#METABOLOMICS WORKBENCH ijochmans_20230717_034505 DATATRACK_ID:4168 STUDY_ID:ST002784 ANALYSIS_ID:AN004531 PROJECT_ID:PR001736
VERSION             	1
CREATED_ON             	July 18, 2023, 9:41 am
#PROJECT
PR:PROJECT_TITLE                 	Metabolic changes during normothermic isolated kidney perfusion
PR:PROJECT_TYPE                  	Experimental
PR:PROJECT_SUMMARY               	Normothermic isolated kidney perfusion is being developed as a method to
PR:PROJECT_SUMMARY               	preserve donor kidneys and to assess their future function before they are
PR:PROJECT_SUMMARY               	transplanted. Donor kidneys can be exposed to different types and degrees of
PR:PROJECT_SUMMARY               	ischemic injury before they are preserved. This project studies how the
PR:PROJECT_SUMMARY               	metabolome changes in relation to different types and degrees of ischemia.
PR:INSTITUTE                     	KU Leuven
PR:DEPARTMENT                    	Microbiology, Immunology and Transplantation
PR:LABORATORY                    	Lab of Abdominal Transplantation
PR:LAST_NAME                     	Jochmans
PR:FIRST_NAME                    	Ina
PR:ADDRESS                       	Herestraat 49, Leuven, 3000, Belgium
PR:EMAIL                         	ina.jochmans@kuleuven.be
PR:PHONE                         	None
PR:FUNDING_SOURCE                	FTBO, KOOR, FWO
PR:CONTRIBUTORS                  	Julie De Beule, Bart Ghesquière, Ina Jochmans
#STUDY
ST:STUDY_TITLE                   	Metabolic changes of the pig kidney during isolated normothermic perfusion with
ST:STUDY_TITLE                   	red blood cell based perfusate - perfusate
ST:STUDY_SUMMARY                 	This study investigates how glucose, lactate and 20 amino acids in the perfusate
ST:STUDY_SUMMARY                 	of normothermically perfused pig kidneys changes over time. It also studies how
ST:STUDY_SUMMARY                 	type and severity of ischemia before perfusion (cold or warm ischemia) change
ST:STUDY_SUMMARY                 	this profile.
ST:INSTITUTE                     	KU Leuven
ST:DEPARTMENT                    	Microbiology, Immunology and Transplantation
ST:LABORATORY                    	Lab of Abdominal Transplantation
ST:LAST_NAME                     	Jochmans
ST:FIRST_NAME                    	Ina
ST:ADDRESS                       	Herestraat 49, Leuven, 3000, Belgium
ST:EMAIL                         	ina.jochmans@kuleuven.be
ST:NUM_GROUPS                    	3
ST:TOTAL_SUBJECTS                	10 kidneys
ST:NUM_MALES                     	5 male pigs
ST:STUDY_TYPE                    	Experimental
ST:PHONE                         	None
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Sus scrofa
SU:TAXONOMY_ID                   	9823
SU:AGE_OR_AGE_RANGE              	~4 months
SU:WEIGHT_OR_WEIGHT_RANGE        	35-45 kg
SU:GENDER                        	Male
SU:ANIMAL_ANIMAL_SUPPLIER        	TOPIGS TN70, Tojapigs, the Netherlands
SU:ANIMAL_LIGHT_CYCLE            	12 hours
SU:ANIMAL_WATER                  	ad libitum
#FACTORS
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data
SUBJECT_SAMPLE_FACTORS           	45	45_T0	Group:WI | Timepoint:0	RAW_FILE_NAME=45_T0.mzML
SUBJECT_SAMPLE_FACTORS           	45	45_T0.25	Group:WI | Timepoint:15	RAW_FILE_NAME=45_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	45	45_T0.50	Group:WI | Timepoint:30	RAW_FILE_NAME=45_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	45	45_T0.75	Group:WI | Timepoint:45	RAW_FILE_NAME=45_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	45	45_T1	Group:WI | Timepoint:60	RAW_FILE_NAME=45_T1.mzML
SUBJECT_SAMPLE_FACTORS           	45	45_T2	Group:WI | Timepoint:120	RAW_FILE_NAME=45_T2.mzML
SUBJECT_SAMPLE_FACTORS           	45	45_T3	Group:WI | Timepoint:180	RAW_FILE_NAME=45_T3.mzML
SUBJECT_SAMPLE_FACTORS           	45	45_T4	Group:WI | Timepoint:240	RAW_FILE_NAME=45_T4.mzML
SUBJECT_SAMPLE_FACTORS           	46	46_T0	Group:WI | Timepoint:0	RAW_FILE_NAME=46_T0.mzML
SUBJECT_SAMPLE_FACTORS           	46	46_T0.25	Group:WI | Timepoint:15	RAW_FILE_NAME=46_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	46	46_T0.50	Group:WI | Timepoint:30	RAW_FILE_NAME=46_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	46	46_T0.75	Group:WI | Timepoint:45	RAW_FILE_NAME=46_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	46	46_T1	Group:WI | Timepoint:60	RAW_FILE_NAME=46_T1.mzML
SUBJECT_SAMPLE_FACTORS           	46	46_T2	Group:WI | Timepoint:120	RAW_FILE_NAME=46_T2.mzML
SUBJECT_SAMPLE_FACTORS           	46	46_T3	Group:WI | Timepoint:180	RAW_FILE_NAME=46_T3.mzML
SUBJECT_SAMPLE_FACTORS           	46	46_T4	Group:WI | Timepoint:240	RAW_FILE_NAME=46_T4.mzML
SUBJECT_SAMPLE_FACTORS           	47	47_T0	Group:Control | Timepoint:0	RAW_FILE_NAME=47_T0.mzML
SUBJECT_SAMPLE_FACTORS           	47	47_T0.25	Group:Control | Timepoint:15	RAW_FILE_NAME=47_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	47	47_T0.50	Group:Control | Timepoint:30	RAW_FILE_NAME=47_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	47	47_T0.75	Group:Control | Timepoint:45	RAW_FILE_NAME=47_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	47	47_T1	Group:Control | Timepoint:60	RAW_FILE_NAME=47_T1.mzML
SUBJECT_SAMPLE_FACTORS           	47	47_T2	Group:Control | Timepoint:120	RAW_FILE_NAME=47_T2.mzML
SUBJECT_SAMPLE_FACTORS           	47	47_T3	Group:Control | Timepoint:180	RAW_FILE_NAME=47_T3.mzML
SUBJECT_SAMPLE_FACTORS           	47	47_T4	Group:Control | Timepoint:240	RAW_FILE_NAME=47_T4.mzML
SUBJECT_SAMPLE_FACTORS           	48	48_T0	Group:CI | Timepoint:0	RAW_FILE_NAME=48_T0.mzML
SUBJECT_SAMPLE_FACTORS           	48	48_T0.25	Group:CI | Timepoint:15	RAW_FILE_NAME=48_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	48	48_T0.50	Group:CI | Timepoint:30	RAW_FILE_NAME=48_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	48	48_T0.75	Group:CI | Timepoint:45	RAW_FILE_NAME=48_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	48	48_T1	Group:CI | Timepoint:60	RAW_FILE_NAME=48_T1.mzML
SUBJECT_SAMPLE_FACTORS           	48	48_T2	Group:CI | Timepoint:120	RAW_FILE_NAME=48_T2.mzML
SUBJECT_SAMPLE_FACTORS           	48	48_T3	Group:CI | Timepoint:180	RAW_FILE_NAME=48_T3.mzML
SUBJECT_SAMPLE_FACTORS           	48	48_T4	Group:CI | Timepoint:240	RAW_FILE_NAME=48_T4.mzML
SUBJECT_SAMPLE_FACTORS           	49	49_T0	Group:Control | Timepoint:0	RAW_FILE_NAME=49_T0.mzML
SUBJECT_SAMPLE_FACTORS           	49	49_T0.25	Group:Control | Timepoint:15	RAW_FILE_NAME=49_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	49	49_T0.50	Group:Control | Timepoint:30	RAW_FILE_NAME=49_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	49	49_T0.75	Group:Control | Timepoint:45	RAW_FILE_NAME=49_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	49	49_T1	Group:Control | Timepoint:60	RAW_FILE_NAME=49_T1.mzML
SUBJECT_SAMPLE_FACTORS           	49	49_T2	Group:Control | Timepoint:120	RAW_FILE_NAME=49_T2.mzML
SUBJECT_SAMPLE_FACTORS           	49	49_T3	Group:Control | Timepoint:180	RAW_FILE_NAME=49_T3.mzML
SUBJECT_SAMPLE_FACTORS           	49	49_T4	Group:Control | Timepoint:240	RAW_FILE_NAME=49_T4.mzML
SUBJECT_SAMPLE_FACTORS           	50	50_T0	Group:CI | Timepoint:0	RAW_FILE_NAME=50_T0.mzML
SUBJECT_SAMPLE_FACTORS           	50	50_T0.25	Group:CI | Timepoint:15	RAW_FILE_NAME=50_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	50	50_T0.50	Group:CI | Timepoint:30	RAW_FILE_NAME=50_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	50	50_T0.75	Group:CI | Timepoint:45	RAW_FILE_NAME=50_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	50	50_T1	Group:CI | Timepoint:60	RAW_FILE_NAME=50_T1.mzML
SUBJECT_SAMPLE_FACTORS           	50	50_T2	Group:CI | Timepoint:120	RAW_FILE_NAME=50_T2.mzML
SUBJECT_SAMPLE_FACTORS           	50	50_T3	Group:CI | Timepoint:180	RAW_FILE_NAME=50_T3.mzML
SUBJECT_SAMPLE_FACTORS           	50	50_T4	Group:CI | Timepoint:240	RAW_FILE_NAME=50_T4.mzML
SUBJECT_SAMPLE_FACTORS           	51	51_T0	Group:Control | Timepoint:0	RAW_FILE_NAME=51_T0.mzML
SUBJECT_SAMPLE_FACTORS           	51	51_T0.25	Group:Control | Timepoint:15	RAW_FILE_NAME=51_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	51	51_T0.50	Group:Control | Timepoint:30	RAW_FILE_NAME=51_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	51	51_T0.75	Group:Control | Timepoint:45	RAW_FILE_NAME=51_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	51	51_T1	Group:Control | Timepoint:60	RAW_FILE_NAME=51_T1.mzML
SUBJECT_SAMPLE_FACTORS           	51	51_T2	Group:Control | Timepoint:120	RAW_FILE_NAME=51_T2.mzML
SUBJECT_SAMPLE_FACTORS           	51	51_T3	Group:Control | Timepoint:180	RAW_FILE_NAME=51_T3.mzML
SUBJECT_SAMPLE_FACTORS           	51	51_T4	Group:Control | Timepoint:240	RAW_FILE_NAME=51_T4.mzML
SUBJECT_SAMPLE_FACTORS           	52	52_T0	Group:CI | Timepoint:0	RAW_FILE_NAME=52_T0.mzML
SUBJECT_SAMPLE_FACTORS           	52	52_T0.25	Group:CI | Timepoint:15	RAW_FILE_NAME=52_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	52	52_T0.50	Group:CI | Timepoint:30	RAW_FILE_NAME=52_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	52	52_T0.75	Group:CI | Timepoint:45	RAW_FILE_NAME=52_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	52	52_T1	Group:CI | Timepoint:60	RAW_FILE_NAME=52_T1.mzML
SUBJECT_SAMPLE_FACTORS           	52	52_T2	Group:CI | Timepoint:120	RAW_FILE_NAME=52_T2.mzML
SUBJECT_SAMPLE_FACTORS           	52	52_T3	Group:CI | Timepoint:180	RAW_FILE_NAME=52_T3.mzML
SUBJECT_SAMPLE_FACTORS           	52	52_T4	Group:CI | Timepoint:240	RAW_FILE_NAME=52_T4.mzML
SUBJECT_SAMPLE_FACTORS           	53	53_T0	Group:WI | Timepoint:0	RAW_FILE_NAME=53_T0.mzML
SUBJECT_SAMPLE_FACTORS           	53	53_T0.25	Group:WI | Timepoint:15	RAW_FILE_NAME=53_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	53	53_T0.50	Group:WI | Timepoint:30	RAW_FILE_NAME=53_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	53	53_T0.75	Group:WI | Timepoint:45	RAW_FILE_NAME=53_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	53	53_T1	Group:WI | Timepoint:60	RAW_FILE_NAME=53_T1.mzML
SUBJECT_SAMPLE_FACTORS           	53	53_T2	Group:WI | Timepoint:120	RAW_FILE_NAME=53_T2.mzML
SUBJECT_SAMPLE_FACTORS           	53	53_T3	Group:WI | Timepoint:180	RAW_FILE_NAME=53_T3.mzML
SUBJECT_SAMPLE_FACTORS           	53	53_T4	Group:WI | Timepoint:240	RAW_FILE_NAME=53_T4.mzML
SUBJECT_SAMPLE_FACTORS           	54	54_T0	Group:CI | Timepoint:0	RAW_FILE_NAME=54_T0.mzML
SUBJECT_SAMPLE_FACTORS           	54	54_T0.25	Group:CI | Timepoint:15	RAW_FILE_NAME=54_T0.25.mzML
SUBJECT_SAMPLE_FACTORS           	54	54_T0.50	Group:CI | Timepoint:30	RAW_FILE_NAME=54_T0.5.mzML
SUBJECT_SAMPLE_FACTORS           	54	54_T0.75	Group:CI | Timepoint:45	RAW_FILE_NAME=54_T0.75.mzML
SUBJECT_SAMPLE_FACTORS           	54	54_T1	Group:CI | Timepoint:60	RAW_FILE_NAME=54_T1.mzML
SUBJECT_SAMPLE_FACTORS           	54	54_T2	Group:CI | Timepoint:120	RAW_FILE_NAME=54_T2.mzML
SUBJECT_SAMPLE_FACTORS           	54	54_T3	Group:CI | Timepoint:180	RAW_FILE_NAME=54_T3.mzML
SUBJECT_SAMPLE_FACTORS           	54	54_T4	Group:CI | Timepoint:240	RAW_FILE_NAME=54_T4.mzML
#COLLECTION
CO:COLLECTION_SUMMARY            	Perfusate samples were collected in ethylenediaminetetraacetic acid (EDTA)
CO:COLLECTION_SUMMARY            	tubes, at baseline (before the kidney was mounted on the normothermic perfusion
CO:COLLECTION_SUMMARY            	device), every 15 minutes during the first hour and hourly thereafter. One
CO:COLLECTION_SUMMARY            	milliliter perfusate aliquots (centrifuged 1000g, 10 minutes, 4°C) were snap
CO:COLLECTION_SUMMARY            	frozen in liquid nitrogen and stored at -80°C until analysis.
CO:SAMPLE_TYPE                   	Perfusate
CO:COLLECTION_FREQUENCY          	Baseline (T0) and during perfusion at 15 min (T0.25), 30 min (T0.50), 45 min
CO:COLLECTION_FREQUENCY          	(T0.75), 1 hour (T1), 2 hours (T2), 3 hours (T3), 4 hours (T4)
CO:STORAGE_CONDITIONS            	-80℃
CO:ADDITIVES                     	EDTA
#TREATMENT
TR:TREATMENT_SUMMARY             	Three experimental conditions were investigated (n=3/group for Control and WI,
TR:TREATMENT_SUMMARY             	n=4/group for CI): (a) Controls; (b) warm ischemia (WI) simulating hypoxic acute
TR:TREATMENT_SUMMARY             	kidney injury; (c) cold ischemia (CI) replicating clinical cold storage. Control
TR:TREATMENT_SUMMARY             	kidneys were retrieved, flushed with cold IGL-1, and immediately reperfused. CI
TR:TREATMENT_SUMMARY             	group, kidneys were exposed to 22h of CI by submerging them in IGL- 1 (a
TR:TREATMENT_SUMMARY             	clinical preservation solution for cold storage) and storing them on ice. In WI,
TR:TREATMENT_SUMMARY             	the renal artery and vein were clamped for 60 min before retrieval. All kidneys
TR:TREATMENT_SUMMARY             	were flushed with 200 ml of Ringer’s solution before mounting them on the ex
TR:TREATMENT_SUMMARY             	situ circuit to wash out IGL-1.
TR:ANIMAL_ANESTHESIA             	Pigs were sedated by an intramuscular injection of Tiletamine/Zolazepam (8
TR:ANIMAL_ANESTHESIA             	mg/kg, Zoletil®, Virbac, Belgium) and Xylazine (2 mg/kg, Xylazine®, VMD
TR:ANIMAL_ANESTHESIA             	pharma, Belgium) to allow orotracheal intubation. Anesthesia was maintained by
TR:ANIMAL_ANESTHESIA             	inhalation of isoflurane (1% Isovet®, Piramal Critical Care B.V., Belgium) and
TR:ANIMAL_ANESTHESIA             	continuous infusion of fentanyl (8 µg/kg, Fentanyl®, Janssen Pharmaceutica,
TR:ANIMAL_ANESTHESIA             	Belgium).
TR:ANIMAL_ACCLIMATION_DURATION   	Minimum of 2 days
TR:ANIMAL_FASTING                	Overnight
TR:ANIMAL_ENDP_EUTHANASIA        	Non-recovery study
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Samples were extracted in an 80% methanol (80:20 methanol:water) (Methanol
SP:SAMPLEPREP_SUMMARY            	≥99.9%, HiPerSolv CHROMANORM®, ULTRA for LC-MS, suitable for UPLC/UHPLC-MS
SP:SAMPLEPREP_SUMMARY            	instruments, VWR, Belgium) extraction buffer containing 1 µM of deuterated D27
SP:SAMPLEPREP_SUMMARY            	myristic acid, 5 µM D12 glucose, 3 µM 13C5-D5-15N Glutamic acid and 3 µM
SP:SAMPLEPREP_SUMMARY            	D7-15N4-Arginine as internal standards. 10 µl of sample was added to 990 µl of
SP:SAMPLEPREP_SUMMARY            	the extraction buffer and stored overnight at -80 °C. Insolubilities and
SP:SAMPLEPREP_SUMMARY            	precipitated proteins were removed by centrifugation at 20.000 g, for 15 min at
SP:SAMPLEPREP_SUMMARY            	4 °C. 200 µL of the supernatant was transferred to an appropriate
SP:SAMPLEPREP_SUMMARY            	mass-spectrometry vial. 10 µl of sample was added to 990 µl of the extraction
SP:SAMPLEPREP_SUMMARY            	buffer and stored overnight at -80 °C.
SP:EXTRACT_STORAGE               	-80℃
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	10 µl was loaded onto an Ultra Performance Liquid Chromatograph (UPLC) equipped
CH:CHROMATOGRAPHY_SUMMARY        	with a Hydrophilic Interaction Liquid Chromatography (HILIC) column (InfinityLab
CH:CHROMATOGRAPHY_SUMMARY        	Poroshell 120 HILIC-Z PEEK-lined 2.1 x 150 mm, 2.7 µm column; Agilent, Santa
CH:CHROMATOGRAPHY_SUMMARY        	Clara, USA)) and connected in-line to a Q-exactive Orbitrap Focus (Thermo Fisher
CH:CHROMATOGRAPHY_SUMMARY        	Scientific, Massachusetts, USA) mass spectrometer. A linear gradient was built
CH:CHROMATOGRAPHY_SUMMARY        	up starting with 90% solvent A (LC-MS grade acetonitrile, Acetonitrile
CH:CHROMATOGRAPHY_SUMMARY        	hypergrade for LC-MS LiChrosolv, Supelco (Merck), Germany) and 10% solvent B (10
CH:CHROMATOGRAPHY_SUMMARY        	mM ammonium acetate (LiChropur™, eluent additive for LC-MS, (Merck), Germany),
CH:CHROMATOGRAPHY_SUMMARY        	pH 9.3). At 2 min the gradient increased to 60% of solvent B and maintained at
CH:CHROMATOGRAPHY_SUMMARY        	60% until 15 min. The gradient returned to 10% solvent B at 16 min and remained
CH:CHROMATOGRAPHY_SUMMARY        	until 25 min. The flow rate was 250 µl/min and the column was kept at 25°C
CH:CHROMATOGRAPHY_SUMMARY        	throughout the analysis. The MS operated in negative ion mode, with a spray
CH:CHROMATOGRAPHY_SUMMARY        	voltage of 2.9 kV and a temperature of the capillary of 325 °C. Gas settings
CH:CHROMATOGRAPHY_SUMMARY        	were as follows: sheath gas 40 and auxiliary gas 15. The vaporizer temperature
CH:CHROMATOGRAPHY_SUMMARY        	was set at 300 °C. A full scan (resolution of 70.000 and scan range of m/z
CH:CHROMATOGRAPHY_SUMMARY        	70-1050) was applied. XCalibur version to operate the LC-MS was 4.2.47.
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	Agilent 1290 Infinity
CH:COLUMN_NAME                   	Agilent InfinityLab Poroshell 120 (2.1 x 150 mm, 2.7 um)
CH:SOLVENT_A                     	100% acetonitrile
CH:SOLVENT_B                     	100% water; 10 mM ammonium acetate, pH 9.3
CH:FLOW_GRADIENT                 	A linear gradient was built up starting with 90% solvent A and 10% solvent B. At
CH:FLOW_GRADIENT                 	2 min the gradient increased to 60% of solvent B and maintained at 60% until 15
CH:FLOW_GRADIENT                 	min.
CH:FLOW_RATE                     	250 µl/min
CH:COLUMN_TEMPERATURE            	25°C
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:LABORATORY_NAME               	Laboratory of Applied Mass Spectrometry, KU Leuven
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive Focus
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	Raw MS data were converted into mzML using the MSConvert tool of Proteowizard
MS:MS_COMMENTS                   	(version 3.0.20247). Peak picking was performed with El_Maven (El_Maven,
MS:MS_COMMENTS                   	Elucidata, Massachusetts, USA, version 0.12.0). Metabolites were identified
MS:MS_COMMENTS                   	using an in-house library containing exact mass and retention time. The mass
MS:MS_COMMENTS                   	accuracy during data processing in El Maven was set at 10 ppm. Calculation of
MS:MS_COMMENTS                   	abundances was done in the LC-MS Workflow of El_Maven. Raw abundances (peak area
MS:MS_COMMENTS                   	values) for each metabolite were corrected for internal standard (Myristic acid
MS:MS_COMMENTS                   	d27).
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	Peak area
MS_METABOLITE_DATA_START
Samples	45_T0	45_T0.25	45_T0.50	45_T0.75	45_T1	45_T2	45_T3	45_T4	46_T0	46_T0.25	46_T0.50	46_T0.75	46_T1	46_T2	46_T3	46_T4	47_T0	47_T0.25	47_T0.50	47_T0.75	47_T1	47_T2	47_T3	47_T4	48_T0	48_T0.25	48_T0.50	48_T0.75	48_T1	48_T2	48_T3	48_T4	49_T0	49_T0.25	49_T0.50	49_T0.75	49_T1	49_T2	49_T3	49_T4	50_T0	50_T0.25	50_T0.50	50_T0.75	50_T1	50_T2	50_T3	50_T4	51_T0	51_T0.25	51_T0.50	51_T0.75	51_T1	51_T2	51_T3	51_T4	52_T0	52_T0.25	52_T0.50	52_T0.75	52_T1	52_T2	52_T3	52_T4	53_T0	53_T0.25	53_T0.50	53_T0.75	53_T1	53_T2	53_T3	53_T4	54_T0	54_T0.25	54_T0.50	54_T0.75	54_T1	54_T2	54_T3	54_T4
Factors	Group:WI | Timepoint:0	Group:WI | Timepoint:15	Group:WI | Timepoint:30	Group:WI | Timepoint:45	Group:WI | Timepoint:60	Group:WI | Timepoint:120	Group:WI | Timepoint:180	Group:WI | Timepoint:240	Group:WI | Timepoint:0	Group:WI | Timepoint:15	Group:WI | Timepoint:30	Group:WI | Timepoint:45	Group:WI | Timepoint:60	Group:WI | Timepoint:120	Group:WI | Timepoint:180	Group:WI | Timepoint:240	Group:Control | Timepoint:0	Group:Control | Timepoint:15	Group:Control | Timepoint:30	Group:Control | Timepoint:45	Group:Control | Timepoint:60	Group:Control | Timepoint:120	Group:Control | Timepoint:180	Group:Control | Timepoint:240	Group:CI | Timepoint:0	Group:CI | Timepoint:15	Group:CI | Timepoint:30	Group:CI | Timepoint:45	Group:CI | Timepoint:60	Group:CI | Timepoint:120	Group:CI | Timepoint:180	Group:CI | Timepoint:240	Group:Control | Timepoint:0	Group:Control | Timepoint:15	Group:Control | Timepoint:30	Group:Control | Timepoint:45	Group:Control | Timepoint:60	Group:Control | Timepoint:120	Group:Control | Timepoint:180	Group:Control | Timepoint:240	Group:CI | Timepoint:0	Group:CI | Timepoint:15	Group:CI | Timepoint:30	Group:CI | Timepoint:45	Group:CI | Timepoint:60	Group:CI | Timepoint:120	Group:CI | Timepoint:180	Group:CI | Timepoint:240	Group:Control | Timepoint:0	Group:Control | Timepoint:15	Group:Control | Timepoint:30	Group:Control | Timepoint:45	Group:Control | Timepoint:60	Group:Control | Timepoint:120	Group:Control | Timepoint:180	Group:Control | Timepoint:240	Group:CI | Timepoint:0	Group:CI | Timepoint:15	Group:CI | Timepoint:30	Group:CI | Timepoint:45	Group:CI | Timepoint:60	Group:CI | Timepoint:120	Group:CI | Timepoint:180	Group:CI | Timepoint:240	Group:WI | Timepoint:0	Group:WI | Timepoint:15	Group:WI | Timepoint:30	Group:WI | Timepoint:45	Group:WI | Timepoint:60	Group:WI | Timepoint:120	Group:WI | Timepoint:180	Group:WI | Timepoint:240	Group:CI | Timepoint:0	Group:CI | Timepoint:15	Group:CI | Timepoint:30	Group:CI | Timepoint:45	Group:CI | Timepoint:60	Group:CI | Timepoint:120	Group:CI | Timepoint:180	Group:CI | Timepoint:240
Glucose	0.972130504	0.90725567	0.839527841	0.900205733	0.870442298	0.901622335	0.831081399	0.726023453	0.989919535	0.980165421	0.960730742	0.938109226	0.882087525	0.910609846	0.820062648	0.821213724	0.991850041	1.085308132	1.169338221	1.182325357	1.292854484	1.33692296	1.116452637	0.900065221	0.850544413	0.930119491	0.876447022	1.039902887	1.059069818	1.052423114	0.950265048	0.839671291	1.055331912	0.855154061	1.055564373	1.161424156	1.195670261	1.241712389	1.116352193	0.854806805	0.95739373	0.956989333	0.953773149	0.965942538	0.974134435	0.82420111	0.606361991	0.390171353	0.88885313	0.931160483	1.004274288	1.016630994	1.122755272	1.202514396	1.034995869	0.817235848	0.950825417	0.817325856	0.928415829	0.928793166	1.07689566	1.044078815	0.787866263	0.623983754	1.058621892	0.908079528	0.874007282	0.906045263	0.859388956	0.821301312	0.819569781	0.726287156	0.88450293	0.878090579	0.936043116	1.000637307	1.029958439	1.145507792	0.894562278	0.6271467
Lactate	1.048975724	4.171060757	4.513973217	4.902988021	6.353255578	9.78449507	11.93618804	15.75455143	1.020704015	2.848894099	3.678329275	4.91499345	5.887235537	9.977985151	11.84286369	15.33998009	0.875436025	1.62829289	1.416961449	1.0860756	1.173832739	3.597575837	6.771212433	7.932106708	1.963669027	3.464578946	2.739730835	2.635734718	2.060844719	3.612614482	8.419044041	13.25973825	0.998545854	1.325976491	1.102328186	1.164816042	1.330596091	3.108805607	6.71037726	8.794800963	1.634491343	3.222655345	2.569040344	2.128513904	1.765915446	4.285938212	7.615423425	10.63318487	0.804409429	1.283531933	1.021876154	0.579789462	0.594905539	2.346402902	6.13619111	10.65408649	1.64450738	4.698522114	5.648383306	4.900360042	4.56193407	6.620309835	12.2790578	18.52895723	0.995625726	3.166495821	4.531724442	5.973029943	6.490411363	8.746057541	12.44238785	17.7659014	1.455403513	2.427617135	2.903212605	2.892335151	2.514934693	4.119648368	10.18544629	15.92349567
Gly	0.004844811	0.015807829	0.016625703	0.017407257	0.021263836	0.030779981	0.034284526	0.035585506	0.004886446	0.011118539	0.013998278	0.018233187	0.020247961	0.029341325	0.03151871	0.035002337	0.00485408	0.024209908	0.03122574	0.036169645	0.039722582	0.043669361	0.043948658	0.044555706	0.004881381	0.018523929	0.021118142	0.025126301	0.025443813	0.027849518	0.032858742	0.038223998	0.005120277	0.015869334	0.024793168	0.030515515	0.034268886	0.043667	0.048004449	0.050417924	0.005018262	0.017357517	0.020627312	0.023549049	0.024438386	0.026850129	0.029649096	0.033535518	0.004882272	0.019540103	0.02596116	0.027583872	0.033403974	0.046503312	0.048575411	0.052220672	0.005003422	0.016022463	0.019742173	0.019568004	0.022880036	0.027204965	0.030482441	0.034072327	0.004864459	0.013439548	0.02084	0.027034602	0.028992569	0.034795206	0.039075186	0.041504697	0.004845624	0.015128116	0.020381107	0.024295497	0.025458154	0.030080923	0.031351634	0.034569415
Gln	0.920910532	0.561860733	0.581581451	0.624098467	0.563103018	0.409977426	0.267447476	0.264141239	0.928260888	0.730951666	0.705357904	0.662591357	0.626289141	0.567154158	0.486900642	0.489408502	0.970785076	0.747800409	0.677686863	0.562060153	0.515760063	0.093248221	0.05513972	0.061474058	1.002088627	0.668147329	0.499716036	0.448100696	0.344118537	0.177508781	0.139672057	0.107675558	1.046430019	0.477658407	0.461270999	0.455957013	0.409232718	0.217332887	0.057521278	0.074621165	0.907599076	0.427472465	0.396951566	0.316855096	0.305781171	0.106176974	0.102042357	0.083105656	0.954046411	0.637713343	0.6659882	0.609132946	0.57690567	0.407025454	0.152878005	0.105307697	0.901471577	0.547469555	0.520125738	0.452863393	0.453030338	0.385751577	0.360463158	0.359421349	1.005659027	0.657082849	0.52651981	0.444581159	0.370866927	0.197318066	0.141856339	0.168172926	0.933082943	0.504233835	0.40352543	0.311918592	0.276203773	0.154667411	0.126732936	0.141188266
Lys	0.011558497	0.012527708	0.014036236	0.014853449	0.015969818	0.028006202	0.038273862	0.043762283	0.011657828	0.01210223	0.0122104	0.014117888	0.013749128	0.02157097	0.026100241	0.03136409	0.011580612	0.013501716	0.022017984	0.029643308	0.036176051	0.065655795	0.080841842	0.087736953	0.011645745	0.014510538	0.019676717	0.02525032	0.024873759	0.032920205	0.041772628	0.052454736	0.01221569	0.016492899	0.019751318	0.02913348	0.034765574	0.058459622	0.07491397	0.084524734	0.011972308	0.013809171	0.01897988	0.024142768	0.025026891	0.036585662	0.048090258	0.057292339	0.011647871	0.012227383	0.02108574	0.030403597	0.037072921	0.06006205	0.073315778	0.082683696	0.011936905	0.012691931	0.018172139	0.022423921	0.026486657	0.036463024	0.041202375	0.048206578	0.011605375	0.011695256	0.011564293	0.014700793	0.015807867	0.022807077	0.029159374	0.033564847	0.011560438	0.012037919	0.016306922	0.020879575	0.021743268	0.032024433	0.036467567	0.04273937
Met	0.001205535	0.009667126	0.010511092	0.011706643	0.016297901	0.03354288	0.047668718	0.054940979	0.000854503	0.006513919	0.008831747	0.012457628	0.014301647	0.026975173	0.035050898	0.044062884	0.000734864	0.012104465	0.019919097	0.027590704	0.038819698	0.079685319	0.106820925	0.120022758	0.001515282	0.016505793	0.02394277	0.03260442	0.035848973	0.051769975	0.070351415	0.087866067	0.000775163	0.007423975	0.018564336	0.02793626	0.038535534	0.066646136	0.080750505	0.094135124	0.000962637	0.013803218	0.021118597	0.028621412	0.033185146	0.055505577	0.080503187	0.095926878	0.000739132	0.010756004	0.020258788	0.029395541	0.043828324	0.079634763	0.093887046	0.107377616	0.001022109	0.012440449	0.022988625	0.029547433	0.040492324	0.056913395	0.067555363	0.080855957	0.000736435	0.007481556	0.011832101	0.018369203	0.021881196	0.032464622	0.041634057	0.048958597	0.000733583	0.011118267	0.019795222	0.028619113	0.033237191	0.053884332	0.068828904	0.082940086
Phe	0.018676937	0.069984576	0.071160358	0.077161441	0.094726	0.174441367	0.242550604	0.276202385	0.016996125	0.052630975	0.063796081	0.076726044	0.083014983	0.130757145	0.155077127	0.190123458	0.012600041	0.083524811	0.13805496	0.190252397	0.255197836	0.471665867	0.588259941	0.654563328	0.024024755	0.093211211	0.1300863	0.178817022	0.196270882	0.254125122	0.32983381	0.411567476	0.012447641	0.05274408	0.134477886	0.192083638	0.253150264	0.403737309	0.503680307	0.562164874	0.017830912	0.089519415	0.129180673	0.170226611	0.197148574	0.306272544	0.413792425	0.491401628	0.012751703	0.072077205	0.138392711	0.181536803	0.254640034	0.418173993	0.47201865	0.513063669	0.020687484	0.072758807	0.126694768	0.159320269	0.211213975	0.277786524	0.305906096	0.354647638	0.01505301	0.047993112	0.066841799	0.096896542	0.112584475	0.165404581	0.211536599	0.248797498	0.014152323	0.06851487	0.112858514	0.158144929	0.180559966	0.278817207	0.32911195	0.385600039
Pro	0.004393745	0.016486083	0.017688221	0.019192602	0.024888665	0.045040487	0.058840761	0.064359676	0.004027601	0.010593576	0.01399154	0.018500792	0.020968367	0.035281255	0.042555444	0.051403313	0.003715439	0.028367057	0.041340193	0.049756513	0.059776494	0.073541721	0.077478967	0.077348374	0.004807637	0.025000763	0.032457297	0.042508617	0.04447861	0.046402072	0.055037544	0.067578979	0.003620659	0.015318418	0.032784599	0.042512902	0.050928036	0.062036805	0.064475103	0.065606991	0.004026511	0.022623035	0.029835777	0.037418582	0.040220262	0.04515081	0.054929726	0.06564076	0.00337733	0.020321198	0.031907636	0.037641224	0.049709649	0.06439349	0.065487099	0.07310877	0.004154352	0.017795898	0.028394385	0.033825626	0.043106308	0.049369025	0.055014591	0.065055638	0.003483646	0.01394971	0.019744439	0.027477514	0.031110122	0.04103957	0.047895497	0.053455415	0.003497113	0.016237885	0.025867176	0.033457013	0.036153871	0.041818959	0.046017151	0.055542427
Ser	0.004250829	0.013032121	0.015665851	0.018455032	0.027085241	0.075049667	0.111417539	0.120942345	0.003961744	0.009373855	0.012313861	0.017969395	0.022599977	0.051809264	0.074745945	0.092534929	0.003579576	0.057013711	0.092941036	0.123326765	0.152398769	0.175187139	0.14446316	0.133212012	0.004751004	0.049146263	0.081077	0.10719744	0.120597118	0.131801866	0.137050089	0.148123934	0.003176508	0.048239584	0.10844449	0.149297879	0.186160314	0.241921678	0.243116911	0.247982081	0.004766446	0.06530245	0.097542328	0.123587205	0.14181659	0.167857627	0.168024243	0.175357757	0.003170266	0.057492027	0.114379496	0.147764339	0.190158662	0.257931937	0.251317438	0.25356855	0.00481438	0.043904641	0.078665063	0.098771309	0.131672691	0.155851959	0.158408639	0.166286163	0.00352505	0.01373706	0.029578186	0.050800562	0.063308028	0.098057301	0.117780101	0.127953316	0.003307228	0.046560866	0.077552655	0.114913418	0.128033991	0.159755134	0.151806685	0.156522642
Thr	0.008789589	0.044476606	0.046820698	0.048788023	0.060699831	0.111158225	0.150403121	0.165596571	0.007831584	0.031366344	0.038663757	0.047589703	0.053484842	0.082957568	0.100617641	0.117968274	0.006622232	0.056451943	0.091339736	0.120699061	0.155640129	0.242699548	0.2866213	0.309649808	0.009160223	0.05594968	0.081499589	0.104176661	0.113962607	0.137677391	0.166650368	0.206471647	0.005730715	0.037865374	0.082367357	0.116208381	0.149227895	0.226576305	0.261766476	0.294736027	0.00705083	0.055805082	0.077075216	0.094496793	0.109871781	0.146191134	0.181624723	0.215410886	0.00526431	0.039139612	0.071615192	0.092712554	0.124351562	0.213213464	0.248592761	0.278329902	0.006623249	0.037456586	0.063890908	0.079751725	0.104468322	0.133662147	0.151036734	0.175495222	0.005415661	0.022988895	0.033821491	0.048944415	0.057558232	0.083645377	0.10592742	0.12015426	0.005224795	0.035815171	0.057535953	0.080654725	0.089617723	0.129074312	0.147789326	0.174378089
Trp	0.002466314	0.013472322	0.013875853	0.015016599	0.01906549	0.034055397	0.044651334	0.050830036	0.002387409	0.009466071	0.012001206	0.015486805	0.017067461	0.027435996	0.03232535	0.038755499	0.002123507	0.017698866	0.029104872	0.039109134	0.05287973	0.102029743	0.125094895	0.128711971	0.003039018	0.017893286	0.025797774	0.036311292	0.040223588	0.056654755	0.07204376	0.085162945	0.002068233	0.010696634	0.026239391	0.037133834	0.05006557	0.094985764	0.115578218	0.126297843	0.00240116	0.017548252	0.027061346	0.035348597	0.041812556	0.074077121	0.090100829	0.094946627	0.001920301	0.014348114	0.025167544	0.03259032	0.049271077	0.096544224	0.111923478	0.124325711	0.002340228	0.014120972	0.024017937	0.030203114	0.040237182	0.058400654	0.062164133	0.068212036	0.002131254	0.009998801	0.014118426	0.020682847	0.023705017	0.033609524	0.040496486	0.047185664	0.001833301	0.013241121	0.023049336	0.03217574	0.036192499	0.06356519	0.069380704	0.07444946
Tyr	0.006164033	0.026572413	0.027894745	0.030457281	0.039426845	0.072616327	0.098706947	0.110420335	0.005880814	0.019220544	0.0244783	0.031527163	0.035114109	0.057341671	0.069232388	0.083980595	0.005478172	0.032708007	0.054384984	0.073572613	0.097383704	0.171247489	0.223377538	0.249324959	0.007159327	0.034356092	0.051093503	0.070245863	0.077558681	0.101080004	0.129370558	0.158494004	0.005475998	0.021332042	0.050825877	0.072695393	0.096194232	0.160627703	0.206023896	0.240970775	0.00597291	0.033412964	0.04852174	0.065350819	0.075991444	0.116527667	0.153813709	0.178229923	0.005110966	0.026728853	0.051138413	0.067791268	0.096186426	0.169658461	0.200432417	0.227975501	0.006090768	0.027730063	0.047056318	0.059941433	0.08100857	0.10519182	0.11917761	0.13565995	0.005585224	0.018079434	0.025732141	0.037395343	0.043506568	0.063825641	0.080155396	0.090856569	0.005243082	0.025288299	0.041788116	0.059079207	0.068289175	0.105952051	0.123438582	0.143938259
(Iso)Leu	0.067414177	0.271218265	0.275587504	0.294657258	0.356186463	0.595781962	0.762300299	0.836585719	0.06033075	0.198315993	0.237164628	0.287308014	0.307120462	0.466019222	0.538961282	0.639350313	0.045936942	0.27640235	0.433779026	0.580523673	0.759354427	1.227999185	1.455680161	1.555131869	0.075767702	0.299664635	0.403379168	0.539143018	0.577664426	0.672779404	0.845698751	1.04026634	0.045595477	0.181129835	0.419827172	0.589078979	0.765076075	1.137978701	1.3080364	1.340404457	0.058295832	0.288468556	0.403903985	0.517423834	0.57868913	0.793065112	1.021057887	1.189046895	0.045966255	0.251689839	0.444958473	0.569828552	0.796018646	1.240704422	1.40283852	1.497341354	0.067584356	0.251809384	0.409810135	0.496953528	0.640619449	0.782039999	0.873842686	1.022025162	0.050723058	0.174254903	0.234556319	0.330571034	0.371177271	0.507218779	0.612481577	0.698709735	0.048003759	0.222702965	0.35628405	0.481799131	0.536620356	0.743769225	0.857799677	1.003889146
Val	0.025692369	0.076312764	0.074618806	0.078711252	0.089813405	0.134649283	0.168506824	0.18137577	0.023032618	0.057700162	0.06533353	0.075452829	0.077942334	0.108368854	0.120255012	0.139880164	0.012855598	0.062695178	0.093753767	0.12113665	0.157206485	0.262705822	0.321618365	0.352780529	0.02245732	0.065515017	0.082981039	0.109752676	0.117713967	0.147029187	0.183357256	0.222340514	0.011688938	0.038637691	0.082416066	0.112502429	0.142599297	0.220300515	0.2633808	0.286047268	0.016865692	0.058892494	0.077476134	0.098938939	0.111411212	0.161419581	0.21001126	0.245230291	0.012681157	0.055634759	0.089861679	0.108569341	0.151304608	0.232000718	0.261344639	0.285047551	0.020629907	0.055435658	0.082626995	0.096554411	0.123510519	0.154498918	0.170630678	0.194580094	0.012705843	0.035475188	0.04634943	0.062103732	0.068903743	0.09334971	0.114828579	0.130770435	0.01176287	0.042302998	0.065501359	0.08764964	0.097753754	0.143129619	0.165609344	0.191579654
Ala	0.010036564	0.042515512	0.04691593	0.050973081	0.06714905	0.129366772	0.173073127	0.211997255	0.010491917	0.030971098	0.041936373	0.054868992	0.061520453	0.105711146	0.131938798	0.173662029	0.009208693	0.037888852	0.034761104	0.023262389	0.021140281	0.0572668	0.073511371	0.079146049	0.013589337	0.06191181	0.05164086	0.049909407	0.034884613	0.042885209	0.07967651	0.122165305	0.0102047	0.031868647	0.03101492	0.029185609	0.030034202	0.083422853	0.12311896	0.136860435	0.014347957	0.05666285	0.048905422	0.043113835	0.03320145	0.055951505	0.090933817	0.134840464	0.010129581	0.038802539	0.025011596	0.019902419	0.020279415	0.064498254	0.125238092	0.177875195	0.014300752	0.055867991	0.071289168	0.068859895	0.074088093	0.088917131	0.132262831	0.183401096	0.010926967	0.036202909	0.054074029	0.071781864	0.077498054	0.108459751	0.154264671	0.200194353	0.010861191	0.050867967	0.061240481	0.061047208	0.053738853	0.059902754	0.107140732	0.158680759
Arg	0.002472393	0.003655326	0.003709353	0.003527192	0.004016422	0.005708968	0.005776538	0.005119655	0.002432506	0.002900911	0.003170132	0.003387849	0.003347762	0.003904845	0.003481496	0.003169584	0.002536537	0.005524146	0.007450781	0.007806013	0.008327671	0.007895051	0.008940939	0.008523675	0.002737998	0.004699164	0.006316131	0.006845787	0.005285173	0.003379343	0.003674765	0.004129058	0.002691975	0.004257208	0.007282363	0.009842898	0.010625067	0.01255643	0.011617519	0.009817835	0.002669642	0.005567569	0.007268987	0.008051236	0.006461382	0.004766424	0.005586491	0.006388483	0.002569428	0.004466765	0.006891853	0.007642767	0.009205695	0.010984967	0.010772174	0.009963101	0.002740249	0.003630703	0.005432959	0.005472214	0.005305894	0.004302366	0.004564478	0.005036281	0.002475706	0.002531472	0.002695633	0.003555904	0.003301096	0.002620405	0.002025019	0.002192935	0.002348137	0.003912585	0.005957462	0.006159122	0.005403843	0.003656015	0.003275943	0.003650631
Asn	0.001076807	0.0025563	0.003300715	0.003569559	0.005128706	0.012172331	0.017800715	0.018015466	0.001086061	0.001707663	0.002319839	0.003288583	0.003802486	0.006678984	0.00850592	0.009767577	0.001078867	0.013175172	0.02194088	0.030978651	0.041318158	0.059974181	0.057093545	0.054436675	0.001084935	0.010927318	0.017436727	0.022485723	0.023959025	0.024538626	0.026853414	0.029184035	0.001138032	0.008309572	0.020267861	0.030417308	0.042400996	0.05796229	0.050483656	0.047926091	0.001115358	0.011767753	0.017880656	0.02263469	0.025712513	0.027213265	0.030457941	0.033962577	0.001085133	0.007620951	0.017996786	0.020648182	0.03029004	0.05862184	0.053210112	0.048849483	0.00111206	0.006752502	0.011761462	0.015711923	0.020549551	0.022904413	0.022770263	0.019395139	0.001081174	0.002679048	0.004550582	0.007254779	0.00867682	0.012050292	0.01358154	0.013852879	0.001076988	0.008149818	0.013291265	0.019033202	0.021144447	0.023800334	0.020836287	0.020858207
Glu	0.079397632	0.150602976	0.160862168	0.172422901	0.218284257	0.295815441	0.286027024	0.268356013	0.080079956	0.116636617	0.146061268	0.193026749	0.218653606	0.341381256	0.389157378	0.434494207	0.079549543	0.251497936	0.280727708	0.290106492	0.270655677	0.100927992	0.094245169	0.096176062	0.07999695	0.192430164	0.217836696	0.241505048	0.254834517	0.137345457	0.117617096	0.126095749	0.08391202	0.223402108	0.277021198	0.337935385	0.34842248	0.113967125	0.094707987	0.107774308	0.082240179	0.200976861	0.259503126	0.291454903	0.297143933	0.132273899	0.113681558	0.128368108	0.080011554	0.185032262	0.248518088	0.357233794	0.353552462	0.137677262	0.112723333	0.118501992	0.081996987	0.227102043	0.257881788	0.246670062	0.292222075	0.251793047	0.226002872	0.231186461	0.079719643	0.120049456	0.212665434	0.301214096	0.338772903	0.433452768	0.450245784	0.436164825	0.079410964	0.181141802	0.234282299	0.296672993	0.327643592	0.312593398	0.217940904	0.207801361
Ornitine	0.003414583	0.004910796	0.005585691	0.006230573	0.007031796	0.011639354	0.015324445	0.016720111	0.003443927	0.003665939	0.004727784	0.005961917	0.006102831	0.009897748	0.011680904	0.013558435	0.003421116	0.006432334	0.010650231	0.014222276	0.017238937	0.02914338	0.036539764	0.038313659	0.003440357	0.006810615	0.009359106	0.01234595	0.012577068	0.015720489	0.018102662	0.020853167	0.003608729	0.004872291	0.008578706	0.012190265	0.014850798	0.026001013	0.033091651	0.036183747	0.00353683	0.007408536	0.008551489	0.010811095	0.011837017	0.015349548	0.017423901	0.018819191	0.003440985	0.005570877	0.009483939	0.012474491	0.016903956	0.027270406	0.033856513	0.037711554	0.003526371	0.006011656	0.008900923	0.010940167	0.013083008	0.016202772	0.017247597	0.019087902	0.003428431	0.00443172	0.006405046	0.008944682	0.009294626	0.013374478	0.016011531	0.017163007	0.003415156	0.005370297	0.008301067	0.011041332	0.011424059	0.016105358	0.016064505	0.017321767
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name
Glucose
Lactate
Gly
Gln
Lys
Met
Phe
Pro
Ser
Thr
Trp
Tyr
(Iso)Leu
Val
Ala
Arg
Asn
Glu
Ornitine
METABOLITES_END
#END