.12856464	30.06542674	51.16033746	36.70155231	22.45510483	20.91854327	27.60615762	20.54359968	29.3618449	25.67602759	27.01894899	29.07193895	28.97150811	43.20962433	34.74067607	34.58308132	31.46502443	27.75851262	31.76584635	38.94712091	30.17852501	18.3151828	29.56226751	24.7618501	24.86745482	30.50310263	32.88376379	32.94047344	36.72123877	22.83081681	46.65631006	31.18548993	30.45306228	25.26158167	34.29935166	33.15830625	27.32093663	29.40206388	29.54942924	22.25522163	24.21049105	25.87258678	24.79582938	21.81294736	29.41506433	25.86885218	23.59574884	20.48967108	27.75934088	18.17289426	27.76650893	15.66833098	12.8916864	0	0	0	0	0	0	52.66919243	52.64931367	55.5416046	61.15047669	49.51678284	40.81867951	51.28232368	0.14	0.28	0.56	1.135	2.27	4.5	9	18
9-HOTrE	1156.678507	1281.488342	1297.949014	117.588611	16.38561404	32.79134218	92.8513953	139.2348711	96.43704149	112.6384625	576.4359452	63.27314141	47.90150053	121.9859375	109.1013682	98.94944139	297.5294449	268.708397	135.7382559	130.140593	90.36560637	279.7381901	69.83705055	94.34587739	103.0409713	93.88389106	72.29205944	120.0185358	163.3607381	92.87339192	80.94988327	62.78744215	115.4040277	93.1649876	59.05118124	109.1257763	60.60104337	50.1383153	97.24834753	191.1828595	245.5932568	323.3933372	95.27312346	332.1333618	88.47053807	72.46323849	375.2548897	49.0248246	82.18019543	370.8483756	60.0876015	198.9630015	277.0522692	105.6674495	52.18807222	138.0293405	40.98158344	23.54572441	0	1.225058826	0	0	0	0	153.0775427	208.4555469	187.4511519	157.6355653	134.3277954	110.3184221	188.0926334	1.5	3	6	12.5	25	50	100	200
9S-HpODE	1077.687825	1029.631155	1171.690532	141.2607221	265.9646105	154.6646081	254.3607841	286.7371432	310.1879705	261.1189571	862.4494547	256.5649213	229.9167726	254.7096462	260.4522808	319.2880966	538.7711653	417.5174674	331.690871	282.8151711	263.849676	558.4644568	256.6195473	316.6716716	245.8450634	256.1310565	258.4929171	397.3078344	317.7955884	282.2870904	269.3648688	258.5525892	328.8402051	321.0632727	273.3283846	269.3480593	220.7513128	235.5883467	284.8713193	318.8357772	251.8746615	356.0988708	292.5524182	513.0033831	354.227957	205.4298916	357.3944824	174.2144223	189.4692427	228.4146525	285.9585715	246.6146753	330.1178324	245.7234923	306.7451654	255.9712597	125.4215333	207.689423	259.5359576	127.3591176	242.3582289	0	0.385642949	0	168.0553145	190.1547146	201.0655829	246.1467306	181.6982558	203.5657881	220.8546417	0.125	0.25	0.5	1	2	4.16	8.3	16.6
9,10-DiHOME	0.62719825	0.615123672	0.576404339	4.157609533	0.101801173	2.343511193	6.234302747	2.564824102	2.198470898	6.259090852	3.36500305	3.069870249	4.643031389	2.646901363	1.534372959	5.046344433	4.081707853	2.62141204	10.34589364	5.900906623	9.805932851	2.441239805	2.349160669	2.863866667	3.983675208	4.330934638	1.629984656	1.729016135	2.826455376	3.838003527	3.935599481	9.878291198	2.995880719	4.436193694	2.352738384	2.369797944	2.937047957	2.949658647	5.105601823	4.620011814	2.178748817	3.079348499	2.123415508	2.722460119	2.543883497	5.233978071	6.507560486	3.278133509	1.952509632	2.442297066	3.222120761	2.800420197	2.92976332	1.799658329	1.955147735	1.552317203	2.914101358	1.475067499	0.094434067	0.204185434	0	0.11832722	0.238769125	0.148299088	13.07146225	12.8902205	12.81516887	15.0557929	11.08171921	12.3151166	10.77551154	0.15	0.3	0.6	1.25	2.5	5	10	20
LTB4	185.1805974	181.4671832	176.0954611	4.163620438	2.422580273	0	3.336729104	3.07666545	1.924051693	2.283498315	11.85619899	0	0	2.389887847	3.223974386	1.836823284	4.946936662	11.30239223	2.426213456	1.980680532	0	10.10068498	1.935991032	1.502318445	0	2.125831276	1.751855977	3.133310652	5.622115702	1.536750053	0	0	1.80207783	0	2.225710692	0	0	0	0	5.576514646	3.640004888	13.27145223	0	13.54992566	3.100899708	2.46355904	6.395932033	0	2.474088864	16.96511273	0	10.66847202	12.05995517	3.887704128	1.518591931	3.533194874	1.625305247	0	0	0	0	0	0	0	0	0	3.438079503	0	0	3.857575282	3.899659519	0.15	0.3	0.6	1.25	2.5	5	10	20
PGE2	340.6061627	294.6537852	334.1496348	489.987134	0	196.1555699	320.4223335	65.25979423	156.8514204	220.3717601	252.1983976	249.4433054	323.9944166	180.8490535	119.2106485	207.9063298	251.2465733	73.68287639	295.4163844	409.7296203	375.0635587	166.3468728	162.7170986	186.6000728	266.1283196	288.9208684	91.95008053	124.124521	121.8053589	309.1841848	174.753763	396.7003218	221.2927788	177.4180267	207.7178717	169.8134857	205.5106793	253.189608	252.5176634	353.0482659	222.2600658	174.5097346	105.6062928	163.4521401	167.6130506	219.9444396	575.1759194	138.7716396	171.7934772	134.3043128	109.4191663	102.9507388	202.9571513	83.52903987	159.9276874	67.41045082	454.4290662	102.4556699	0	390.5075193	0	0	0	0	806.9903082	766.2490814	810.9776346	867.2677446	729.9408728	757.9398178	743.0843391	1.5	3	6.25	12.5	25	50	100	200
Resolvin D1	13.19537205	12.10695697	13.83627829	3.07243495	2.757353109	2.338895254	3.655133364	4.427574652	3.432601404	4.053050804	13.16612995	3.091134603	2.49798252	3.784619424	3.481257535	3.632056075	7.566830274	7.309411742	4.938017481	3.821502661	3.229820135	7.220802576	2.751769119	2.602532313	2.363286037	2.666080012	2.935151405	3.853206329	4.456688756	3.452859254	2.564760867	3.525970177	3.654358193	3.107314165	2.793306691	2.832487308	0	0	2.660618101	5.656339489	6.062660396	8.28794627	3.92654885	9.665196217	3.610489122	3.287241831	8.872343511	2.079654079	3.285970698	8.219025773	2.55433325	5.788041909	7.52390183	4.123027386	2.715874011	4.427080211	2.257420498	0	0	0	0	0	0	0	3.380692304	4.090875392	3.20141749	3.194811131	3.50884903	3.082841112	3.789447815	0.15	0.3	0.6	1.25	2.5	5	10	20
Resolvin D2	12.46525905	10.84287593	12.85136606	3.967188422	2.058319043	1.572371397	3.101254526	2.923540836	2.863938941	3.191739188	13.19006403	0	2.217146272	3.12774552	4.089240533	2.776163809	7.74542227	6.476606166	4.053106784	2.558539419	2.494388059	5.687122317	2.204595003	2.759742546	2.242449363	2.527348912	2.470496196	3.773020109	4.963884004	2.553995763	2.901714925	2.47214108	3.708629078	3.164849578	2.236453273	1.94875295	2.377499743	2.42571759	2.254225795	4.148605836	4.921952517	6.008127089	2.543728402	7.804614555	3.033547907	2.291376103	6.964414096	1.968236278	2.646657223	9.374207755	2.253509442	6.115377323	6.070876968	3.290089979	2.516885762	4.03749454	1.604588492	1.554198137	0	1.473355771	0	0	0	1.450148228	3.028849358	4.045625852	4.009584602	2.540651315	3.030953864	2.715151644	3.002872133	0.15	0.3	0.6	1.25	2.5	5	10	20
Resolvin D3	2.027698227	1.861834098	1.973525705	0.516474987	0	0.530335069	0.515343919	0.54149527	0	0	0.520353267	0	0	0	0.542433266	0.528044588	0.526147547	0.573108324	0.529678632	0	0.532252977	0	0.521401462	0.522818116	0.514700006	0.522399067	0	0.524311388	0	0	0	0.554178436	0.530861948	0.515353091	0.534281663	0.541041333	0	0.532706953	0	0	0.558660775	0.522552438	0	0.534409867	0.538614436	0.520969999	0.543879554	0.525104676	0.515975352	0.522517145	0	0	0	0.527283796	0.517654654	0	0	0	0	0.510505622	0.524063605	0	0.580765967	0.535092256	0.51406335	0.524070707	0	0.51703612	0	0	0	0.15	0.3	0.6	1.25	2.5	5	10	20
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	formula	mz	neutral_mass	refmet_name	rt
11,12-DiHETrE	C20H32O4	337.3	338.2457096	11,12-DiHETrE	5.3
11,12-EpETrE	C20H32O3	319.3	320.2351449	11,12-EpETrE	7.3
12-HETE	C20H32O3	319.3	320.2351449	12-HETE	6.3
13-HODE	C18H32O3	295.3	296.2351	13-HODE	5.8
13-HpODE	C18H32O4	311.2	312.2300595	13-HpODE	3.4
13-Oxo-ODE	C18H30O3	293.2	294.2194948	13-Oxo-ODE	6.1
14,15-DiHETrE	C20H34O4	337	338.2457096	14,15-DiHETrE	5.1
14,15-EpETrE	C20H32O3	319.3	320.2351449	14,15-EpETrE	5.5
20-HETE	C20H32O3	319.3	320.2351449	20-HETE	5.5
5,6-DiHETrE	C20H34O4	337.3	338.2457096	5,6-DiHETrE	5.6
5-HETE	C20H32O3	319	320.2351449	5-HETE	6.6
8,9-DiHETrE	C20H32O4	337.3	320.2351449	8,9-DiHETrE	5.2
8,9-EpETrE	C20H32O3	319.3	320.2351449	8,9-EpETrE	6.4
9,10-DiHOME	C18H34O4	313.3	314.2457	9,10-DiHOME	5.1
9-HETE	C20H32O3	319.3	320.2351449	9-HETE	7.3
9-HODE	C18H32O3	295.3	296.2351449	9-HODE	5.9
9-HOTrE	C18H30O3	293.3	294.2194948	9-HOTrE	5.4
9S-HpODE	C18H32O4	311.3	312.2300595	9S-HpODE	5.1
LTB4	C20H32O4	335.3	336.2301	LTB4	4.9
PGE2	C20H32O5	271.3	352.2249741	PGE2	4.8
Resolvin D1	C22H32O5	375.3	376.2249741	Resolvin D1	4.4
Resolvin D2	C22H32O5	375.3	350.2093241	Resolvin D2	5.1
Resolvin D3	C22H32O5	375.3	350.2093241	Resolvin D3	4.2
METABOLITES_END
#END