#METABOLOMICS WORKBENCH nemkovt_20230425_150410 DATATRACK_ID:3892 STUDY_ID:ST002681 ANALYSIS_ID:AN004353 PROJECT_ID:PR001020
VERSION             	1
CREATED_ON             	May 2, 2023, 10:50 am
#PROJECT
PR:PROJECT_TITLE                 	Metabolic profile of individuals with and without type 2 diabetes from
PR:PROJECT_TITLE                 	sub-Saharan Africa
PR:PROJECT_SUMMARY               	Epidemiological data predicts that Sub-Saharan Africa will have the largest
PR:PROJECT_SUMMARY               	increase in type 2 diabetes (T2D) prevalence over the next two decades.
PR:PROJECT_SUMMARY               	Metabolomics studies have identified biomarkers that could improve T2D diagnosis
PR:PROJECT_SUMMARY               	and follow-up. However, no studies have characterized the metabolome of people
PR:PROJECT_SUMMARY               	from Sub-Saharan Africa. Plasma samples from Senegalese individuals with T2D
PR:PROJECT_SUMMARY               	(n=31) or without T2D (n=34) were compared using measures of oxidative stress
PR:PROJECT_SUMMARY               	damage and plasma antioxidant enzyme activity, and mass-spectrometry-based
PR:PROJECT_SUMMARY               	lipidomics and metabolomics analyses. Results showed that glucose, lactate, and
PR:PROJECT_SUMMARY               	TCA metabolites (fumarate, malate, and succinate) were increased in the T2D
PR:PROJECT_SUMMARY               	group, suggesting alterations in glycolysis and mitochondrial dysfunction.
PR:PROJECT_SUMMARY               	Several amino acids (leucine, isoleucine, valine, and tryptophan) and long-to
PR:PROJECT_SUMMARY               	very-long-chain fatty acids were higher in the T2D group. Finally, elevated
PR:PROJECT_SUMMARY               	levels of ketone bodies and acylcarnitines were observed along with increased
PR:PROJECT_SUMMARY               	levels of oxidative stress damage and anti-oxidant activity. In conclusion, the
PR:PROJECT_SUMMARY               	T2D group exhibited modifications in metabolites previously shown to be
PR:PROJECT_SUMMARY               	associated with T2D risk in populations from other areas of the world. Future
PR:PROJECT_SUMMARY               	studies should seek to test whether these metabolites could be used as
PR:PROJECT_SUMMARY               	predictors for T2D-related complications in people from Sub-Saharan Africa.
PR:INSTITUTE                     	University of Colorado Anschutz Medical Campus
PR:LAST_NAME                     	Nemkov
PR:FIRST_NAME                    	Travis
PR:ADDRESS                       	12801 E 17th Avenue, RC-1 South, Rm 9121, Aurora, CO, 80045, USA
PR:EMAIL                         	travis.nemkov@cuanschutz.edu
PR:PHONE                         	303-724-3253
#STUDY
ST:STUDY_TITLE                   	Non-T2D vs T2D
ST:STUDY_SUMMARY                 	Plasma samples from Senegalese individuals with T2D (n=31) or without T2D (n=34)
ST:STUDY_SUMMARY                 	were compared using mass-spectrometry-based metabolomics analyses.
ST:INSTITUTE                     	University of Colorado Anschutz Medical Campus
ST:LAST_NAME                     	Nemkov
ST:FIRST_NAME                    	Travis
ST:ADDRESS                       	12801 E 17th Avenue, RC-1 South, Rm 9403G, Aurora, CO, 80045, USA
ST:EMAIL                         	travis.nemkov@cuanschutz.edu
ST:PHONE                         	303-724-3253
#SUBJECT
SU:SUBJECT_TYPE                  	Human
SU:SUBJECT_SPECIES               	Homo sapiens
SU:TAXONOMY_ID                   	9606
#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           	-	Control_AKLA-	Group:Control	RAW_FILE_NAME=Control_AKLA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_AMDI-	Group:Control	RAW_FILE_NAME=Control_AMDI_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_BABI-	Group:Control	RAW_FILE_NAME=Control_BABI_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_BACO-	Group:Control	RAW_FILE_NAME=Control_BACO_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_BADA-	Group:Control	RAW_FILE_NAME=Control_BADA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_CECA-	Group:Control	RAW_FILE_NAME=Control_CECA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_COMA-	Group:Control	RAW_FILE_NAME=Control_COMA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_DIEM-	Group:Control	RAW_FILE_NAME=Control_DIEM_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_DIMA31-	Group:Control	RAW_FILE_NAME=Control_DIMA31_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_DOMA-	Group:Control	RAW_FILE_NAME=Control_DOMA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_EMYA-	Group:Control	RAW_FILE_NAME=Control_EMYA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_FAAH-	Group:Control	RAW_FILE_NAME=Control_FAAH_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_FAKA-	Group:Control	RAW_FILE_NAME=Control_FAKA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_FAND-	Group:Control	RAW_FILE_NAME=Control_FAND_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_HABA-	Group:Control	RAW_FILE_NAME=Control_HABA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_HOLE-	Group:Control	RAW_FILE_NAME=Control_HOLE_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_IBGA-	Group:Control	RAW_FILE_NAME=Control_IBGA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_KHGU-	Group:Control	RAW_FILE_NAME=Control_KHGU_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_MAMB-	Group:Control	RAW_FILE_NAME=Control_MAMB_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_MBKH-	Group:Control	RAW_FILE_NAME=Control_MBKH_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_MEPA-	Group:Control	RAW_FILE_NAME=Control_MEPA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_MOKE-	Group:Control	RAW_FILE_NAME=Control_MOKE_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_NDFA25-	Group:Control	RAW_FILE_NAME=Control_NDFA25_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_NDGU23-	Group:Control	RAW_FILE_NAME=Control_NDGU23_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_NGEU-	Group:Control	RAW_FILE_NAME=Control_NGEU_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_NZFE-	Group:Control	RAW_FILE_NAME=Control_NZFE_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_PAMA-	Group:Control	RAW_FILE_NAME=Control_PAMA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_RAFA-	Group:Control	RAW_FILE_NAME=Control_RAFA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SAAD-	Group:Control	RAW_FILE_NAME=Control_SAAD_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SAAL-	Group:Control	RAW_FILE_NAME=Control_SAAL_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SACA23-	Group:Control	RAW_FILE_NAME=Control_SACA23_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SADI-	Group:Control	RAW_FILE_NAME=Control_SADI_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SALL-	Group:Control	RAW_FILE_NAME=Control_SALL_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SESO-	Group:Control	RAW_FILE_NAME=Control_SESO_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_BASA-	Group:T2D	RAW_FILE_NAME=T2D_BASA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_CAFA-	Group:T2D	RAW_FILE_NAME=T2D_CAFA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_CODI-	Group:T2D	RAW_FILE_NAME=T2D_CODI_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DAFA60-	Group:T2D	RAW_FILE_NAME=T2D_DAFA60_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DIDA-	Group:T2D	RAW_FILE_NAME=T2D_DIDA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DIFA-	Group:T2D	RAW_FILE_NAME=T2D_DIFA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DIFA37-	Group:T2D	RAW_FILE_NAME=T2D_DIFA37_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DIKH-	Group:T2D	RAW_FILE_NAME=T2D_DIKH_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DSMA-	Group:T2D	RAW_FILE_NAME=T2D_DSMA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_FAAS-	Group:T2D	RAW_FILE_NAME=T2D_FAAS_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_FAOU-	Group:T2D	RAW_FILE_NAME=T2D_FAOU_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_GUOU-	Group:T2D	RAW_FILE_NAME=T2D_GUOU_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_GUSA-	Group:T2D	RAW_FILE_NAME=T2D_GUSA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_KAAD-	Group:T2D	RAW_FILE_NAME=T2D_KAAD_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_LEWA-	Group:T2D	RAW_FILE_NAME=T2D_LEWA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_MADI52-	Group:T2D	RAW_FILE_NAME=T2D_MADI52_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_MBPA-	Group:T2D	RAW_FILE_NAME=T2D_MBPA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_MOMB-	Group:T2D	RAW_FILE_NAME=T2D_MOMB_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDFA-	Group:T2D	RAW_FILE_NAME=T2D_NDFA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDMO-	Group:T2D	RAW_FILE_NAME=T2D_NDMO_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDND-	Group:T2D	RAW_FILE_NAME=T2D_NDND_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDOU-	Group:T2D	RAW_FILE_NAME=T2D_NDOU_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDPA-	Group:T2D	RAW_FILE_NAME=T2D_NDPA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NIIB-	Group:T2D	RAW_FILE_NAME=T2D_NIIB_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SADI-	Group:T2D	RAW_FILE_NAME=T2D_SADI_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SAKH-	Group:T2D	RAW_FILE_NAME=T2D_SAKH_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SAMO11-	Group:T2D	RAW_FILE_NAME=T2D_SAMO11_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SASE-	Group:T2D	RAW_FILE_NAME=T2D_SASE_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SODA-	Group:T2D	RAW_FILE_NAME=T2D_SODA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SOFA-	Group:T2D	RAW_FILE_NAME=T2D_SOFA_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_THAN-	Group:T2D	RAW_FILE_NAME=T2D_THAN_neg.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_AKLA+	Group:Control	RAW_FILE_NAME=Control_AKLA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_AMDI+	Group:Control	RAW_FILE_NAME=Control_AMDI_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_BABI+	Group:Control	RAW_FILE_NAME=Control_BABI_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_BACO+	Group:Control	RAW_FILE_NAME=Control_BACO_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_BADA+	Group:Control	RAW_FILE_NAME=Control_BADA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_CECA+	Group:Control	RAW_FILE_NAME=Control_CECA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_COMA+	Group:Control	RAW_FILE_NAME=Control_COMA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_DIEM+	Group:Control	RAW_FILE_NAME=Control_DIEM_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_DIMA31+	Group:Control	RAW_FILE_NAME=Control_DIMA31_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_DOMA+	Group:Control	RAW_FILE_NAME=Control_DOMA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_EMYA+	Group:Control	RAW_FILE_NAME=Control_EMYA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_FAAH+	Group:Control	RAW_FILE_NAME=Control_FAAH_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_FAKA+	Group:Control	RAW_FILE_NAME=Control_FAKA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_FAND+	Group:Control	RAW_FILE_NAME=Control_FAND_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_HABA+	Group:Control	RAW_FILE_NAME=Control_HABA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_HOLE+	Group:Control	RAW_FILE_NAME=Control_HOLE_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_IBGA+	Group:Control	RAW_FILE_NAME=Control_IBGA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_KHGU+	Group:Control	RAW_FILE_NAME=Control_KHGU_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_MAMB+	Group:Control	RAW_FILE_NAME=Control_MAMB_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_MBKH+	Group:Control	RAW_FILE_NAME=Control_MBKH_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_MEPA+	Group:Control	RAW_FILE_NAME=Control_MEPA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_MOKE+	Group:Control	RAW_FILE_NAME=Control_MOKE_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_NDFA25+	Group:Control	RAW_FILE_NAME=Control_NDFA25_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_NDGU23+	Group:Control	RAW_FILE_NAME=Control_NDGU23_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_NGEU+	Group:Control	RAW_FILE_NAME=Control_NGEU_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_NZFE+	Group:Control	RAW_FILE_NAME=Control_NZFE_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_PAMA+	Group:Control	RAW_FILE_NAME=Control_PAMA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_RAFA+	Group:Control	RAW_FILE_NAME=Control_RAFA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SAAD+	Group:Control	RAW_FILE_NAME=Control_SAAD_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SAAL+	Group:Control	RAW_FILE_NAME=Control_SAAL_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SACA23+	Group:Control	RAW_FILE_NAME=Control_SACA23_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SADI+	Group:Control	RAW_FILE_NAME=Control_SADI_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SALL+	Group:Control	RAW_FILE_NAME=Control_SALL_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	Control_SESO+	Group:Control	RAW_FILE_NAME=Control_SESO_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_BASA+	Group:T2D	RAW_FILE_NAME=T2D_BASA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_CAFA+	Group:T2D	RAW_FILE_NAME=T2D_CAFA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_CODI+	Group:T2D	RAW_FILE_NAME=T2D_CODI_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DAFA60+	Group:T2D	RAW_FILE_NAME=T2D_DAFA60_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DIDA+	Group:T2D	RAW_FILE_NAME=T2D_DIDA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DIFA+	Group:T2D	RAW_FILE_NAME=T2D_DIFA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DIFA37+	Group:T2D	RAW_FILE_NAME=T2D_DIFA37_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DIKH+	Group:T2D	RAW_FILE_NAME=T2D_DIKH_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_DSMA+	Group:T2D	RAW_FILE_NAME=T2D_DSMA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_FAAS+	Group:T2D	RAW_FILE_NAME=T2D_FAAS_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_FAOU+	Group:T2D	RAW_FILE_NAME=T2D_FAOU_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_GUOU+	Group:T2D	RAW_FILE_NAME=T2D_GUOU_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_GUSA+	Group:T2D	RAW_FILE_NAME=T2D_GUSA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_KAAD+	Group:T2D	RAW_FILE_NAME=T2D_KAAD_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_LEWA+	Group:T2D	RAW_FILE_NAME=T2D_LEWA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_MADI52+	Group:T2D	RAW_FILE_NAME=T2D_MADI52_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_MBPA+	Group:T2D	RAW_FILE_NAME=T2D_MBPA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_MOMB+	Group:T2D	RAW_FILE_NAME=T2D_MOMB_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDFA+	Group:T2D	RAW_FILE_NAME=T2D_NDFA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDMO+	Group:T2D	RAW_FILE_NAME=T2D_NDMO_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDND+	Group:T2D	RAW_FILE_NAME=T2D_NDND_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDOU+	Group:T2D	RAW_FILE_NAME=T2D_NDOU_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NDPA+	Group:T2D	RAW_FILE_NAME=T2D_NDPA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_NIIB+	Group:T2D	RAW_FILE_NAME=T2D_NIIB_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SADI+	Group:T2D	RAW_FILE_NAME=T2D_SADI_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SAKH+	Group:T2D	RAW_FILE_NAME=T2D_SAKH_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SAMO11+	Group:T2D	RAW_FILE_NAME=T2D_SAMO11_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SASE+	Group:T2D	RAW_FILE_NAME=T2D_SASE_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SODA+	Group:T2D	RAW_FILE_NAME=T2D_SODA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_SOFA+	Group:T2D	RAW_FILE_NAME=T2D_SOFA_pos.mzxml
SUBJECT_SAMPLE_FACTORS           	-	T2D_THAN+	Group:T2D	RAW_FILE_NAME=T2D_THAN_pos.mzxml
#COLLECTION
CO:COLLECTION_SUMMARY            	Blood was drawn into fluoride tubes for glucose measurement, heparin tubes for
CO:COLLECTION_SUMMARY            	lipid measurement, and EDTA tubes for HbA1c and metabolomics analyses. Plasma
CO:COLLECTION_SUMMARY            	was isolated and stored at -80C until analysis.
CO:SAMPLE_TYPE                   	Blood (plasma)
#TREATMENT
TR:TREATMENT_SUMMARY             	NA
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Prior to LC-MS analysis, 10ul of plasma was resuspended in 9 volumes of
SP:SAMPLEPREP_SUMMARY            	pre-chilled (-20°C) methanol:acetonitrile:water (5:3:2, v:v) and vortexed
SP:SAMPLEPREP_SUMMARY            	continuously for 30 min at 4°C. Insoluble material was removed by
SP:SAMPLEPREP_SUMMARY            	centrifugation at 18,000 g for 10 min at 4°C and supernatants were isolated for
SP:SAMPLEPREP_SUMMARY            	metabolomics analysis by UHPLC-MS.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	Thermo Vanquish
CH:COLUMN_NAME                   	Phenomenex Kinetex C18 (100 x 2.1mm,1.7um)
CH:SOLVENT_A                     	0.1% formic acid in water
CH:SOLVENT_B                     	0.1% formic acid in acetonitrile
CH:FLOW_GRADIENT                 	0-0.5min 5% B; 1.1min 95% B; 2.75min 95%B; 3min 5%B; 5min 5%B
CH:FLOW_RATE                     	0.45
CH:COLUMN_TEMPERATURE            	45
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Thermo Q Exactive Orbitrap
MS:INSTRUMENT_TYPE               	Orbitrap
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	The Q Exactive mass spectrometer (ThermoFisher) was operated independently in
MS:MS_COMMENTS                   	positive or negative ion mode, scanning in Full MS mode (2 microscans) from 60
MS:MS_COMMENTS                   	to 900 m/z at 70,000 resolution, with 4 kV spray voltage, 45 sheath gas, 15
MS:MS_COMMENTS                   	auxiliary gas. Calibration was performed prior to analysis using the PierceTM
MS:MS_COMMENTS                   	Positive and Negative Ion Calibration Solutions (ThermoFisher). Acquired data
MS:MS_COMMENTS                   	was then converted from raw to mzXML file format using Mass Matrix (Cleveland,
MS:MS_COMMENTS                   	OH). Samples were analyzed in randomized order with a technical mixture injected
MS:MS_COMMENTS                   	periodically through analysis to qualify instrument performance. Metabolite
MS:MS_COMMENTS                   	assignments, isotopologue distributions, and correction for expected natural
MS:MS_COMMENTS                   	abundances of deuterium, 13C, and 15N isotopes were performed using MAVEN
MS:MS_COMMENTS                   	(Princeton, NJ)
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	AU
MS_METABOLITE_DATA_START
Samples	Control_KHGU+	Control_HABA+	Control_NDFA25+	Control_BACO+	Control_FAKA+	Control_AKLA+	Control_RAFA+	Control_DOMA+	Control_PAMA+	Control_SAAD+	Control_NZFE+	Control_DIEM+	Control_DIMA31+	Control_FAND+	Control_SACA23+	Control_BABI+	Control_MBKH+	Control_MEPA+	Control_HOLE+	Control_SAAL+	Control_NGEU+	Control_SESO+	Control_FAAH+	Control_EMYA+	Control_NDGU23+	Control_IBGA+	Control_SADI+	Control_MAMB+	Control_COMA+	Control_CECA+	Control_AMDI+	Control_MOKE+	Control_BADA+	Control_SALL+	T2D_DSMA+	T2D_MADI52+	T2D_MOMB+	T2D_SADI+	T2D_BASA+	T2D_NDOU+	T2D_GUOU+	T2D_MBPA+	T2D_SODA+	T2D_NDPA+	T2D_NDMO+	T2D_SOFA+	T2D_LEWA+	T2D_FAOU+	T2D_NIIB+	T2D_GUSA+	T2D_KAAD+	T2D_DIFA+	T2D_DIDA+	T2D_SAKH+	T2D_NDFA+	T2D_CAFA+	T2D_DIFA37+	T2D_DAFA60+	T2D_THAN+	T2D_CODI+	T2D_DIKH+	T2D_SAMO11+	T2D_NDND+	T2D_FAAS+	T2D_SASE+
Factors	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:Control	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D	Group:T2D
L-alanine	7.28E+06	8.24E+06	8.82E+06	7.32E+06	9.86E+06	9.78E+06	1.03E+07	1.10E+07	1.76E+07	1.40E+07	1.47E+07	1.03E+07	7.43E+06	1.38E+07	1.14E+07	1.23E+07	9.87E+06	5.18E+06	1.64E+07	1.17E+07	8.16E+06	5.65E+06	7.55E+06	7.39E+06	8.71E+06	7.78E+06	9.80E+06	1.57E+07	8.69E+06	1.07E+07	9.10E+06	7.63E+06	7.86E+06	9.12E+06	8.30E+06	1.07E+07	9.56E+06	9.40E+06	1.47E+07	9.53E+06	1.15E+07	9.43E+06	1.53E+07	1.20E+07	1.05E+07	1.03E+07	1.28E+07	1.12E+07	1.01E+07	6.38E+06	9.24E+06	7.57E+06	1.55E+07	1.35E+07	1.46E+07	8.76E+06	8.52E+06	1.19E+07	1.48E+07	9.38E+06	1.40E+07	1.73E+07	1.45E+07	6.23E+06	7.63E+06
L-arginine	2.33E+06	5.33E+06	2.09E+06	2.80E+06	3.35E+06	4.71E+06	3.03E+06	3.73E+06	4.06E+06	4.41E+06	3.48E+06	4.99E+06	3.76E+06	3.15E+06	4.29E+06	4.82E+06	2.38E+06	3.49E+06	2.74E+06	4.38E+06	2.88E+06	2.20E+06	2.12E+06	2.74E+06	4.88E+06	4.31E+06	4.70E+06	3.64E+06	3.28E+06	1.85E+06	2.84E+06	2.65E+06	3.67E+06	5.46E+06	3.14E+06	4.45E+06	5.21E+06	4.40E+06	4.01E+06	3.03E+06	1.57E+06	3.53E+06	2.97E+06	1.47E+06	3.53E+06	3.51E+06	2.58E+06	4.11E+06	4.81E+06	3.44E+06	3.85E+06	3.97E+06	2.06E+06	3.30E+06	2.65E+06	4.08E+06	3.95E+06	3.58E+06	2.19E+06	5.45E+06	3.04E+06	1.48E+06	3.11E+06	1.72E+06	1.80E+06
L-asparagine	1.46E+05	2.65E+05	3.80E+05	2.44E+05	5.67E+05	6.58E+05	6.47E+05	7.05E+05	6.44E+05	2.94E+05	8.05E+05	5.23E+05	6.37E+05	7.23E+05	5.40E+05	3.15E+05	2.52E+05	4.21E+05	6.05E+05	3.50E+05	5.14E+05	2.48E+05	3.49E+05	3.19E+05	2.51E+05	2.70E+05	5.44E+05	7.44E+05	2.61E+05	5.37E+05	7.30E+05	8.48E+05	5.62E+05	5.65E+05	4.92E+05	6.96E+05	2.70E+05	4.76E+05	6.78E+05	2.13E+05	5.44E+05	6.76E+05	3.08E+05	2.09E+05	2.27E+05	5.89E+05	3.67E+05	6.67E+05	5.50E+05	6.69E+05	2.22E+05	4.62E+05	8.16E+05	1.67E+05	4.79E+05	1.52E+05	3.55E+05	3.81E+05	2.82E+05	1.72E+05	2.73E+05	8.05E+05	1.98E+05	1.69E+05	5.29E+05
L-aspartate	2.44E+05	2.59E+05	6.11E+05	2.59E+05	7.84E+05	9.75E+05	6.33E+05	7.52E+05	8.09E+05	2.94E+05	1.07E+06	6.77E+05	9.39E+05	2.56E+05	1.10E+06	1.14E+05	1.12E+05	4.71E+05	1.48E+06	1.84E+05	1.13E+06	9.78E+04	3.07E+05	4.42E+05	6.42E+04	4.79E+05	1.07E+06	8.85E+05	3.14E+05	1.15E+06	1.07E+06	1.09E+06	1.24E+06	1.17E+06	7.38E+05	8.68E+05	4.39E+05	2.78E+05	2.27E+05	4.09E+05	1.08E+06	1.19E+06	9.88E+05	8.80E+04	3.00E+05	9.22E+05	4.98E+05	9.30E+05	6.78E+05	7.44E+05	4.19E+05	3.36E+05	3.38E+05	4.23E+05	2.07E+05	2.98E+05	3.18E+05	5.97E+05	2.83E+05	1.71E+05	4.16E+05	1.07E+06	2.72E+05	9.79E+04	7.06E+05
L-cysteine	1.07E+05	1.08E+05	2.89E+05	1.49E+05	4.12E+05	3.47E+05	1.80E+05	2.66E+05	3.23E+05	7.98E+04	2.34E+05	2.84E+05	1.92E+05	2.77E+05	2.29E+05	1.34E+05	1.35E+05	2.68E+05	3.58E+05	2.98E+05	3.61E+05	1.99E+05	1.38E+05	1.23E+05	9.01E+04	7.38E+04	2.07E+05	1.76E+05	1.73E+05	3.09E+05	3.66E+05	2.13E+05	2.82E+05	2.53E+05	2.84E+05	3.47E+05	1.79E+05	2.20E+05	3.74E+05	1.19E+05	4.58E+04	1.08E+05	2.35E+05	1.01E+05	3.62E+04	2.11E+05	2.36E+05	1.09E+05	1.99E+05	1.96E+05	4.83E+04	1.77E+05	3.65E+05	8.29E+04	1.65E+04	5.46E+04	7.60E+04	4.33E+04	1.21E+04	8.66E+04	7.60E+04	1.89E+05	4.45E+03	1.60E+05	1.11E+05
L-glutamate	1.60E+06	1.14E+06	2.14E+06	8.25E+05	2.83E+06	2.60E+06	1.06E+07	2.85E+06	6.41E+06	2.63E+06	7.07E+06	5.27E+06	3.75E+06	4.85E+06	4.13E+06	1.01E+06	5.87E+05	3.26E+06	1.82E+06	5.56E+06	3.26E+06	1.64E+06	8.62E+05	2.29E+06	1.06E+06	7.76E+05	1.41E+07	7.10E+06	1.73E+06	3.53E+06	6.58E+06	4.56E+06	4.45E+06	4.07E+06	3.63E+06	3.48E+06	9.45E+05	6.22E+06	4.25E+06	1.32E+06	9.57E+06	8.30E+06	7.63E+06	2.06E+06	2.60E+06	7.37E+06	5.29E+06	4.74E+06	7.50E+06	5.88E+06	1.23E+06	4.09E+06	5.66E+06	1.51E+06	3.88E+06	1.43E+06	1.47E+06	4.08E+06	4.95E+06	2.45E+06	2.38E+06	9.48E+06	1.22E+07	7.91E+05	5.69E+06
L-glutamine	3.14E+06	4.35E+06	7.83E+06	4.34E+06	1.47E+07	1.14E+07	8.10E+06	1.23E+07	1.53E+07	4.65E+06	1.48E+07	9.76E+06	1.32E+07	1.19E+07	1.18E+07	5.14E+06	4.46E+06	1.05E+07	1.13E+07	1.06E+07	1.03E+07	5.65E+06	3.64E+06	5.98E+06	4.00E+06	4.70E+06	8.37E+06	1.14E+07	4.10E+06	1.19E+07	1.69E+07	1.66E+07	1.51E+07	1.15E+07	1.07E+07	1.41E+07	5.07E+06	1.09E+07	1.18E+07	5.44E+06	1.06E+07	1.36E+07	6.61E+06	5.71E+06	4.43E+06	1.24E+07	6.47E+06	1.48E+07	1.23E+07	1.40E+07	4.57E+06	9.69E+06	1.30E+07	3.71E+06	8.31E+06	3.44E+06	4.30E+06	9.27E+06	5.03E+06	3.55E+06	6.23E+06	1.37E+07	5.82E+05	3.14E+06	9.48E+06
glycine	1.06E+06	1.25E+06	1.55E+06	1.10E+06	1.67E+06	1.74E+06	1.79E+06	1.56E+06	2.22E+06	1.19E+06	1.47E+06	1.57E+06	1.60E+06	1.66E+06	1.55E+06	9.29E+05	1.21E+06	1.35E+06	1.55E+06	1.00E+06	1.06E+06	1.09E+06	1.01E+06	1.06E+06	8.34E+05	8.04E+05	1.24E+06	1.78E+06	1.07E+06	1.68E+06	1.44E+06	1.62E+06	1.46E+06	1.33E+06	1.60E+06	2.06E+06	1.05E+06	1.66E+06	1.38E+06	1.27E+06	1.29E+06	1.50E+06	1.40E+06	1.12E+06	8.98E+05	1.48E+06	1.05E+06	1.48E+06	1.39E+06	1.39E+06	1.08E+06	1.03E+06	1.70E+06	7.47E+05	1.16E+06	1.03E+06	9.77E+05	1.11E+06	9.93E+05	7.63E+05	9.35E+05	1.36E+06	9.07E+05	6.74E+05	2.27E+06
L-histidine	2.86E+06	2.74E+06	2.74E+06	2.60E+06	2.01E+06	2.39E+06	2.13E+06	2.46E+06	1.82E+06	4.70E+06	2.43E+06	2.10E+06	2.00E+06	2.44E+06	1.60E+06	3.57E+06	4.08E+06	1.70E+06	2.33E+06	2.49E+06	2.30E+06	2.05E+06	3.66E+06	3.60E+06	2.46E+06	3.98E+06	2.43E+06	3.14E+06	3.33E+06	2.23E+06	1.80E+06	2.07E+06	2.21E+06	2.03E+06	1.89E+06	2.42E+06	4.19E+06	2.54E+06	3.36E+06	3.06E+06	2.30E+06	2.98E+06	2.37E+06	4.07E+06	3.34E+06	2.12E+06	3.59E+06	2.28E+06	2.44E+06	1.74E+06	3.35E+06	2.07E+06	2.92E+06	3.89E+06	3.22E+06	3.02E+06	3.85E+06	3.60E+06	2.57E+06	2.49E+06	3.40E+06	1.81E+06	2.37E+06	3.05E+06	1.87E+06
L-leucine	3.63E+07	3.95E+07	4.64E+07	4.35E+07	2.71E+07	4.96E+07	2.56E+07	3.44E+07	3.46E+07	6.02E+07	3.90E+07	2.88E+07	5.93E+07	2.73E+07	2.91E+07	4.31E+07	3.48E+07	2.18E+07	3.66E+07	7.04E+07	3.39E+07	5.65E+07	3.38E+07	4.85E+07	4.08E+07	4.63E+07	3.90E+07	3.84E+07	4.43E+07	2.71E+07	2.33E+07	3.04E+07	4.21E+07	5.33E+07	1.84E+07	4.18E+07	4.48E+07	3.92E+07	3.60E+07	5.73E+07	4.56E+07	5.16E+07	7.64E+07	6.19E+07	4.36E+07	2.80E+07	6.60E+07	5.26E+07	3.49E+07	2.84E+07	4.22E+07	3.61E+07	5.09E+07	6.56E+07	7.23E+07	4.55E+07	4.88E+07	8.70E+07	5.66E+07	4.72E+07	5.07E+07	4.60E+07	9.40E+07	3.26E+07	4.60E+07
L-lysine	3.15E+06	4.04E+06	3.06E+06	5.28E+06	3.82E+06	4.98E+06	2.92E+06	3.11E+06	4.03E+06	8.23E+06	5.00E+06	4.35E+06	2.62E+06	4.96E+06	3.12E+06	7.50E+06	7.17E+06	2.52E+06	6.02E+06	7.55E+06	3.36E+06	4.62E+06	5.45E+06	5.03E+06	5.64E+06	5.59E+06	4.82E+06	5.23E+06	5.45E+06	3.97E+06	5.04E+06	4.19E+06	4.70E+06	3.41E+06	3.94E+06	5.15E+06	8.01E+06	4.24E+06	6.47E+06	1.09E+07	3.96E+06	6.12E+06	5.76E+06	5.88E+06	7.21E+06	4.10E+06	6.49E+06	4.89E+06	4.36E+06	5.24E+06	6.43E+06	3.16E+06	4.07E+06	9.53E+06	7.74E+06	5.24E+06	8.01E+06	9.08E+06	6.03E+06	5.32E+06	9.77E+06	5.85E+06	7.92E+06	5.56E+06	3.95E+06
L-methionine	1.77E+06	2.79E+06	6.10E+06	2.41E+06	3.19E+06	4.61E+06	3.37E+06	4.65E+06	4.27E+06	3.72E+06	6.59E+06	3.81E+06	4.39E+06	4.50E+06	3.57E+06	2.84E+06	3.04E+06	1.64E+06	7.61E+06	8.16E+06	3.54E+06	2.56E+06	2.86E+06	3.32E+06	2.67E+06	2.93E+06	4.80E+06	3.68E+06	2.11E+06	5.32E+06	4.07E+06	4.02E+06	4.83E+06	3.88E+06	2.42E+06	3.44E+06	2.99E+06	3.14E+06	7.66E+06	3.94E+06	3.43E+06	5.46E+06	7.10E+06	2.82E+06	1.89E+06	3.52E+06	4.66E+06	4.66E+06	3.40E+06	3.78E+06	2.54E+06	3.66E+06	3.91E+06	2.47E+06	5.13E+06	1.49E+06	3.09E+06	8.02E+06	3.55E+06	2.16E+06	3.49E+06	6.62E+06	5.05E+06	1.84E+06	3.09E+06
L-phenylalanine	5.22E+06	6.14E+06	2.13E+07	6.82E+06	2.92E+07	6.03E+07	2.43E+07	4.00E+07	4.47E+07	1.38E+07	4.05E+07	3.79E+07	4.01E+07	4.13E+07	3.97E+07	7.26E+06	7.59E+06	2.08E+07	4.40E+07	2.25E+07	4.50E+07	7.72E+06	5.50E+06	8.51E+06	7.70E+06	8.23E+06	6.28E+07	6.51E+07	6.05E+06	3.89E+07	3.26E+07	3.39E+07	5.27E+07	4.17E+07	2.57E+07	4.66E+07	8.52E+06	3.88E+07	4.49E+07	1.12E+07	5.01E+07	5.98E+07	3.20E+07	7.48E+06	5.85E+06	4.26E+07	1.58E+07	4.12E+07	4.52E+07	3.51E+07	6.51E+06	3.00E+07	3.51E+07	6.79E+06	1.81E+07	1.05E+07	1.08E+07	3.23E+07	4.21E+07	7.08E+06	9.01E+06	4.80E+07	1.68E+07	8.86E+06	4.50E+07
L-proline	3.79E+07	4.10E+07	5.87E+07	4.27E+07	4.72E+07	4.57E+07	3.89E+07	4.52E+07	8.17E+07	6.87E+07	8.50E+07	4.27E+07	6.15E+07	6.51E+07	3.95E+07	7.28E+07	6.05E+07	3.46E+07	7.88E+07	5.85E+07	3.01E+07	5.10E+07	3.23E+07	6.57E+07	4.36E+07	5.91E+07	6.31E+07	5.76E+07	3.64E+07	4.03E+07	4.08E+07	5.48E+07	5.51E+07	5.16E+07	4.80E+07	7.27E+07	3.81E+07	4.42E+07	8.80E+07	4.60E+07	6.00E+07	7.10E+07	8.73E+07	5.33E+07	5.88E+07	5.93E+07	1.33E+08	4.84E+07	3.92E+07	5.55E+07	3.63E+07	3.66E+07	7.08E+07	5.12E+07	8.86E+07	4.46E+07	3.79E+07	8.37E+07	8.16E+07	5.92E+07	6.70E+07	8.11E+07	6.89E+07	2.93E+07	3.45E+07
L-serine	4.40E+05	8.84E+05	8.51E+05	6.85E+05	1.43E+06	1.46E+06	1.34E+06	1.70E+06	1.83E+06	6.82E+05	1.43E+06	1.23E+06	1.46E+06	1.32E+06	1.38E+06	7.17E+05	8.15E+05	1.23E+06	1.63E+06	7.35E+05	1.14E+06	7.62E+05	9.00E+05	8.25E+05	6.32E+05	5.71E+05	1.79E+06	1.69E+06	6.27E+05	1.55E+06	1.60E+06	1.87E+06	1.45E+06	1.51E+06	1.01E+06	1.39E+06	5.89E+05	1.70E+06	1.28E+06	7.72E+05	1.12E+06	1.29E+06	6.92E+05	8.11E+05	4.03E+05	1.44E+06	9.03E+05	1.31E+06	1.23E+06	1.49E+06	5.92E+05	8.84E+05	1.56E+06	6.65E+05	8.41E+05	5.69E+05	7.22E+05	9.65E+05	7.48E+05	5.81E+05	9.62E+05	1.82E+06	1.07E+06	7.35E+05	1.60E+06
L-threonine	1.54E+06	2.61E+06	3.31E+06	2.27E+06	4.53E+06	5.20E+06	4.13E+06	4.86E+06	5.53E+06	2.88E+06	5.75E+06	6.12E+06	4.52E+06	7.52E+06	4.81E+06	4.13E+06	2.58E+06	3.18E+06	3.97E+06	4.48E+06	2.47E+06	1.22E+06	1.95E+06	2.86E+06	2.15E+06	2.68E+06	7.66E+06	4.69E+06	2.01E+06	3.80E+06	5.47E+06	6.55E+06	5.41E+06	5.61E+06	3.37E+06	5.51E+06	2.43E+06	5.13E+06	6.99E+06	2.82E+06	3.39E+06	5.47E+06	3.06E+06	2.55E+06	2.22E+06	4.29E+06	3.36E+06	4.45E+06	4.67E+06	7.38E+06	2.33E+06	3.57E+06	4.34E+06	2.19E+06	3.30E+06	1.42E+06	3.71E+06	4.09E+06	2.49E+06	2.68E+06	2.59E+06	4.99E+06	2.62E+06	1.74E+06	4.17E+06
L-tryptophan	4.30E+07	2.30E+07	5.81E+07	4.47E+07	2.42E+07	2.93E+07	1.21E+07	3.25E+07	2.85E+07	6.53E+07	3.43E+07	1.90E+07	2.74E+07	2.58E+07	2.09E+07	5.54E+07	6.71E+07	8.63E+06	4.58E+07	6.85E+07	2.22E+07	3.27E+07	5.82E+07	5.91E+07	5.91E+07	6.74E+07	3.00E+07	2.11E+07	5.84E+07	2.93E+07	2.45E+07	2.03E+07	2.53E+07	3.09E+07	1.39E+07	1.84E+07	6.23E+07	2.51E+07	4.72E+07	1.04E+08	4.57E+07	5.52E+07	6.71E+07	7.72E+07	3.19E+07	1.85E+07	5.31E+07	2.28E+07	1.64E+07	1.53E+07	5.54E+07	2.81E+07	3.70E+07	6.14E+07	2.23E+07	8.69E+07	9.11E+07	1.03E+08	8.38E+07	3.72E+07	8.18E+07	2.39E+07	5.86E+07	9.62E+07	2.44E+07
L-tyrosine	3.50E+06	2.93E+06	7.91E+06	2.26E+06	5.92E+06	6.66E+06	4.77E+06	8.04E+06	9.40E+06	4.42E+06	9.56E+06	5.95E+06	6.06E+06	8.59E+06	5.60E+06	3.38E+06	3.89E+06	3.28E+06	1.20E+07	1.63E+07	5.08E+06	4.46E+06	2.27E+06	5.62E+06	3.81E+06	2.44E+06	8.93E+06	9.16E+06	2.15E+06	1.02E+07	9.98E+06	5.97E+06	9.23E+06	4.39E+06	5.20E+06	5.84E+06	2.74E+06	4.13E+06	1.67E+07	4.62E+06	8.88E+06	1.03E+07	1.92E+07	3.54E+06	1.72E+06	8.10E+06	1.10E+07	9.83E+06	4.85E+06	4.92E+06	3.87E+06	4.14E+06	9.95E+06	2.64E+06	7.47E+06	3.79E+06	3.42E+06	1.56E+07	1.16E+07	3.36E+06	6.44E+06	1.17E+07	9.41E+06	3.07E+06	5.38E+06
L-valine	5.70E+07	6.28E+07	9.21E+07	6.34E+07	4.73E+07	6.54E+07	4.33E+07	4.17E+07	7.42E+07	8.27E+07	6.89E+07	5.34E+07	5.14E+07	4.73E+07	5.08E+07	7.33E+07	6.91E+07	3.73E+07	8.88E+07	1.07E+08	4.76E+07	7.46E+07	5.53E+07	1.03E+08	7.21E+07	6.03E+07	8.58E+07	9.15E+07	6.43E+07	7.96E+07	4.69E+07	4.82E+07	7.80E+07	4.88E+07	4.53E+07	9.07E+07	6.44E+07	6.31E+07	8.84E+07	8.26E+07	8.47E+07	8.49E+07	1.34E+08	9.16E+07	6.49E+07	5.08E+07	1.25E+08	5.73E+07	5.32E+07	5.96E+07	6.33E+07	5.04E+07	8.32E+07	7.87E+07	9.91E+07	6.15E+07	6.76E+07	1.52E+08	1.19E+08	8.16E+07	9.27E+07	8.15E+07	1.63E+08	5.17E+07	6.99E+07
L-cystine	5.40E+04	6.59E+04	8.17E+04	4.96E+04	1.15E+05	2.10E+05	1.32E+05	6.89E+04	1.29E+05	6.33E+04	9.55E+04	1.33E+05	8.19E+04	1.97E+05	1.28E+05	1.57E+05	5.02E+04	1.78E+05	1.90E+05	9.73E+04	2.53E+05	1.09E+05	3.83E+04	1.48E+05	9.64E+04	5.52E+04	1.33E+05	9.96E+04	5.91E+04	1.18E+05	2.72E+05	8.55E+04	1.32E+05	1.97E+05	4.20E+05	3.98E+05	1.70E+05	2.18E+05	1.14E+05	7.84E+04	1.48E+05	3.32E+05	1.13E+05	3.58E+04	2.13E+05	1.46E+05	9.19E+04	1.11E+05	6.97E+05	1.57E+05	5.96E+04	7.84E+04	1.27E+05	1.82E+05	3.34E+04	6.28E+04	5.86E+04	1.39E+05	5.18E+04	2.13E+05	8.77E+04	1.75E+05	1.47E+05	4.42E+04	1.15E+05
Adenosine	1.43E+04	5.15E+03	1.17E+04	5.51E+03	7.50E+02	1.58E+03	1.54E+03	2.40E+03	2.05E+03	4.78E+03	2.74E+03	1.88E+03	0.00E+00	2.22E+03	1.58E+03	1.26E+05	4.97E+03	3.10E+03	1.71E+03	4.22E+03	2.43E+03	7.74E+03	1.27E+04	8.12E+03	2.51E+03	4.77E+03	1.65E+03	2.47E+03	4.51E+03	9.27E+02	2.53E+03	1.94E+03	2.58E+03	3.63E+03	1.78E+03	2.96E+03	0.00E+00	3.91E+03	2.13E+03	1.00E+04	1.92E+03	2.89E+03	8.50E+03	1.23E+04	6.49E+03	1.71E+03	8.18E+03	5.32E+03	2.48E+03	1.62E+03	7.08E+03	4.55E+03	2.69E+03	1.24E+04	0.00E+00	9.31E+03	5.97E+03	2.47E+03	5.59E+03	7.14E+03	5.81E+03	2.56E+03	1.16E+04	6.28E+03	1.64E+03
Adenine	2.12E+05	7.45E+04	5.67E+04	5.13E+04	6.96E+04	8.05E+04	7.36E+04	8.77E+04	9.89E+04	2.50E+04	7.98E+04	8.38E+04	9.79E+04	8.51E+04	6.79E+04	3.16E+05	2.33E+04	9.81E+04	8.88E+04	6.28E+04	7.31E+04	2.01E+04	1.48E+04	9.94E+03	2.41E+04	2.22E+04	1.66E+05	1.73E+05	1.93E+04	1.38E+05	1.34E+05	1.21E+05	1.49E+05	1.29E+05	8.02E+04	7.61E+04	3.58E+04	9.68E+04	7.15E+04	3.94E+04	1.65E+05	1.50E+05	1.30E+05	4.72E+04	2.58E+04	9.96E+04	7.44E+04	1.11E+05	1.02E+05	1.08E+05	2.42E+04	8.67E+04	1.11E+05	4.29E+04	0.00E+00	3.55E+04	0.00E+00	6.05E+04	5.62E+04	2.99E+04	2.51E+04	1.78E+05	8.36E+04	2.47E+04	1.18E+05
Hypoxanthine	3.15E+06	1.32E+05	2.27E+06	3.14E+05	1.58E+05	1.78E+06	2.36E+05	6.61E+05	1.99E+06	2.48E+06	6.07E+05	4.37E+05	1.33E+06	8.74E+05	8.40E+05	1.95E+06	1.45E+06	1.67E+06	1.19E+06	1.83E+06	7.16E+05	1.64E+06	7.13E+05	1.17E+06	1.17E+06	3.70E+05	3.57E+05	1.63E+05	8.49E+05	1.40E+06	7.03E+05	1.66E+05	1.37E+06	1.29E+06	2.12E+05	3.83E+05	4.85E+05	6.81E+05	2.86E+06	1.07E+07	3.95E+07	1.59E+07	2.69E+07	2.36E+07	3.23E+06	5.63E+05	1.90E+06	4.29E+05	3.31E+05	9.54E+05	1.01E+06	9.61E+05	2.11E+06	9.41E+05	1.26E+06	3.47E+05	1.18E+06	1.94E+06	3.29E+06	7.11E+05	1.85E+06	1.78E+05	2.13E+06	8.19E+04	1.00E+06
Xanthine	5.91E+04	8.87E+04	1.39E+05	6.47E+04	1.02E+05	1.90E+05	3.76E+04	1.33E+05	8.96E+04	1.15E+05	1.68E+05	2.11E+05	1.31E+05	1.71E+05	1.16E+05	1.13E+05	1.33E+05	1.42E+05	5.09E+05	1.61E+05	1.89E+05	1.73E+05	1.79E+05	2.56E+05	2.60E+05	2.31E+05	3.13E+05	7.61E+04	2.46E+05	1.75E+05	2.02E+05	1.66E+05	8.74E+04	1.90E+05	1.25E+05	1.39E+05	2.95E+05	8.53E+04	3.06E+05	2.81E+05	2.07E+05	1.52E+05	1.56E+05	3.32E+05	1.72E+05	1.54E+05	4.07E+05	2.29E+05	7.16E+04	1.31E+05	1.54E+05	1.33E+05	1.23E+05	1.20E+05	3.59E+05	4.81E+05	8.59E+04	3.46E+05	3.90E+05	1.27E+05	1.55E+05	1.26E+05	4.42E+05	2.72E+05	2.24E+05
Allantoate	6.10E+05	8.79E+05	6.92E+05	1.69E+06	5.83E+05	6.64E+05	5.35E+05	4.40E+05	6.26E+05	1.57E+06	7.45E+05	5.37E+05	5.40E+05	7.17E+05	5.62E+05	9.21E+05	1.37E+06	3.03E+05	1.26E+06	7.99E+05	2.83E+05	7.28E+05	7.69E+05	1.09E+06	8.42E+05	1.67E+06	7.14E+05	6.72E+05	1.37E+06	3.41E+05	5.52E+05	4.79E+05	6.98E+05	3.52E+05	7.26E+05	4.67E+05	1.82E+06	6.30E+05	7.75E+05	2.04E+06	7.38E+05	1.13E+06	4.92E+05	1.36E+06	1.31E+06	7.61E+05	5.01E+05	6.42E+05	5.77E+05	6.83E+05	9.48E+05	4.09E+05	9.11E+05	7.21E+05	6.65E+05	8.70E+05	1.64E+06	7.55E+05	5.93E+05	1.66E+06	1.47E+06	7.72E+05	6.14E+05	1.20E+06	3.89E+05
5-Hydroxyisourate	1.18E+05	2.86E+05	1.74E+05	2.33E+05	2.56E+05	1.76E+05	8.39E+04	1.96E+05	1.78E+05	1.61E+05	7.09E+04	1.14E+05	2.24E+05	1.43E+05	2.02E+05	1.55E+05	1.98E+05	7.13E+04	1.92E+05	7.42E+04	1.97E+05	1.10E+05	0.00E+00	9.97E+04	6.84E+04	9.14E+04	9.69E+04	1.17E+05	5.97E+04	1.53E+05	1.71E+05	2.35E+05	1.30E+05	1.04E+05	1.46E+05	1.51E+05	1.99E+05	1.93E+05	3.45E+05	1.65E+05	2.66E+05	2.73E+05	1.56E+05	1.11E+05	9.72E+04	1.60E+05	7.59E+04	2.21E+05	1.25E+05	1.82E+05	6.72E+04	9.42E+04	9.77E+04	1.69E+05	1.31E+05	8.07E+04	1.25E+05	1.79E+05	1.09E+05	5.71E+04	0.00E+00	1.01E+05	3.93E+04	1.26E+05	9.49E+04
Nicotimide	2.24E+06	5.47E+05	4.75E+05	4.30E+05	6.63E+05	4.65E+05	3.35E+05	3.49E+05	5.36E+05	5.95E+05	3.10E+05	0.00E+00	2.52E+05	3.94E+05	2.64E+05	5.71E+05	3.76E+05	2.71E+05	2.46E+05	2.73E+05	2.40E+05	4.73E+05	3.90E+05	7.31E+05	4.10E+05	5.53E+05	2.81E+05	3.16E+05	3.79E+05	2.67E+05	2.60E+05	2.48E+05	2.38E+05	2.84E+05	4.21E+05	3.79E+05	7.14E+05	3.93E+05	4.36E+05	1.92E+06	7.12E+05	7.36E+05	1.35E+06	1.72E+06	6.91E+05	2.28E+05	1.89E+06	3.16E+05	2.82E+05	2.57E+05	6.27E+05	3.88E+05	2.41E+05	1.59E+06	3.78E+05	7.55E+05	1.04E+06	5.16E+05	7.39E+05	1.32E+06	8.65E+05	2.41E+05	5.98E+05	6.41E+05	0.00E+00
Phosphate	1.05E+07	1.44E+07	1.96E+07	1.79E+07	9.27E+06	1.53E+07	6.83E+06	9.98E+06	1.49E+07	2.95E+07	2.32E+07	2.00E+07	2.04E+07	2.62E+07	2.21E+07	3.15E+07	2.64E+07	1.26E+07	4.30E+07	3.86E+07	2.42E+07	4.99E+07	2.66E+07	5.05E+07	3.76E+07	4.40E+07	3.84E+07	4.02E+07	4.03E+07	3.44E+07	2.15E+07	1.66E+07	1.79E+07	2.53E+07	1.02E+07	1.52E+07	1.86E+07	1.17E+07	1.64E+07	3.53E+07	1.59E+07	2.91E+07	2.94E+07	3.40E+07	3.90E+07	1.62E+07	4.51E+07	1.59E+07	1.67E+07	1.50E+07	3.09E+07	1.83E+07	2.99E+07	3.98E+07	4.30E+07	4.51E+07	3.61E+07	4.87E+07	3.50E+07	3.83E+07	4.61E+07	3.69E+07	4.57E+07	3.76E+07	2.38E+07
5-Oxoproline	2.59E+06	3.40E+06	6.23E+06	3.90E+06	1.11E+07	8.18E+06	8.43E+06	9.13E+06	1.22E+07	4.02E+06	1.20E+07	7.56E+06	1.10E+07	9.50E+06	9.22E+06	3.98E+06	3.19E+06	8.54E+06	9.79E+06	8.74E+06	8.83E+06	4.55E+06	2.81E+06	5.40E+06	3.05E+06	3.58E+06	8.97E+06	8.57E+06	3.44E+06	9.03E+06	1.35E+07	1.24E+07	1.23E+07	9.00E+06	9.30E+06	1.07E+07	4.24E+06	8.97E+06	8.95E+06	4.51E+06	1.01E+07	1.11E+07	6.78E+06	4.75E+06	4.21E+06	9.87E+06	6.11E+06	1.14E+07	1.01E+07	1.15E+07	3.63E+06	7.52E+06	1.12E+07	2.86E+06	7.84E+06	2.46E+06	3.22E+06	8.55E+06	6.19E+06	3.26E+06	5.26E+06	1.26E+07	3.46E+06	2.58E+06	7.77E+06
L-Homocysteine	7.15E+03	6.34E+04	2.73E+05	3.97E+04	1.44E+05	1.41E+05	9.26E+04	8.27E+04	2.11E+05	5.84E+04	1.94E+05	1.00E+05	1.64E+05	1.40E+05	1.76E+05	4.65E+04	1.03E+04	8.37E+04	2.93E+05	3.04E+05	3.37E+05	8.20E+04	4.47E+04	5.31E+04	4.94E+04	3.24E+04	3.08E+05	1.33E+05	4.56E+04	1.33E+05	1.61E+05	1.50E+05	1.93E+05	1.73E+05	1.39E+05	1.29E+05	2.53E+04	1.69E+05	1.56E+05	4.23E+04	1.20E+05	2.94E+05	1.54E+05	3.33E+04	3.03E+04	3.02E+05	1.18E+05	2.19E+05	1.42E+05	1.63E+05	1.05E+05	8.28E+04	1.54E+05	8.27E+03	0.00E+00	2.11E+04	2.46E+04	1.68E+05	1.26E+05	5.56E+04	8.94E+04	1.65E+05	1.78E+04	6.80E+04	1.24E+05
Dimethylglycine	8.90E+05	1.95E+06	1.76E+06	1.10E+06	1.90E+06	2.71E+06	1.14E+06	1.17E+06	1.29E+06	1.36E+06	2.06E+06	1.64E+06	1.88E+06	2.00E+06	1.38E+06	1.62E+06	2.00E+06	1.77E+06	3.02E+06	1.88E+06	1.26E+06	2.00E+06	1.02E+06	2.65E+06	2.41E+06	3.62E+06	3.19E+06	2.30E+06	1.77E+06	2.14E+06	2.47E+06	1.88E+06	3.50E+06	2.16E+06	1.46E+06	3.06E+06	2.00E+06	1.78E+06	3.33E+06	2.00E+06	1.63E+06	1.70E+06	2.58E+06	2.64E+06	2.48E+06	2.69E+06	2.71E+06	2.27E+06	1.62E+06	3.20E+06	1.21E+06	1.81E+06	2.08E+06	4.74E+06	2.62E+06	9.21E+05	1.52E+06	3.96E+06	1.99E+06	2.24E+06	2.41E+06	2.92E+06	5.27E+06	1.55E+06	2.63E+06
Ornithine	1.22E+06	1.45E+06	1.68E+06	3.06E+06	1.28E+06	1.72E+06	1.12E+06	8.23E+05	1.65E+06	3.35E+06	1.65E+06	1.38E+06	1.31E+06	2.03E+06	1.61E+06	2.25E+06	3.27E+06	8.09E+05	3.52E+06	2.39E+06	8.82E+05	1.80E+06	1.53E+06	2.52E+06	2.04E+06	3.57E+06	2.16E+06	1.75E+06	2.77E+06	1.00E+06	1.42E+06	1.42E+06	1.60E+06	9.62E+05	1.47E+06	1.35E+06	3.70E+06	1.59E+06	2.75E+06	4.95E+06	1.86E+06	3.66E+06	1.79E+06	2.81E+06	3.09E+06	1.84E+06	1.58E+06	1.91E+06	1.39E+06	1.80E+06	2.12E+06	1.03E+06	2.55E+06	2.06E+06	2.49E+06	1.85E+06	3.58E+06	3.00E+06	2.20E+06	3.22E+06	3.61E+06	2.35E+06	2.04E+06	2.66E+06	1.07E+06
L-Citrulline	2.50E+05	4.20E+05	8.75E+05	4.19E+05	1.06E+06	1.21E+06	1.15E+06	8.14E+05	9.81E+05	4.56E+05	1.27E+06	9.13E+05	1.62E+06	1.50E+06	1.79E+06	4.05E+05	3.86E+05	9.56E+05	9.45E+05	1.15E+06	6.95E+05	4.44E+05	2.87E+05	5.08E+05	3.30E+05	6.06E+05	1.77E+06	8.94E+05	3.77E+05	1.03E+06	1.07E+06	9.30E+05	1.49E+06	7.33E+05	8.76E+05	1.21E+06	6.41E+05	1.28E+06	1.44E+06	3.69E+05	9.24E+05	2.82E+06	6.78E+05	4.14E+05	8.04E+05	1.55E+06	4.58E+05	1.29E+06	2.30E+06	1.93E+06	3.75E+05	7.10E+05	5.59E+05	3.70E+05	4.55E+05	3.90E+05	4.07E+05	7.81E+05	5.15E+05	5.76E+05	2.66E+05	7.08E+05	7.26E+05	1.74E+05	7.24E+05
Spermidine	7.15E+05	4.21E+05	5.75E+05	8.25E+05	1.05E+05	1.23E+05	3.44E+04	5.57E+04	7.94E+04	4.56E+05	4.31E+04	1.69E+04	3.51E+04	1.99E+04	2.06E+04	3.12E+05	3.80E+05	6.52E+03	5.85E+04	1.27E+05	9.52E+03	2.90E+05	1.93E+05	2.24E+05	1.30E+05	1.75E+05	1.25E+04	1.10E+04	1.43E+05	1.71E+04	7.42E+03	9.16E+03	1.26E+04	0.00E+00	2.19E+04	6.12E+04	7.93E+05	9.79E+04	4.66E+04	1.02E+06	5.03E+04	1.21E+05	2.54E+05	3.06E+05	2.85E+05	2.12E+04	2.39E+05	3.83E+04	3.19E+04	2.78E+04	2.76E+05	4.15E+04	2.15E+04	2.79E+05	2.81E+05	2.11E+05	2.00E+05	1.73E+05	2.34E+05	1.34E+05	1.87E+05	3.02E+04	1.38E+05	2.03E+05	6.45E+03
Spermine	1.67E+05	8.39E+04	9.52E+04	2.57E+05	4.96E+03	4.11E+03	3.96E+03	1.00E+04	1.09E+04	3.52E+05	1.45E+04	0.00E+00	8.77E+03	3.05E+03	0.00E+00	1.49E+05	2.18E+05	0.00E+00	1.51E+04	4.56E+04	0.00E+00	1.26E+05	1.53E+05	1.90E+05	1.14E+05	1.46E+05	0.00E+00	3.80E+03	1.14E+05	0.00E+00	0.00E+00	0.00E+00	2.99E+03	0.00E+00	6.86E+03	5.40E+03	2.60E+05	3.66E+03	8.09E+03	5.12E+05	8.31E+03	6.76E+03	5.24E+04	2.18E+05	2.16E+05	0.00E+00	7.74E+04	0.00E+00	0.00E+00	0.00E+00	1.83E+05	0.00E+00	0.00E+00	1.81E+05	1.65E+05	1.97E+05	1.85E+05	1.38E+05	1.26E+05	8.85E+04	1.54E+05	0.00E+00	4.18E+04	1.71E+05	0.00E+00
D-Glucosamine	2.18E+04	2.03E+04	2.62E+04	1.62E+04	1.34E+05	1.45E+05	1.76E+05	1.16E+05	9.62E+04	5.43E+03	7.46E+04	3.30E+04	6.58E+04	8.02E+04	5.79E+04	2.83E+03	2.95E+03	6.34E+04	2.39E+04	4.20E+03	2.92E+04	9.05E+02	0.00E+00	0.00E+00	9.22E+02	2.22E+03	3.82E+04	2.84E+04	0.00E+00	1.83E+04	5.22E+04	1.43E+04	4.05E+04	2.92E+04	1.24E+05	9.17E+04	1.38E+04	1.65E+05	6.87E+04	4.25E+03	7.43E+04	1.47E+05	6.00E+04	2.51E+03	9.08E+03	1.76E+05	3.07E+03	8.53E+04	4.15E+04	7.92E+04	1.29E+03	4.50E+04	4.10E+04	9.23E+03	0.00E+00	0.00E+00	2.96E+03	1.57E+03	1.92E+04	3.20E+03	2.15E+03	4.24E+04	5.63E+03	0.00E+00	2.47E+04
Asymmetric dimethyl arginine	7.25E+05	5.12E+05	8.83E+05	7.87E+05	5.87E+05	6.87E+05	4.91E+05	5.71E+05	6.60E+05	1.23E+06	6.88E+05	4.71E+05	6.60E+05	5.92E+05	4.64E+05	6.47E+05	5.52E+05	3.83E+05	8.64E+05	8.52E+05	4.79E+05	1.13E+06	7.10E+05	1.08E+06	8.07E+05	8.74E+05	7.04E+05	5.66E+05	7.00E+05	6.61E+05	5.42E+05	3.91E+05	6.57E+05	5.58E+05	4.85E+05	7.00E+05	1.13E+06	5.43E+05	7.48E+05	1.03E+06	4.64E+05	1.02E+06	8.25E+05	6.42E+05	1.38E+06	5.78E+05	8.74E+05	5.22E+05	9.06E+05	6.05E+05	7.86E+05	3.99E+05	6.12E+05	1.03E+06	9.62E+05	1.01E+06	1.22E+06	1.21E+06	5.54E+05	1.20E+06	8.27E+05	6.22E+05	7.98E+05	8.13E+05	4.31E+05
Carnosine	0.00E+00	0.00E+00	0.00E+00	1.96E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	6.93E+04	0.00E+00	0.00E+00	3.25E+04	7.68E+03	0.00E+00	2.10E+04	1.88E+04	9.92E+04	6.85E+04	0.00E+00	0.00E+00	6.86E+03	1.05E+04	3.52E+04	3.38E+04	2.57E+04	0.00E+00	0.00E+00	2.43E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	2.18E+04	2.49E+04	0.00E+00	2.69E+04	4.18E+04	0.00E+00	6.12E+04	6.06E+03	9.84E+03	0.00E+00	1.77E+04	1.45E+05	2.38E+04	4.55E+04	0.00E+00	0.00E+00	7.51E+03	1.75E+04	3.17E+04	0.00E+00	7.46E+04	2.91E+04	1.24E+04	3.28E+04	1.46E+04	0.00E+00	1.90E+04	8.57E+04	0.00E+00	1.75E+05	1.05E+04	0.00E+00
5-Guanidino-2-oxopentanoate	4.26E+03	2.19E+03	1.29E+04	1.68E+04	4.20E+03	1.74E+04	2.08E+04	5.01E+03	4.69E+03	7.71E+03	4.66E+03	2.72E+04	1.34E+04	1.54E+04	5.55E+03	1.45E+04	0.00E+00	4.43E+03	1.16E+04	2.61E+04	1.16E+04	0.00E+00	8.53E+03	1.94E+04	2.33E+03	0.00E+00	8.51E+03	4.99E+04	1.59E+03	3.90E+03	3.92E+03	0.00E+00	7.12E+03	1.15E+04	0.00E+00	8.53E+03	2.57E+04	9.56E+03	3.27E+04	5.45E+03	1.29E+04	3.93E+04	1.71E+04	3.31E+03	2.01E+04	6.33E+03	2.37E+04	2.35E+04	5.60E+04	4.24E+04	1.44E+04	4.24E+04	2.12E+04	1.08E+04	1.14E+05	6.12E+03	2.89E+03	3.65E+04	3.30E+04	1.74E+04	4.02E+03	1.85E+04	0.00E+00	1.70E+03	0.00E+00
Phosphocreatine	6.40E+04	9.05E+04	9.22E+04	7.18E+04	1.02E+05	7.36E+04	4.95E+04	7.39E+04	5.77E+04	5.10E+04	7.55E+04	1.09E+05	1.11E+05	8.73E+04	4.37E+04	7.83E+04	8.72E+04	2.23E+04	9.97E+04	1.99E+05	6.68E+04	9.67E+04	6.63E+04	7.12E+04	9.88E+04	1.17E+05	8.22E+04	8.34E+04	4.54E+04	1.09E+05	4.31E+04	6.15E+04	4.37E+04	6.87E+04	6.72E+04	7.89E+04	7.92E+04	5.27E+04	9.46E+04	9.63E+04	8.97E+04	1.33E+05	1.01E+05	1.04E+05	7.82E+04	6.25E+04	1.47E+05	9.93E+04	7.48E+04	6.27E+04	6.47E+04	7.21E+04	5.84E+04	8.40E+04	1.13E+05	6.27E+04	7.65E+04	1.12E+05	9.46E+04	8.38E+04	1.07E+05	1.50E+05	4.12E+04	4.91E+04	8.20E+04
Creatine	2.28E+07	2.87E+07	1.14E+07	7.42E+06	1.59E+07	4.28E+07	9.27E+06	1.59E+07	3.46E+07	1.25E+07	9.19E+06	4.02E+07	9.32E+06	3.00E+07	2.26E+07	2.86E+07	2.12E+07	1.35E+07	2.70E+07	1.42E+07	1.49E+07	3.23E+07	9.04E+06	1.95E+07	7.69E+06	1.51E+07	1.80E+07	4.93E+07	3.45E+07	1.17E+07	3.18E+07	8.68E+06	3.48E+07	2.10E+07	1.26E+07	6.66E+07	2.70E+07	1.91E+07	1.50E+07	3.96E+07	2.16E+07	2.26E+07	3.29E+07	1.80E+07	1.52E+07	1.13E+07	4.18E+07	3.13E+07	9.20E+06	1.63E+07	4.23E+07	2.58E+07	2.69E+07	4.01E+07	3.87E+07	2.72E+07	3.84E+07	5.84E+07	2.16E+07	1.64E+07	3.13E+07	1.22E+07	5.27E+07	1.88E+07	3.76E+07
Creatinine	3.15E+07	1.93E+07	5.08E+07	4.34E+07	2.70E+07	3.84E+07	3.23E+07	2.76E+07	3.01E+07	5.93E+07	3.87E+07	2.71E+07	3.99E+07	3.12E+07	1.59E+07	3.70E+07	4.23E+07	2.32E+07	4.72E+07	8.78E+07	2.05E+07	4.95E+07	2.68E+07	3.42E+07	3.13E+07	5.38E+07	4.04E+07	3.49E+07	2.82E+07	4.30E+07	2.56E+07	2.63E+07	3.10E+07	2.53E+07	2.13E+07	3.95E+07	6.46E+07	2.59E+07	4.65E+07	3.12E+07	2.76E+07	8.11E+07	6.31E+07	4.91E+07	1.67E+08	2.61E+07	4.73E+07	2.81E+07	7.47E+07	5.96E+07	2.19E+07	2.42E+07	2.95E+07	5.33E+07	4.47E+07	3.95E+07	3.59E+07	6.37E+07	4.09E+07	5.18E+07	3.69E+07	2.81E+07	4.41E+07	2.68E+07	2.92E+07
4-Acetamidobutanoate	5.10E+05	8.20E+04	6.46E+05	1.02E+05	8.45E+04	7.89E+04	1.46E+05	7.25E+04	9.93E+04	1.94E+05	8.28E+04	2.42E+05	9.85E+04	1.88E+05	1.39E+05	1.07E+05	8.49E+04	6.67E+04	4.31E+06	1.58E+05	9.22E+04	1.22E+05	1.17E+05	2.02E+05	6.76E+04	1.23E+05	3.44E+05	9.66E+05	1.78E+05	8.54E+04	8.64E+04	7.95E+04	2.93E+05	1.50E+05	7.01E+04	2.50E+05	2.80E+05	5.09E+04	2.82E+05	2.11E+05	1.17E+05	3.70E+06	1.34E+05	1.67E+05	4.14E+05	1.00E+06	2.73E+05	3.35E+05	3.11E+06	2.01E+05	1.22E+05	2.27E+05	1.37E+06	4.92E+05	1.41E+05	6.09E+04	4.80E+04	3.93E+05	2.00E+05	5.99E+05	2.04E+05	3.60E+05	1.36E+05	7.79E+04	2.46E+05
N-Acetyl-L-ornithine	9.70E+04	1.99E+04	2.39E+05	1.41E+05	1.11E+05	2.56E+05	1.61E+05	1.12E+05	1.43E+05	1.17E+05	2.39E+05	2.14E+05	2.48E+05	1.24E+05	1.10E+05	3.29E+03	3.27E+04	7.44E+04	4.61E+05	1.73E+05	4.77E+05	1.69E+05	5.40E+04	2.64E+05	1.87E+04	8.71E+04	6.02E+05	2.49E+05	1.11E+05	3.62E+05	3.55E+05	2.37E+05	2.02E+05	1.84E+05	8.79E+04	1.54E+05	1.42E+05	1.12E+05	1.50E+05	1.57E+05	1.59E+05	1.02E+06	2.17E+05	1.01E+05	2.26E+05	3.12E+05	2.91E+05	2.91E+05	8.72E+05	2.06E+05	7.64E+04	1.33E+05	2.66E+05	1.80E+05	0.00E+00	5.95E+04	1.20E+05	2.47E+05	2.17E+05	7.34E+04	1.31E+05	1.01E+06	1.69E+05	3.04E+04	1.88E+05
trans-4-Hydroxy-L-proline	2.58E+05	6.20E+05	5.55E+05	2.84E+05	7.15E+05	7.19E+05	5.37E+05	5.41E+05	5.86E+05	4.52E+05	5.89E+05	2.01E+06	6.06E+05	4.95E+05	2.38E+06	5.09E+05	1.43E+06	3.14E+05	8.39E+05	1.13E+06	6.14E+05	5.32E+05	4.06E+05	7.13E+05	4.52E+05	7.97E+05	1.02E+06	7.85E+05	3.49E+05	9.82E+05	8.47E+05	1.11E+06	7.23E+05	6.38E+05	4.70E+05	1.44E+06	3.11E+05	1.87E+06	4.55E+05	4.68E+05	4.93E+05	9.99E+05	5.78E+05	7.27E+05	9.44E+05	9.54E+05	6.69E+05	7.04E+05	1.51E+06	1.99E+06	1.84E+05	6.74E+05	8.61E+05	5.24E+05	7.12E+05	1.15E+05	3.10E+05	3.89E+05	4.41E+05	6.17E+05	3.83E+05	9.17E+05	3.10E+05	3.56E+05	8.75E+05
L-1-Pyrroline-3-hydroxy-5-carboxylate	2.17E+06	1.43E+06	2.43E+06	2.38E+06	1.84E+06	1.25E+06	1.19E+06	1.28E+06	1.83E+06	3.21E+06	2.37E+06	8.56E+05	1.79E+06	1.63E+06	1.32E+06	1.67E+06	1.53E+06	7.19E+05	2.15E+06	1.87E+06	1.47E+06	1.27E+06	1.33E+06	2.70E+06	1.59E+06	2.27E+06	1.74E+06	2.28E+06	1.59E+06	1.04E+06	1.75E+06	1.54E+06	1.66E+06	1.63E+06	1.19E+06	1.68E+06	2.47E+06	1.53E+06	2.21E+06	3.04E+06	5.30E+06	4.39E+06	3.87E+06	4.07E+06	4.38E+06	1.43E+06	2.87E+06	2.18E+06	1.50E+06	1.60E+06	1.91E+06	1.70E+06	2.09E+06	1.78E+06	3.95E+06	2.37E+06	3.26E+06	3.34E+06	4.56E+06	3.51E+06	4.40E+06	4.19E+06	2.70E+06	2.62E+06	2.09E+06
Taurine	1.68E+05	3.01E+04	2.00E+05	3.31E+04	6.12E+05	3.47E+05	3.66E+05	2.73E+05	4.75E+05	6.50E+04	4.24E+05	3.60E+05	3.73E+05	5.36E+05	2.04E+05	1.69E+04	2.14E+04	4.27E+05	3.40E+05	1.45E+05	2.18E+05	9.39E+04	3.61E+04	7.58E+04	4.50E+04	5.45E+04	3.80E+05	4.58E+05	4.65E+04	2.78E+05	3.65E+05	3.54E+05	2.23E+05	4.89E+05	5.37E+05	3.20E+05	6.50E+04	3.12E+05	2.75E+05	1.71E+05	1.40E+06	7.02E+05	6.27E+05	1.98E+05	1.34E+05	6.21E+05	6.08E+05	5.89E+05	5.39E+05	5.80E+05	6.06E+04	8.42E+05	7.29E+05	1.90E+05	2.23E+05	9.96E+04	8.77E+04	1.88E+05	2.68E+05	3.35E+05	1.42E+05	2.54E+05	2.65E+05	7.98E+04	2.21E+05
Hypotaurine	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	6.79E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	8.68E+03	0.00E+00	7.11E+03	2.75E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	7.89E+03	0.00E+00	6.35E+03	6.94E+03	2.23E+04	0.00E+00	0.00E+00	4.66E+03	0.00E+00	0.00E+00	0.00E+00	3.20E+04	3.30E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	1.89E+04	1.70E+04	5.45E+03	3.97E+04	0.00E+00	2.85E+04	1.87E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	7.44E+03	0.00E+00	0.00E+00	0.00E+00	8.43E+03	0.00E+00	6.37E+03
3-Sulfino-L-alanine	5.77E+03	0.00E+00	0.00E+00	0.00E+00	1.41E+04	0.00E+00	6.07E+03	0.00E+00	0.00E+00	0.00E+00	6.63E+03	0.00E+00	1.04E+04	1.91E+04	7.26E+03	3.89E+03	0.00E+00	2.19E+04	8.55E+03	0.00E+00	1.72E+04	0.00E+00	7.45E+03	0.00E+00	0.00E+00	0.00E+00	7.94E+03	4.16E+03	0.00E+00	2.18E+04	9.70E+03	1.58E+04	1.93E+04	2.59E+04	4.52E+03	2.25E+03	4.90E+03	5.08E+03	4.29E+03	0.00E+00	3.43E+03	8.55E+03	0.00E+00	0.00E+00	0.00E+00	6.18E+03	1.40E+04	1.14E+04	5.03E+03	5.31E+03	0.00E+00	3.46E+05	2.89E+05	0.00E+00	9.73E+04	0.00E+00	1.48E+04	4.96E+03	0.00E+00	0.00E+00	0.00E+00	1.06E+04	0.00E+00	0.00E+00	4.12E+04
L-Cysteate	7.23E+04	9.71E+04	1.18E+05	3.70E+04	1.27E+05	4.99E+04	1.28E+05	1.28E+05	6.41E+04	9.70E+04	9.38E+04	1.11E+05	6.98E+04	8.85E+04	2.11E+04	1.10E+05	1.05E+05	4.16E+04	8.98E+04	4.92E+04	9.18E+04	9.26E+04	7.27E+04	8.87E+04	1.13E+05	7.68E+04	1.43E+05	8.59E+04	6.31E+04	1.02E+05	1.06E+05	8.62E+04	1.25E+05	9.45E+04	1.01E+05	1.27E+05	8.79E+04	1.32E+05	6.81E+04	6.87E+04	1.05E+05	1.00E+05	1.51E+05	1.24E+05	3.83E+04	1.26E+05	6.53E+04	1.60E+05	7.04E+04	1.23E+05	6.80E+04	1.15E+05	6.34E+04	1.02E+05	3.69E+04	1.38E+05	5.34E+04	8.80E+04	4.51E+04	6.34E+04	7.83E+04	1.58E+05	8.72E+04	1.16E+05	1.27E+05
L-Methionine S-oxide	8.48E+05	4.71E+05	9.20E+05	7.41E+05	2.34E+05	4.36E+05	1.93E+05	3.70E+05	2.94E+05	1.11E+06	2.27E+05	1.25E+05	1.98E+05	1.79E+05	1.73E+05	5.92E+05	5.18E+05	5.77E+04	3.00E+05	3.46E+05	1.05E+05	2.45E+05	4.58E+05	5.17E+05	2.96E+05	4.24E+05	1.70E+05	1.11E+05	2.47E+05	1.32E+05	9.79E+04	1.24E+05	1.41E+05	1.11E+05	1.77E+05	2.97E+05	8.38E+05	2.26E+05	3.63E+05	1.05E+06	2.61E+05	2.71E+05	4.14E+05	4.87E+05	3.53E+05	1.14E+05	3.44E+05	1.89E+05	1.63E+05	1.20E+05	5.31E+05	1.20E+05	1.53E+05	3.30E+05	6.14E+05	3.00E+05	5.29E+05	8.04E+05	5.19E+05	3.06E+05	7.04E+05	1.84E+05	2.75E+05	4.30E+05	1.10E+05
5-Hydroxyindoleacetate	3.91E+04	1.32E+04	1.33E+05	3.86E+04	2.12E+05	6.22E+05	1.60E+05	2.00E+05	2.64E+05	8.36E+04	3.10E+05	3.26E+05	2.52E+05	2.08E+05	2.03E+05	5.51E+04	4.80E+04	1.66E+05	2.80E+05	1.24E+05	1.77E+05	3.13E+04	5.00E+04	4.06E+04	4.73E+04	7.29E+04	5.90E+05	3.83E+05	4.02E+04	2.53E+05	2.67E+05	1.98E+05	3.69E+05	2.52E+05	1.87E+05	4.90E+05	6.81E+04	2.01E+05	3.28E+05	6.55E+04	5.59E+05	6.56E+05	1.34E+05	3.96E+04	6.59E+04	2.16E+05	8.40E+04	3.59E+05	6.12E+05	3.15E+05	1.82E+04	2.31E+06	1.73E+06	7.69E+04	6.74E+04	7.58E+04	9.02E+04	1.98E+05	1.88E+05	8.85E+04	9.30E+04	2.80E+05	6.76E+04	6.88E+04	2.87E+05
3-Methyldioxyindole	1.18E+04	2.47E+04	1.08E+04	1.13E+04	1.78E+04	1.32E+04	1.57E+04	1.20E+04	2.23E+04	2.74E+04	1.62E+04	1.03E+04	1.62E+04	7.11E+03	1.90E+04	2.53E+04	2.82E+04	9.15E+03	1.76E+04	8.56E+03	2.54E+04	6.82E+03	1.20E+04	1.15E+04	1.19E+04	2.98E+04	1.16E+04	1.09E+04	1.09E+04	6.08E+03	6.52E+03	4.57E+03	6.36E+03	9.91E+03	6.18E+03	2.59E+04	2.49E+04	1.57E+04	8.61E+03	2.54E+04	1.26E+04	1.67E+04	8.34E+03	2.40E+04	6.58E+04	1.48E+04	2.88E+04	0.00E+00	2.41E+04	2.14E+04	1.16E+04	9.87E+03	6.70E+03	2.45E+04	3.80E+04	6.81E+04	4.92E+04	3.83E+04	1.90E+04	1.12E+05	2.82E+04	1.12E+04	2.71E+04	1.61E+04	1.08E+04
Indole	1.21E+06	7.10E+05	1.64E+06	1.33E+06	8.88E+05	1.08E+06	4.52E+05	1.19E+06	9.73E+05	2.42E+06	1.46E+06	7.77E+05	1.12E+06	1.09E+06	2.26E+06	2.56E+06	2.39E+06	3.61E+05	1.90E+06	2.66E+06	1.06E+06	4.42E+06	2.44E+06	2.12E+06	2.23E+06	2.46E+06	1.30E+06	1.05E+06	2.21E+06	1.25E+06	8.65E+05	9.10E+05	1.13E+06	1.34E+06	4.94E+05	7.20E+05	1.92E+06	8.74E+05	1.81E+06	3.67E+06	1.72E+06	1.99E+06	2.24E+06	3.09E+06	5.89E+06	7.79E+05	1.91E+06	9.95E+05	7.67E+05	1.06E+06	2.07E+06	9.23E+05	1.48E+06	2.60E+06	1.23E+06	3.60E+06	3.58E+06	4.34E+06	3.67E+06	1.49E+06	3.24E+06	1.10E+06	2.27E+06	3.90E+06	1.16E+06
Indole-3-acetate	3.52E+05	1.38E+05	2.22E+05	1.82E+05	2.32E+04	1.07E+05	5.30E+04	1.05E+05	3.00E+05	1.04E+06	1.12E+05	7.92E+04	7.50E+04	2.15E+05	4.67E+04	2.11E+05	2.09E+06	2.97E+04	1.73E+05	1.92E+05	5.86E+05	2.17E+05	3.07E+05	3.78E+05	2.52E+05	5.93E+05	1.36E+05	1.27E+05	3.57E+05	7.63E+04	9.56E+04	2.56E+04	8.34E+04	7.30E+04	2.27E+04	9.25E+04	3.69E+05	6.72E+04	2.92E+05	2.59E+05	1.08E+05	3.22E+05	7.57E+04	5.22E+05	1.06E+06	5.44E+04	3.11E+05	1.06E+05	1.61E+05	2.12E+05	1.82E+05	8.41E+04	1.14E+05	4.73E+05	2.59E+06	1.71E+06	2.79E+05	6.41E+05	4.53E+05	5.75E+05	5.21E+05	1.15E+05	1.97E+05	5.09E+05	3.93E+04
Indoxyl	8.14E+04	1.97E+04	6.18E+04	2.33E+04	2.71E+04	3.10E+04	1.93E+04	2.58E+04	4.78E+04	5.28E+04	2.44E+04	1.26E+05	3.61E+04	1.35E+04	4.15E+04	4.78E+05	1.37E+05	2.15E+04	1.52E+04	1.56E+04	6.71E+04	2.02E+05	4.42E+04	3.86E+04	3.57E+04	1.14E+05	5.69E+04	7.71E+04	9.27E+04	2.03E+04	2.73E+04	3.11E+04	2.33E+04	2.95E+04	4.15E+04	8.75E+04	1.68E+05	5.01E+04	3.79E+04	2.15E+05	4.14E+04	8.60E+04	9.03E+04	6.88E+04	1.48E+05	2.56E+04	1.54E+05	2.25E+04	9.95E+04	7.13E+04	1.43E+05	1.22E+04	4.26E+04	1.36E+05	1.32E+05	8.23E+04	2.60E+05	3.39E+05	5.43E+04	1.59E+05	2.18E+05	2.13E+04	9.37E+04	2.84E+05	3.67E+04
L-Tryptophamide	0.00E+00	6.98E+03	1.27E+04	0.00E+00	2.02E+03	3.78E+03	1.76E+03	0.00E+00	0.00E+00	2.12E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	1.58E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	1.46E+04	0.00E+00	8.58E+03	3.84E+04	0.00E+00	3.17E+03	0.00E+00	0.00E+00	2.94E+03	0.00E+00	3.49E+03	0.00E+00	0.00E+00	2.34E+03	3.29E+03	0.00E+00	0.00E+00	4.02E+03	0.00E+00	5.35E+03	1.33E+04	0.00E+00	0.00E+00	0.00E+00	3.05E+03	4.22E+03	1.41E+04	0.00E+00	0.00E+00	4.01E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	4.80E+04	0.00E+00	2.21E+03	1.48E+04	1.27E+04	0.00E+00
Kynurenine	1.09E+05	3.51E+04	3.88E+05	9.70E+04	5.83E+05	1.83E+06	4.26E+05	7.21E+05	7.89E+05	2.97E+05	8.59E+05	9.36E+05	6.58E+05	6.61E+05	5.91E+05	1.78E+05	1.54E+05	4.63E+05	7.62E+05	3.59E+05	5.18E+05	9.48E+04	1.49E+05	1.04E+05	1.10E+05	2.04E+05	1.61E+06	1.16E+06	1.27E+05	6.99E+05	7.01E+05	6.34E+05	1.01E+06	5.61E+05	5.24E+05	1.42E+06	2.28E+05	5.68E+05	8.73E+05	1.53E+05	1.76E+06	1.86E+06	3.71E+05	1.44E+05	2.03E+05	5.38E+05	2.39E+05	1.13E+06	1.79E+06	9.14E+05	9.41E+04	7.25E+05	1.13E+06	2.07E+05	3.10E+05	1.91E+05	2.50E+05	5.07E+05	5.04E+05	2.41E+05	2.33E+05	7.61E+05	1.97E+05	1.57E+05	6.52E+05
Kynurenic acid	2.88E+04	3.05E+04	5.47E+04	5.84E+04	1.59E+04	4.10E+04	3.91E+04	4.00E+04	2.27E+04	1.74E+05	5.07E+04	4.08E+04	4.36E+04	4.05E+04	2.70E+04	8.01E+04	1.11E+05	3.15E+04	7.77E+04	1.34E+05	4.09E+04	5.79E+04	5.56E+04	1.14E+05	9.61E+04	1.05E+05	5.73E+04	5.80E+04	1.28E+05	6.18E+04	4.50E+04	2.20E+04	4.22E+04	3.34E+04	3.29E+04	4.30E+04	7.47E+04	3.51E+04	6.15E+04	9.33E+04	5.09E+04	7.85E+04	5.65E+04	1.12E+05	4.36E+05	4.41E+04	7.54E+04	5.09E+04	7.80E+04	8.51E+04	4.75E+04	2.71E+04	5.07E+04	1.38E+05	1.23E+05	1.02E+05	1.08E+05	1.82E+05	6.46E+04	2.16E+05	1.37E+05	2.72E+04	6.26E+04	1.07E+05	3.10E+04
Anthranilate	2.40E+05	0.00E+00	1.66E+06	4.47E+05	6.15E+04	7.81E+04	2.01E+05	5.54E+04	3.25E+05	3.06E+05	8.00E+04	2.04E+05	1.37E+05	4.27E+04	3.83E+04	8.82E+04	4.04E+05	4.31E+04	4.49E+05	4.22E+05	1.12E+05	7.20E+05	2.43E+05	5.30E+05	2.64E+05	2.30E+05	1.19E+06	3.71E+05	6.65E+04	8.18E+04	4.34E+05	6.35E+04	2.53E+05	2.24E+05	6.38E+04	2.13E+05	4.75E+05	2.11E+05	2.30E+05	1.94E+05	6.19E+05	1.23E+06	3.63E+05	2.82E+05	3.14E+06	8.35E+05	2.51E+05	3.35E+05	8.90E+05	2.53E+06	1.12E+05	2.54E+05	6.17E+05	3.85E+05	2.60E+05	4.46E+05	1.27E+05	2.87E+05	3.04E+05	6.52E+05	2.50E+05	5.03E+05	3.49E+06	4.46E+05	1.89E+05
g-Oxalo-crotote	3.17E+05	4.59E+03	3.12E+05	2.21E+04	6.15E+03	1.10E+05	1.81E+04	5.12E+04	2.17E+05	2.47E+05	3.49E+04	2.71E+04	9.85E+04	9.42E+04	8.03E+04	2.82E+05	2.36E+05	1.34E+05	1.17E+05	5.27E+05	6.37E+04	7.37E+05	1.82E+05	3.28E+05	2.95E+05	8.23E+04	1.15E+04	2.03E+03	1.83E+05	1.33E+05	6.27E+04	9.07E+03	1.02E+05	1.05E+05	1.29E+04	2.00E+04	4.73E+04	5.11E+04	3.14E+05	1.50E+06	3.26E+06	1.99E+06	9.00E+06	6.79E+06	7.64E+05	7.04E+04	7.69E+05	2.97E+04	7.63E+03	9.56E+04	1.96E+05	7.79E+04	1.67E+05	2.48E+05	8.35E+05	7.35E+04	2.09E+05	8.46E+05	1.09E+06	2.02E+05	2.55E+05	3.72E+03	1.20E+06	5.34E+03	8.33E+04
2-Aminomucote	0.00E+00	0.00E+00	0.00E+00	3.35E+03	5.86E+03	0.00E+00	3.77E+03	0.00E+00	0.00E+00	0.00E+00	1.40E+04	0.00E+00	2.36E+04	1.07E+04	8.31E+03	8.83E+03	0.00E+00	9.01E+03	7.27E+03	7.12E+03	5.95E+03	0.00E+00	0.00E+00	0.00E+00	1.10E+04	3.88E+03	0.00E+00	1.50E+04	2.02E+04	0.00E+00	0.00E+00	6.76E+03	8.87E+03	0.00E+00	0.00E+00	4.03E+03	5.21E+04	5.50E+03	8.82E+03	1.64E+04	0.00E+00	9.81E+03	0.00E+00	0.00E+00	3.66E+04	6.07E+03	0.00E+00	6.29E+03	1.27E+04	1.03E+04	7.30E+03	0.00E+00	0.00E+00	1.27E+05	0.00E+00	1.71E+04	1.69E+04	0.00E+00	0.00E+00	4.52E+04	2.65E+04	9.09E+03	0.00E+00	1.39E+04	5.68E+03
8-Methoxykynurete	0.00E+00	0.00E+00	0.00E+00	1.00E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	4.50E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	9.89E+03	9.94E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	4.57E+03	0.00E+00	0.00E+00	2.65E+04	4.35E+03	0.00E+00	0.00E+00	0.00E+00	4.80E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	9.63E+03	2.46E+04	2.02E+04	3.12E+04	0.00E+00	3.46E+04	2.14E+04	0.00E+00	3.70E+04	0.00E+00	0.00E+00
Serotonin	7.08E+04	2.15E+04	2.44E+04	6.36E+06	3.47E+04	1.88E+04	1.71E+04	3.05E+04	2.06E+04	1.02E+07	2.34E+04	1.54E+04	1.91E+04	3.13E+04	1.52E+04	2.27E+04	1.49E+04	1.78E+04	2.77E+06	1.15E+04	8.39E+03	1.83E+04	2.11E+04	1.44E+04	1.55E+04	1.45E+04	1.34E+04	3.08E+04	9.16E+03	1.37E+04	1.26E+04	1.22E+04	1.27E+04	1.90E+04	2.00E+04	1.25E+04	1.44E+04	1.81E+04	7.67E+03	2.21E+04	8.32E+03	3.80E+04	8.76E+04	6.55E+04	1.38E+04	1.41E+04	2.47E+05	2.36E+04	2.11E+04	1.90E+04	1.15E+04	6.11E+04	2.50E+04	7.88E+04	1.28E+04	2.36E+04	1.52E+04	1.82E+04	1.38E+04	8.07E+04	1.43E+04	1.47E+04	2.70E+04	1.23E+04	1.90E+04
Diethanolamine	1.08E+05	8.31E+04	1.09E+05	1.37E+05	4.09E+04	4.81E+04	6.75E+04	7.39E+04	4.65E+04	1.54E+05	5.19E+04	4.21E+04	3.70E+04	4.71E+04	3.09E+04	9.77E+04	5.11E+04	5.63E+04	4.98E+04	6.69E+04	3.68E+04	8.39E+04	9.68E+04	6.31E+04	8.86E+04	7.66E+04	6.58E+04	5.20E+04	1.06E+05	6.24E+04	4.26E+04	1.52E+04	2.26E+04	3.93E+04	5.41E+04	6.43E+04	1.44E+05	3.58E+04	6.88E+04	9.49E+04	3.57E+04	7.00E+04	5.05E+04	1.10E+05	3.26E+05	4.63E+04	7.05E+04	7.95E+04	2.00E+05	1.00E+05	9.89E+04	4.26E+04	7.18E+04	1.65E+05	3.91E+04	2.17E+05	8.09E+04	1.62E+05	4.88E+04	2.53E+05	6.76E+04	3.56E+04	8.57E+04	6.56E+04	4.56E+04
Triethanolamine	2.66E+04	1.35E+04	1.54E+05	1.65E+04	3.07E+04	1.54E+04	2.89E+04	8.61E+04	5.67E+04	0.00E+00	5.99E+04	2.21E+04	4.73E+04	2.67E+04	2.84E+04	3.57E+04	8.09E+03	4.66E+04	4.74E+04	3.73E+04	3.40E+04	1.25E+04	0.00E+00	4.66E+03	1.87E+04	1.35E+04	8.79E+03	1.55E+04	1.17E+04	3.93E+04	2.69E+04	2.13E+04	1.97E+04	4.16E+03	6.02E+04	3.57E+04	1.48E+04	2.34E+04	3.11E+04	0.00E+00	2.50E+04	2.02E+04	3.78E+04	1.11E+04	1.19E+04	9.67E+03	5.24E+03	6.15E+04	1.85E+04	1.73E+04	1.40E+04	2.29E+04	1.14E+04	0.00E+00	6.52E+04	1.39E+04	2.06E+04	1.46E+04	1.23E+04	2.39E+04	5.41E+03	4.26E+04	1.26E+04	0.00E+00	1.41E+04
Phosphodimethyl-ethanolamine	7.58E+04	5.51E+04	1.34E+04	7.15E+04	0.00E+00	0.00E+00	0.00E+00	0.00E+00	3.82E+03	2.60E+04	0.00E+00	3.71E+04	4.44E+03	0.00E+00	0.00E+00	1.83E+04	7.57E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	4.73E+04	1.84E+04	3.15E+04	2.97E+04	0.00E+00	1.02E+04	3.19E+04	0.00E+00	8.81E+03	0.00E+00	5.55E+03	1.25E+04	0.00E+00	2.49E+04	7.56E+04	1.06E+04	0.00E+00	7.37E+04	3.96E+04	3.72E+04	5.77E+03	1.34E+05	3.24E+05	0.00E+00	0.00E+00	4.97E+04	2.94E+04	0.00E+00	2.71E+04	0.00E+00	1.17E+04	3.07E+05	4.11E+04	2.84E+04	9.81E+04	0.00E+00	0.00E+00	5.30E+05	4.74E+04	0.00E+00	1.71E+04	9.21E+04	2.45E+04
Acetylcarnitine	1.10E+07	1.82E+07	3.08E+07	1.86E+07	1.86E+07	2.03E+07	1.22E+07	1.50E+07	2.39E+07	1.66E+07	1.89E+07	1.15E+07	1.80E+07	1.31E+07	6.59E+06	1.81E+07	1.28E+07	1.26E+07	2.34E+07	2.46E+07	8.50E+06	2.84E+07	1.35E+07	2.97E+07	3.54E+07	1.60E+07	4.07E+07	1.29E+07	1.51E+07	2.50E+07	1.46E+07	1.61E+07	2.62E+07	1.73E+07	1.95E+07	1.68E+07	2.25E+07	2.56E+07	1.19E+07	1.24E+07	2.83E+07	2.67E+07	2.81E+07	3.11E+07	1.91E+07	9.90E+06	4.92E+07	9.37E+06	1.87E+07	1.22E+07	1.84E+07	1.01E+07	1.85E+07	2.63E+07	6.53E+06	1.23E+07	1.42E+07	5.03E+07	4.79E+07	3.64E+07	1.90E+07	1.32E+07	4.16E+07	1.53E+07	1.71E+07
Propionylcarnitine	5.72E+05	1.15E+06	9.05E+05	4.62E+05	1.38E+05	4.17E+05	2.37E+05	1.87E+05	6.96E+05	1.30E+06	2.07E+05	2.06E+05	5.07E+05	1.54E+05	1.24E+05	1.05E+06	9.35E+05	8.01E+04	4.90E+05	7.20E+05	1.12E+05	9.49E+05	4.58E+05	1.31E+06	5.38E+05	5.08E+05	2.97E+05	1.76E+05	9.87E+05	3.18E+05	1.31E+05	8.48E+04	1.51E+05	1.79E+05	1.43E+05	3.12E+05	6.73E+05	2.34E+05	8.52E+05	8.57E+05	4.14E+05	5.24E+05	8.07E+05	3.14E+06	1.39E+06	1.01E+05	2.60E+06	3.50E+05	5.14E+05	1.90E+05	1.11E+06	6.25E+04	3.61E+05	1.03E+06	1.11E+06	8.63E+05	9.75E+05	1.62E+06	2.19E+06	8.42E+05	1.70E+06	1.73E+05	2.72E+06	8.76E+05	2.04E+05
Butyrylcarnitine	5.64E+05	3.51E+05	2.83E+05	6.63E+05	7.74E+04	1.60E+05	8.77E+04	7.06E+04	6.52E+04	7.51E+05	1.04E+05	1.04E+05	7.97E+04	5.45E+04	1.10E+05	1.01E+06	6.70E+05	2.83E+04	7.56E+04	3.12E+05	3.01E+04	5.75E+05	4.33E+05	6.20E+05	6.57E+05	3.80E+05	1.97E+05	1.11E+05	7.00E+05	5.94E+04	4.24E+04	6.42E+04	5.92E+04	2.33E+04	1.20E+05	1.46E+05	9.06E+05	1.15E+05	1.57E+05	8.49E+05	1.70E+05	1.17E+05	2.36E+05	1.16E+06	3.85E+06	4.95E+04	5.52E+05	5.51E+04	4.55E+05	1.07E+05	7.53E+05	3.53E+04	2.27E+05	1.66E+06	1.01E+05	9.80E+05	1.03E+06	8.50E+05	6.96E+05	1.30E+06	6.03E+05	4.33E+04	3.51E+05	6.23E+05	8.07E+04
Tiglylcarnitine	6.48E+04	3.86E+04	5.03E+04	3.72E+04	4.74E+04	4.29E+04	3.67E+04	5.27E+04	5.56E+04	1.29E+05	3.88E+04	3.76E+04	5.03E+04	4.52E+04	4.05E+04	9.59E+04	1.55E+05	3.99E+04	5.99E+04	2.98E+04	5.22E+04	6.65E+04	2.39E+04	7.81E+04	8.61E+04	9.46E+04	4.71E+04	4.53E+04	8.17E+04	3.60E+04	4.37E+04	3.84E+04	5.00E+04	3.66E+04	4.73E+04	5.07E+04	2.78E+05	5.34E+04	6.48E+04	2.68E+05	4.53E+04	7.63E+04	7.70E+04	1.83E+05	4.18E+05	4.29E+04	9.02E+04	5.87E+04	6.85E+04	4.71E+04	7.72E+04	4.11E+04	3.49E+04	5.72E+05	3.11E+04	8.93E+04	1.79E+05	2.21E+05	1.05E+05	1.84E+05	1.48E+05	3.80E+04	1.67E+05	5.14E+04	9.57E+04
Valerylcarnitine	9.46E+05	3.73E+05	6.29E+05	1.38E+06	2.38E+05	5.94E+05	3.43E+05	2.49E+05	3.75E+05	2.89E+06	3.39E+05	3.21E+05	3.95E+05	2.71E+05	2.52E+05	1.97E+06	2.93E+06	1.53E+05	4.26E+05	2.36E+06	3.28E+05	6.30E+05	1.28E+06	2.62E+06	9.89E+05	1.30E+06	6.42E+05	6.00E+05	1.76E+06	3.07E+05	3.31E+05	2.35E+05	4.01E+05	2.61E+05	4.06E+05	5.06E+05	2.72E+06	4.56E+05	6.09E+05	1.82E+06	4.34E+05	1.21E+06	8.99E+05	2.33E+06	4.39E+06	2.86E+05	1.60E+06	2.01E+05	4.67E+05	4.35E+05	2.32E+06	1.95E+05	9.16E+05	4.88E+06	4.95E+05	1.91E+06	2.45E+06	2.78E+06	1.97E+06	2.68E+06	1.95E+06	3.12E+05	1.68E+06	3.79E+06	3.70E+05
Hexenoylcarnitine	4.46E+04	3.10E+04	3.50E+04	8.27E+04	1.77E+04	1.09E+04	5.97E+03	1.92E+04	1.68E+04	9.48E+04	1.38E+04	1.10E+04	1.43E+04	1.07E+04	1.23E+04	6.33E+04	7.39E+04	9.83E+03	3.64E+04	6.33E+04	1.28E+04	5.86E+04	6.50E+04	7.74E+04	1.29E+05	6.07E+04	5.31E+04	6.08E+03	4.20E+04	2.95E+04	8.75E+03	2.56E+04	8.10E+03	1.60E+04	1.85E+04	2.24E+04	3.64E+04	1.74E+04	1.75E+04	8.28E+04	4.87E+04	2.62E+04	2.87E+04	1.09E+05	2.47E+05	4.71E+03	4.07E+04	1.23E+04	2.02E+04	5.55E+04	5.59E+04	1.36E+04	1.45E+04	1.88E+05	3.60E+04	5.49E+04	6.93E+04	1.04E+05	3.49E+04	2.50E+05	5.03E+04	1.34E+04	5.35E+04	8.20E+04	1.10E+05
Hexanoylcarnitine	2.08E+05	3.60E+05	6.09E+05	1.38E+06	1.38E+05	1.81E+05	9.16E+04	1.44E+05	9.72E+04	4.59E+05	2.24E+05	1.03E+05	4.10E+05	1.02E+05	4.55E+04	7.73E+05	4.76E+05	9.78E+04	2.63E+05	1.28E+06	6.92E+04	7.94E+05	7.35E+05	1.38E+06	1.51E+06	3.03E+05	2.42E+05	1.01E+05	2.32E+05	2.95E+05	1.11E+05	8.77E+05	1.27E+05	1.92E+05	2.42E+05	1.04E+05	7.32E+05	2.16E+05	1.72E+05	4.11E+05	1.52E+05	2.17E+05	4.55E+05	6.71E+05	8.87E+05	1.23E+05	5.32E+05	3.24E+05	1.52E+05	1.55E+05	6.33E+05	1.20E+05	1.25E+05	8.31E+05	3.26E+05	5.15E+05	4.62E+05	1.08E+06	3.98E+05	1.08E+06	5.77E+05	8.66E+04	6.06E+05	4.82E+05	1.44E+05
Methylmalonylcarnitine	8.50E+03	2.29E+03	6.71E+04	6.44E+03	1.14E+04	3.42E+04	3.58E+04	2.13E+04	3.22E+04	5.92E+04	2.77E+04	3.10E+04	3.19E+04	5.59E+03	1.84E+04	9.20E+03	6.52E+03	4.35E+03	2.06E+04	6.01E+04	1.31E+04	1.16E+04	5.29E+03	6.25E+03	3.93E+03	7.02E+03	3.65E+04	8.36E+03	4.41E+03	1.57E+04	1.14E+04	2.56E+04	1.74E+04	2.01E+04	8.00E+03	2.06E+04	1.64E+04	2.51E+04	3.67E+04	9.09E+03	6.58E+04	6.53E+04	6.61E+04	1.21E+04	2.53E+04	3.65E+04	2.05E+04	2.82E+04	5.72E+04	3.87E+04	9.56E+03	2.25E+04	5.47E+04	9.71E+03	0.00E+00	7.31E+03	4.36E+03	7.97E+04	7.28E+04	8.10E+03	2.57E+04	4.23E+04	1.05E+05	1.47E+04	2.66E+04
Octenoylcarnitine	7.21E+05	5.35E+05	1.32E+06	3.19E+06	8.55E+05	1.01E+06	2.11E+05	5.59E+05	2.31E+05	5.78E+06	9.28E+05	4.09E+05	5.36E+05	4.90E+05	1.15E+05	4.17E+06	4.84E+06	1.50E+05	1.93E+06	1.05E+06	3.60E+05	6.43E+05	3.03E+06	4.53E+06	4.32E+06	1.40E+06	2.30E+06	4.65E+05	1.60E+06	1.00E+06	9.94E+05	5.22E+05	5.57E+05	7.69E+05	1.84E+05	1.22E+06	1.55E+06	3.55E+05	4.42E+05	2.24E+06	1.60E+06	7.44E+05	3.54E+06	2.85E+06	1.38E+07	1.88E+05	2.07E+06	4.30E+05	5.16E+05	5.47E+05	1.37E+06	1.72E+05	3.73E+05	9.19E+06	1.37E+06	1.99E+06	3.73E+06	7.81E+06	2.09E+06	1.99E+07	3.16E+06	5.45E+05	4.27E+06	9.09E+06	1.23E+06
Octanoylcarnitine	1.45E+06	3.03E+06	4.00E+06	1.25E+07	5.44E+05	8.50E+05	5.44E+05	5.76E+05	2.16E+05	2.99E+06	1.05E+06	3.56E+05	2.44E+06	2.92E+05	1.19E+05	4.87E+06	2.59E+06	1.74E+05	1.33E+06	8.32E+06	1.98E+05	5.31E+06	8.26E+06	1.09E+07	8.64E+06	1.85E+06	1.40E+06	5.07E+05	1.82E+06	1.66E+06	2.99E+05	6.20E+06	4.62E+05	7.47E+05	1.34E+06	4.03E+05	8.72E+06	9.58E+05	6.54E+05	3.62E+06	8.41E+05	1.46E+06	3.09E+06	3.85E+06	4.63E+06	8.29E+05	2.69E+06	2.45E+06	6.05E+05	5.65E+05	3.35E+06	5.26E+05	5.29E+05	6.99E+06	2.16E+06	3.12E+06	3.21E+06	6.77E+06	3.48E+06	5.19E+06	3.52E+06	3.98E+05	3.83E+06	3.89E+06	8.12E+05
Dimethylheptanoyl carnitine	3.59E+05	8.29E+04	6.95E+04	8.28E+05	2.38E+04	6.38E+04	1.18E+05	9.56E+04	2.21E+04	4.64E+05	7.17E+04	8.10E+04	1.43E+05	2.92E+04	1.73E+04	3.82E+05	9.80E+05	1.10E+04	9.50E+04	6.57E+05	1.68E+04	1.92E+05	3.44E+05	4.96E+05	2.55E+05	6.52E+05	5.76E+04	2.75E+04	4.46E+05	8.42E+04	8.86E+04	4.79E+04	4.25E+04	7.32E+04	2.73E+04	8.92E+04	5.43E+05	3.50E+04	4.03E+04	3.93E+05	5.97E+04	7.83E+04	8.76E+04	2.97E+05	1.68E+06	3.66E+04	1.54E+05	4.30E+04	1.16E+05	1.34E+05	1.77E+05	3.36E+04	4.41E+04	3.60E+05	1.26E+05	1.61E+05	5.90E+05	4.88E+05	1.12E+05	3.55E+05	1.46E+05	3.10E+04	9.43E+04	5.74E+05	3.82E+04
Pimelylcarnitine	2.70E+04	1.84E+04	1.47E+05	6.47E+04	1.33E+04	1.08E+04	4.93E+03	7.70E+03	1.80E+04	6.93E+04	1.26E+04	8.66E+03	1.00E+04	2.94E+03	5.58E+03	1.91E+04	2.39E+04	2.01E+03	9.39E+03	0.00E+00	9.70E+03	4.55E+04	3.03E+04	1.91E+04	4.98E+04	0.00E+00	2.96E+04	5.81E+03	0.00E+00	1.05E+04	1.09E+04	1.58E+04	4.75E+03	6.69E+03	5.39E+03	1.38E+04	4.53E+04	1.10E+04	6.93E+03	8.67E+04	1.29E+04	5.06E+04	0.00E+00	4.56E+04	1.18E+06	6.93E+03	2.97E+03	8.52E+03	3.99E+04	3.52E+04	0.00E+00	0.00E+00	0.00E+00	1.96E+05	1.60E+04	1.22E+04	0.00E+00	7.18E+04	1.08E+04	1.50E+05	2.44E+04	1.04E+04	3.67E+04	5.70E+03	1.14E+04
Hydroxyoctanoyl carnitine	1.80E+05	2.95E+05	3.29E+05	1.65E+06	7.71E+04	2.01E+05	1.05E+05	1.75E+05	6.51E+04	7.78E+05	2.24E+05	1.21E+05	2.13E+05	9.43E+04	2.79E+04	5.82E+05	6.96E+05	4.28E+04	2.69E+05	6.74E+05	5.06E+04	4.78E+05	6.05E+05	4.51E+05	1.51E+06	5.28E+05	3.30E+05	6.17E+04	3.87E+05	2.14E+05	6.08E+04	1.38E+05	2.02E+05	1.22E+05	1.36E+05	9.06E+04	1.18E+06	1.60E+05	1.69E+05	6.85E+05	1.73E+05	1.70E+05	3.55E+05	5.81E+05	6.75E+05	1.04E+05	6.74E+05	1.56E+05	1.22E+05	1.93E+05	4.79E+05	9.56E+04	1.27E+05	1.92E+06	3.29E+05	2.74E+05	5.16E+05	8.02E+05	4.35E+05	1.25E+06	4.52E+05	5.39E+04	2.15E+05	4.57E+05	1.10E+05
Decanoylcarnitine	1.47E+05	3.19E+05	5.94E+05	1.62E+06	1.10E+05	1.13E+05	1.18E+05	1.19E+05	4.27E+04	7.85E+05	2.72E+05	9.59E+04	6.76E+05	8.00E+04	4.08E+04	1.09E+06	4.94E+05	5.47E+04	3.35E+05	2.07E+06	5.68E+04	1.24E+06	2.55E+06	2.59E+06	3.01E+06	5.04E+05	5.19E+05	1.03E+05	5.29E+05	5.63E+05	1.10E+05	2.25E+06	2.16E+05	3.76E+05	3.12E+05	1.01E+05	1.25E+06	2.51E+05	1.32E+05	7.23E+05	1.71E+05	4.33E+05	5.96E+05	6.18E+05	7.00E+05	3.02E+05	1.02E+06	5.80E+05	1.60E+05	2.21E+05	1.03E+06	2.13E+05	1.64E+05	2.25E+06	8.93E+05	9.33E+05	8.85E+05	1.78E+06	9.80E+05	1.38E+06	1.26E+06	9.88E+04	9.52E+05	1.19E+06	2.56E+05
Dimethylnonoyl carnitine	1.48E+04	9.42E+03	7.76E+03	2.64E+04	4.26E+03	1.13E+03	8.82E+03	4.29E+03	8.46E+03	2.35E+04	6.55E+03	8.47E+03	7.28E+03	9.76E+03	1.04E+04	1.18E+04	5.54E+04	4.71E+03	9.81E+03	6.66E+04	7.84E+03	1.12E+04	3.29E+04	5.41E+04	2.50E+04	6.95E+04	0.00E+00	8.93E+03	1.97E+04	1.33E+04	1.21E+04	1.37E+04	1.11E+04	1.50E+04	9.39E+03	0.00E+00	1.85E+04	8.87E+03	4.26E+02	7.68E+03	7.58E+03	0.00E+00	5.26E+03	9.69E+03	1.65E+04	5.91E+03	9.12E+03	1.03E+04	4.68E+03	1.05E+04	6.73E+03	8.42E+03	4.80E+03	1.72E+04	9.96E+03	1.14E+04	5.54E+04	3.61E+04	1.17E+04	1.32E+04	1.45E+04	1.16E+04	1.19E+04	3.99E+04	1.20E+04
Hydroxydecanoyl carnitine	2.21E+05	3.18E+05	4.01E+05	2.63E+06	9.09E+04	1.21E+05	1.13E+05	9.71E+04	2.97E+04	9.73E+05	1.55E+05	9.86E+04	1.41E+05	5.94E+04	2.47E+04	5.93E+05	7.84E+05	1.49E+04	2.87E+05	6.05E+05	2.87E+04	4.19E+05	9.57E+05	5.48E+05	1.87E+06	4.83E+05	3.18E+05	5.04E+04	5.87E+05	1.81E+05	5.39E+04	1.43E+05	1.16E+05	9.46E+04	9.44E+04	6.82E+04	1.51E+06	1.73E+05	1.33E+05	1.28E+06	1.23E+05	1.47E+05	4.51E+05	6.48E+05	8.73E+05	6.53E+04	7.02E+05	1.41E+05	7.99E+04	1.59E+05	5.43E+05	8.60E+04	1.12E+05	2.83E+06	4.52E+05	3.98E+05	6.98E+05	9.33E+05	5.46E+05	1.21E+06	5.74E+05	3.86E+04	2.73E+05	5.81E+05	1.05E+05
Dodecenoylcarnitine	1.77E+04	2.41E+04	5.15E+04	6.68E+04	7.02E+03	1.20E+04	3.69E+03	8.40E+03	4.22E+03	2.80E+04	1.31E+04	3.63E+03	1.31E+04	2.79E+03	1.32E+03	3.08E+04	2.57E+04	6.54E+03	1.89E+04	2.38E+04	3.91E+03	3.73E+04	9.14E+04	6.08E+04	1.32E+05	2.71E+04	3.37E+04	2.16E+03	2.10E+04	2.21E+04	4.89E+03	9.97E+04	9.73E+03	1.71E+04	1.32E+04	3.51E+03	3.65E+04	7.74E+03	8.40E+03	2.66E+04	6.92E+03	1.01E+04	1.59E+04	2.20E+04	2.00E+04	5.44E+03	3.51E+04	7.48E+03	4.44E+03	8.12E+03	1.98E+04	5.29E+03	5.58E+03	4.63E+04	1.55E+04	1.58E+04	2.50E+04	5.04E+04	2.57E+04	1.37E+05	2.30E+04	5.77E+03	2.32E+04	5.87E+04	1.31E+04
Dodecanoylcarnitine	3.17E+04	3.67E+04	7.69E+04	1.52E+05	1.21E+04	1.57E+04	9.32E+03	1.10E+04	5.85E+03	1.10E+05	2.73E+04	7.97E+03	3.62E+04	7.06E+03	5.73E+03	9.82E+04	6.27E+04	6.91E+03	2.82E+04	1.02E+05	4.83E+03	6.18E+04	1.60E+05	1.93E+05	2.87E+05	5.03E+04	7.82E+04	6.59E+03	4.96E+04	2.92E+04	1.04E+04	9.76E+04	1.50E+04	2.17E+04	2.86E+04	7.75E+03	1.29E+05	2.60E+04	1.64E+04	6.77E+04	1.57E+04	2.79E+04	3.94E+04	4.23E+04	4.25E+04	1.37E+04	9.28E+04	2.66E+04	1.37E+04	1.80E+04	6.50E+04	1.05E+04	1.64E+04	1.44E+05	4.70E+04	1.20E+05	7.29E+04	7.82E+04	6.56E+04	1.69E+05	6.65E+04	6.35E+03	6.86E+04	8.35E+04	1.31E+04
Hydroxyundecanoyl carnitine	1.94E+04	9.36E+03	1.02E+04	2.68E+04	2.04E+04	1.83E+04	1.38E+04	6.55E+03	1.29E+04	2.90E+04	1.25E+04	7.72E+03	6.67E+03	7.79E+03	1.33E+04	1.83E+04	4.23E+04	1.34E+04	8.09E+03	7.44E+03	2.20E+04	1.67E+04	1.52E+04	2.02E+04	3.04E+04	2.44E+04	1.52E+04	1.10E+04	2.22E+04	1.01E+04	1.07E+04	1.39E+04	1.73E+04	1.78E+04	1.59E+04	1.08E+04	1.95E+04	8.03E+03	1.99E+04	2.25E+04	7.51E+03	1.46E+04	1.46E+04	3.06E+04	9.19E+04	6.86E+03	5.97E+03	7.60E+03	1.52E+04	1.62E+04	1.91E+04	1.04E+04	1.04E+04	2.71E+04	9.94E+03	1.29E+04	1.25E+04	1.67E+04	1.79E+04	2.63E+04	1.68E+04	1.63E+04	1.84E+04	3.43E+04	1.53E+04
Hydroxydodecanoyl carnitine	5.79E+03	4.40E+03	6.09E+03	2.91E+04	1.23E+03	3.70E+03	1.48E+03	3.09E+03	1.74E+03	4.38E+04	5.50E+03	3.07E+03	9.47E+03	0.00E+00	8.37E+03	2.28E+04	1.73E+04	3.66E+03	1.46E+04	2.50E+04	1.24E+03	1.81E+04	3.25E+04	2.58E+04	7.65E+04	3.00E+04	2.37E+04	1.90E+03	3.33E+04	1.40E+04	3.91E+03	1.55E+04	7.60E+03	6.68E+03	7.25E+03	3.14E+03	4.82E+04	2.32E+03	4.40E+03	3.04E+04	6.52E+03	7.98E+03	1.29E+04	2.94E+04	3.30E+04	3.26E+03	3.61E+04	6.47E+03	5.30E+03	1.87E+04	2.81E+04	4.95E+03	9.53E+03	1.07E+05	2.46E+04	2.60E+04	3.89E+04	4.62E+04	2.55E+04	9.54E+04	3.55E+04	1.68E+03	2.26E+04	4.04E+04	2.25E+03
Tetradecenoylcarnitine	3.93E+04	2.52E+04	4.85E+04	1.57E+05	1.30E+04	1.40E+04	4.42E+03	1.03E+04	6.68E+03	9.41E+04	2.39E+04	7.51E+03	2.73E+04	4.19E+03	8.01E+03	7.19E+04	4.68E+04	1.18E+04	3.59E+04	7.64E+04	6.43E+03	5.85E+04	1.47E+05	8.31E+04	3.08E+05	4.42E+04	6.27E+04	7.06E+03	5.13E+04	2.97E+04	9.14E+03	9.21E+04	1.58E+04	1.80E+04	1.92E+04	8.39E+03	8.67E+04	2.24E+04	1.42E+04	5.78E+04	1.41E+04	2.15E+04	2.82E+04	4.11E+04	4.08E+04	1.18E+04	9.14E+04	1.79E+04	1.14E+04	1.43E+04	4.99E+04	1.07E+04	1.23E+04	1.09E+05	3.38E+04	2.85E+04	5.41E+04	6.39E+04	4.43E+04	2.99E+05	5.05E+04	8.90E+03	4.23E+04	1.08E+05	1.20E+04
Tetradecanoylcarnitine	1.41E+04	7.60E+03	8.65E+03	2.29E+04	3.19E+03	3.00E+03	1.69E+03	3.46E+03	5.13E+03	2.75E+04	5.49E+03	1.82E+03	5.30E+03	3.68E+03	2.27E+03	2.01E+04	1.68E+04	2.60E+03	6.74E+03	1.22E+04	1.93E+03	1.56E+04	1.88E+04	4.04E+04	5.61E+04	1.77E+04	1.23E+04	3.45E+03	1.64E+04	5.64E+03	3.65E+03	9.41E+03	4.64E+03	5.72E+03	5.29E+03	2.96E+03	3.48E+04	4.40E+03	3.89E+03	1.42E+04	6.61E+03	6.02E+03	1.11E+04	2.67E+04	1.93E+04	3.93E+03	2.06E+04	3.66E+03	1.82E+03	5.23E+03	1.49E+04	2.20E+03	5.06E+03	2.74E+04	1.46E+04	4.43E+04	2.62E+04	2.35E+04	1.96E+04	5.63E+04	1.58E+04	3.88E+03	2.19E+04	2.62E+04	1.92E+03
Hydroxytetradecenoylcarnitine	2.80E+03	1.69E+03	2.71E+03	6.03E+03	4.48E+02	1.14E+03	2.87E+02	7.28E+02	3.28E+02	4.25E+03	1.29E+03	1.14E+03	1.98E+03	3.27E+02	8.46E+03	2.92E+03	2.60E+04	6.07E+02	3.48E+03	2.05E+03	3.77E+02	3.06E+03	4.55E+03	8.46E+03	1.39E+04	3.08E+03	5.34E+03	8.08E+02	3.42E+03	2.77E+03	1.23E+03	2.77E+03	1.19E+03	1.57E+03	5.32E+02	4.59E+02	1.17E+04	2.73E+03	1.30E+03	1.13E+04	1.46E+03	1.44E+03	2.48E+03	4.05E+03	4.17E+03	1.01E+03	4.62E+03	9.78E+02	2.65E+03	1.60E+03	3.08E+03	0.00E+00	1.46E+03	1.49E+04	3.63E+03	2.00E+03	1.00E+04	1.24E+04	4.56E+03	3.43E+04	3.05E+03	1.05E+03	3.48E+03	9.99E+03	8.87E+02
Pentadecanoylcarnitine	7.86E+03	5.14E+02	2.15E+02	1.27E+04	0.00E+00	1.15E+03	7.10E+02	0.00E+00	0.00E+00	3.01E+03	4.02E+02	4.85E+02	4.20E+02	3.29E+02	5.98E+03	5.79E+03	7.35E+03	0.00E+00	4.00E+02	2.83E+03	0.00E+00	2.03E+03	3.20E+03	4.57E+03	5.63E+03	4.74E+03	1.05E+03	3.56E+02	2.95E+03	5.81E+02	2.11E+03	7.29E+02	7.43E+02	1.42E+03	0.00E+00	2.73E+03	3.36E+03	6.79E+02	6.81E+02	8.81E+03	3.24E+02	2.12E+03	1.35E+03	2.12E+03	6.99E+03	2.62E+02	1.92E+03	2.78E+02	0.00E+00	1.64E+03	2.39E+03	8.50E+02	3.14E+02	5.59E+03	1.12E+03	2.68E+03	4.08E+03	3.72E+03	9.70E+02	5.08E+03	2.76E+03	2.22E+02	1.70E+03	6.56E+03	2.76E+02
Hydroxytetradecanoyl carnitine	8.35E+02	2.17E+03	1.68E+03	4.85E+03	4.22E+02	1.17E+03	3.55E+02	2.97E+02	6.12E+02	6.29E+03	1.62E+03	3.19E+02	1.77E+03	5.69E+02	2.72E+02	3.47E+03	5.04E+03	2.97E+02	1.06E+03	1.87E+03	2.79E+02	2.94E+03	3.16E+03	1.85E+03	6.77E+03	4.08E+03	2.05E+03	2.83E+02	3.78E+03	1.51E+03	6.46E+02	3.31E+02	4.56E+02	5.74E+02	8.26E+02	2.39E+02	7.08E+03	1.53E+03	1.66E+03	4.38E+03	1.02E+03	4.85E+02	1.62E+03	6.76E+03	4.49E+03	8.76E+02	4.64E+03	1.22E+03	8.06E+02	1.05E+03	3.85E+03	3.72E+02	1.91E+03	1.05E+04	3.11E+03	2.95E+03	4.47E+03	6.26E+03	5.23E+03	6.09E+03	4.18E+03	4.97E+02	3.74E+03	4.64E+03	3.93E+02
Hexadecenoylcarnitine	3.04E+04	2.90E+04	3.05E+04	3.54E+04	4.42E+03	4.33E+03	1.41E+03	3.43E+03	5.08E+03	2.45E+04	5.10E+03	1.62E+03	5.08E+03	4.03E+03	2.81E+03	1.79E+04	1.24E+04	3.57E+03	8.76E+03	6.10E+03	3.38E+03	1.72E+04	1.57E+04	2.38E+04	4.18E+04	2.10E+04	1.02E+04	2.80E+03	1.25E+04	7.35E+03	4.10E+03	8.88E+03	2.68E+03	6.36E+03	4.56E+03	1.91E+03	2.54E+04	4.98E+03	2.93E+03	1.00E+04	5.15E+03	8.56E+03	7.15E+03	1.83E+04	1.67E+04	2.99E+03	1.66E+04	2.85E+03	2.67E+03	4.75E+03	1.86E+04	2.11E+03	2.67E+03	2.72E+04	1.92E+04	1.77E+04	2.29E+04	2.70E+04	1.38E+04	5.01E+04	1.22E+04	3.64E+03	1.70E+04	3.61E+04	3.21E+03
Palmitoylcarnitine	1.63E+04	6.61E+04	3.28E+04	2.50E+04	8.58E+04	1.21E+04	1.25E+04	5.78E+03	1.43E+04	2.18E+05	5.44E+05	4.15E+04	2.72E+04	6.88E+04	4.74E+04	3.00E+04	2.53E+05	1.63E+05	5.54E+04	1.59E+05	1.38E+05	7.44E+04	1.03E+06	4.19E+05	2.22E+05	1.29E+05	6.04E+05	1.38E+05	6.72E+05	3.68E+05	2.40E+04	3.83E+04	5.82E+04	4.94E+04	2.50E+04	1.11E+04	7.10E+03	1.13E+05	1.75E+04	3.03E+04	1.15E+05	3.52E+04	4.17E+04	1.62E+05	4.66E+05	3.07E+05	4.61E+04	1.34E+05	4.95E+04	4.73E+04	9.17E+04	3.48E+05	5.63E+04	7.18E+04	3.74E+05	4.35E+05	3.72E+05	6.09E+05	4.54E+05	5.32E+05	3.88E+05	3.33E+05	2.05E+05	4.39E+05	8.20E+04
Hydroxyhexadecenoylcarnitine	2.94E+02	0.00E+00	4.34E+02	1.24E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	2.05E+03	3.23E+02	0.00E+00	0.00E+00	0.00E+00	1.07E+03	1.39E+03	7.77E+02	0.00E+00	0.00E+00	9.96E+02	0.00E+00	9.27E+02	1.71E+03	1.05E+03	3.24E+03	1.41E+03	9.03E+02	2.19E+02	1.15E+03	3.70E+02	0.00E+00	2.96E+02	2.63E+02	2.51E+02	2.77E+02	0.00E+00	2.48E+03	3.01E+02	0.00E+00	7.83E+02	4.16E+02	0.00E+00	0.00E+00	2.97E+03	2.05E+03	2.39E+02	1.88E+03	0.00E+00	0.00E+00	3.41E+02	1.49E+03	0.00E+00	3.44E+02	2.95E+03	8.99E+02	1.39E+03	1.12E+03	2.02E+03	1.12E+03	6.28E+03	1.57E+03	2.43E+02	9.20E+02	1.81E+03	0.00E+00
Heptadecanoyl carnitine	4.34E+02	7.06E+02	3.80E+02	2.89E+02	3.94E+02	0.00E+00	0.00E+00	2.23E+02	0.00E+00	1.05E+03	1.60E+03	0.00E+00	0.00E+00	2.97E+02	2.89E+02	3.26E+02	8.12E+02	0.00E+00	2.99E+02	3.31E+02	0.00E+00	2.40E+02	2.32E+03	4.27E+02	2.82E+02	3.58E+02	5.86E+02	2.72E+02	8.02E+02	1.35E+03	0.00E+00	3.49E+02	0.00E+00	0.00E+00	2.29E+02	0.00E+00	2.76E+02	1.52E+03	2.50E+02	0.00E+00	6.20E+02	3.72E+02	2.66E+02	1.74E+03	2.42E+03	1.98E+03	0.00E+00	4.03E+02	0.00E+00	2.52E+02	2.63E+02	9.05E+02	0.00E+00	3.46E+02	5.06E+02	8.80E+02	4.01E+02	9.38E+02	2.39E+03	2.18E+03	4.55E+02	4.39E+03	4.20E+02	9.45E+02	0.00E+00
Hydroxyhexadecanoyl carnitine	2.79E+02	4.54E+02	0.00E+00	4.46E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	4.11E+02	2.35E+02	0.00E+00	2.75E+02	0.00E+00	0.00E+00	7.99E+02	8.00E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	2.45E+02	2.98E+02	4.61E+02	1.76E+03	1.01E+03	2.46E+02	0.00E+00	8.61E+02	2.36E+02	0.00E+00	0.00E+00	0.00E+00	2.66E+02	2.02E+02	0.00E+00	1.07E+03	0.00E+00	2.59E+02	4.00E+02	2.87E+02	0.00E+00	0.00E+00	1.24E+03	9.75E+02	0.00E+00	1.43E+03	0.00E+00	0.00E+00	0.00E+00	8.74E+02	2.01E+02	4.83E+02	2.58E+03	1.44E+03	9.57E+02	7.28E+02	1.10E+03	1.13E+03	3.48E+03	8.42E+02	2.52E+02	8.28E+02	6.12E+02	0.00E+00
Stearidonyl carnitine	0.00E+00	0.00E+00	0.00E+00	7.54E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	1.83E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	4.41E+02	1.08E+03	0.00E+00	0.00E+00	3.78E+02	0.00E+00	0.00E+00	0.00E+00	1.73E+03	5.33E+02	5.16E+02	2.76E+02	0.00E+00	8.17E+02	0.00E+00	3.00E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	5.28E+02	0.00E+00	0.00E+00	1.44E+03	0.00E+00	2.95E+02	2.87E+02	5.48E+02	1.65E+03	0.00E+00	1.04E+03	0.00E+00	0.00E+00	2.61E+02	1.42E+03	0.00E+00	0.00E+00	1.48E+03	5.18E+02	3.68E+02	1.19E+03	9.87E+02	6.15E+02	2.69E+03	0.00E+00	0.00E+00	9.66E+02	1.36E+03	0.00E+00
Gamma-linolenyl carnitine	3.46E+03	1.21E+03	1.89E+03	8.74E+03	1.38E+03	1.16E+03	0.00E+00	3.23E+02	1.07E+03	1.05E+04	2.31E+03	3.39E+02	8.98E+02	8.39E+02	3.24E+02	4.61E+03	6.32E+03	0.00E+00	1.89E+03	1.09E+03	3.59E+02	2.76E+03	5.29E+03	1.24E+04	7.24E+03	2.03E+03	2.63E+03	5.48E+02	2.40E+03	2.06E+03	1.40E+03	1.12E+03	5.87E+02	1.58E+03	2.66E+02	5.77E+02	4.08E+03	2.29E+02	6.73E+02	4.74E+03	2.18E+03	1.48E+03	2.86E+03	1.19E+04	9.10E+03	2.61E+02	3.53E+03	2.32E+02	3.06E+02	2.72E+02	4.44E+03	0.00E+00	3.18E+02	6.52E+03	2.22E+03	5.45E+03	1.29E+04	1.02E+04	2.43E+03	1.30E+04	2.54E+03	3.58E+03	5.45E+03	2.35E+04	1.22E+03
Linoelaidyl carnitine	7.12E+04	4.22E+04	8.77E+04	5.23E+05	5.33E+04	5.90E+04	1.98E+04	4.69E+04	9.78E+04	2.04E+05	2.63E+04	1.03E+04	1.74E+04	2.76E+04	1.27E+04	9.16E+04	1.26E+05	6.70E+03	4.03E+04	3.62E+04	1.51E+04	6.64E+04	1.01E+05	2.38E+05	1.66E+05	4.98E+04	4.42E+04	3.82E+04	5.17E+04	3.33E+04	2.53E+04	2.94E+04	1.73E+04	2.17E+04	1.56E+04	5.01E+04	4.92E+05	2.59E+04	8.98E+04	4.59E+05	1.21E+05	1.63E+05	1.68E+05	2.51E+05	1.29E+05	1.17E+04	7.46E+04	1.34E+04	1.23E+04	1.16E+04	8.41E+04	6.20E+03	2.35E+04	1.32E+05	6.37E+04	8.92E+04	2.47E+05	1.34E+05	7.88E+04	1.84E+05	6.95E+04	4.02E+04	8.28E+04	3.98E+05	1.75E+04
Octadecenylcarnitine	3.67E+04	7.36E+04	4.13E+04	3.63E+04	1.80E+05	2.11E+04	1.77E+04	7.47E+03	1.54E+04	6.49E+04	1.52E+05	2.10E+04	1.06E+04	1.75E+04	1.87E+04	1.39E+04	8.82E+04	8.69E+04	2.48E+04	1.09E+05	7.92E+04	4.55E+04	2.87E+05	1.74E+05	7.50E+04	7.52E+04	3.16E+05	9.21E+04	5.42E+05	8.69E+05	1.19E+05	1.72E+05	5.66E+04	1.54E+05	2.83E+04	1.97E+04	1.52E+04	2.03E+05	2.39E+04	3.97E+04	1.51E+05	3.61E+04	6.71E+04	6.41E+04	1.79E+05	1.25E+05	1.93E+04	4.91E+04	2.25E+04	1.70E+04	2.93E+04	1.66E+05	2.25E+04	3.03E+04	1.85E+05	1.80E+05	2.80E+05	2.72E+05	2.85E+05	2.83E+05	3.35E+05	8.27E+05	1.06E+05	9.30E+05	7.49E+05
Stearoylcarnitine	1.49E+04	2.31E+04	1.02E+04	3.96E+03	9.54E+03	1.91E+03	2.75E+03	1.22E+03	1.20E+03	6.55E+03	1.70E+04	1.35E+03	5.28E+02	2.63E+03	2.20E+03	1.64E+03	9.90E+03	4.95E+03	8.93E+02	4.07E+03	4.89E+03	2.24E+03	3.02E+04	8.35E+03	5.39E+03	5.05E+03	1.43E+04	6.10E+03	1.20E+04	2.08E+04	3.85E+03	5.48E+03	1.68E+03	3.47E+03	2.87E+03	1.74E+03	1.57E+03	2.60E+04	3.46E+03	5.77E+03	9.09E+03	4.95E+03	4.97E+03	1.26E+04	2.05E+04	1.15E+04	1.45E+03	4.84E+03	2.01E+03	2.33E+03	2.42E+03	1.11E+04	1.19E+03	2.98E+03	1.41E+04	1.38E+04	1.04E+04	2.01E+04	1.38E+04	2.20E+04	8.97E+03	3.27E+04	2.71E+03	1.80E+04	2.68E+04
Hydroxyoctadecenoylcarnitine	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	4.07E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	8.55E+02	8.31E+02	2.38E+02	0.00E+00	0.00E+00	0.00E+00	4.03E+02	4.08E+02	3.79E+02	2.12E+03	5.04E+02	2.98E+02	0.00E+00	4.17E+02	0.00E+00	0.00E+00	0.00E+00	2.58E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	1.85E+03	7.68E+02	0.00E+00	1.06E+03	0.00E+00	0.00E+00	0.00E+00	3.08E+02	0.00E+00	2.39E+02	2.71E+03	6.58E+02	6.51E+02	4.19E+02	1.17E+03	7.77E+02	2.94E+03	3.31E+02	0.00E+00	6.19E+02	9.67E+02	2.47E+02
Arachidyl carnitine	0.00E+00	0.00E+00	0.00E+00	5.65E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	3.08E+02	4.54E+02	7.42E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	2.49E+02	0.00E+00	2.84E+02	0.00E+00	3.47E+02	0.00E+00	0.00E+00	1.69E+03	1.05E+03	4.49E+02	8.86E+02	4.64E+02	3.43E+02	3.03E+02	1.49E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	2.69E+02	2.02E+03	0.00E+00	4.50E+02	6.54E+02	0.00E+00	6.71E+02	5.39E+02	8.95E+02	4.96E+02	5.15E+02	0.00E+00	2.57E+02	2.82E+02	0.00E+00	4.45E+02	0.00E+00	0.00E+00	3.66E+02	9.76E+02	3.12E+02	1.16E+03	0.00E+00	4.48E+02	3.31E+02	2.43E+02	3.94E+02	1.35E+03
Cervonyl carnitine	3.90E+03	1.69E+03	2.27E+03	4.07E+03	3.60E+02	6.48E+02	0.00E+00	5.76E+02	2.87E+02	3.88E+03	1.15E+03	2.96E+02	2.41E+02	2.55E+02	5.28E+02	4.99E+03	2.65E+03	1.10E+03	2.82E+02	1.75E+03	0.00E+00	6.61E+03	3.96E+03	8.79E+03	1.38E+04	1.69E+03	9.65E+02	5.13E+02	8.70E+03	8.00E+02	1.03E+03	1.11E+03	1.53E+03	9.32E+02	4.42E+02	9.47E+02	4.30E+03	1.14E+03	3.44E+02	1.12E+04	1.69E+03	3.14E+03	2.02E+03	7.42E+03	6.56E+03	6.57E+02	5.30E+03	1.28E+03	7.24E+02	1.60E+03	5.96E+03	2.67E+02	9.92E+02	5.58E+03	4.61E+03	2.41E+03	9.26E+03	5.54E+03	2.29E+03	2.33E+04	4.15E+03	5.03E+02	7.06E+03	1.12E+04	3.31E+02
Tetracosatetraenoyl carnitine	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	1.70E+03	4.62E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	3.58E+03	1.72E+03	0.00E+00	0.00E+00	3.05E+03	7.71E+02	0.00E+00	2.55E+02	0.00E+00	0.00E+00	0.00E+00	3.18E+02	0.00E+00	2.56E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	5.46E+02	1.39E+03	0.00E+00	2.62E+02	0.00E+00	0.00E+00	0.00E+00	2.96E+02	0.00E+00	0.00E+00	6.46E+02	0.00E+00	3.69E+03	3.11E+02	3.46E+03	0.00E+00	0.00E+00	2.75E+03	0.00E+00	0.00E+00	0.00E+00
Arachidonyl carnitine	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	5.44E+02	3.50E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	6.56E+02	0.00E+00	0.00E+00	0.00E+00	1.08E+03	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	3.46E+02	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	0.00E+00	1.45E+03	0.00E+00	1.65E+03	0.00E+00	0.00E+00	3.03E+02	0.00E+00	0.00E+00	0.00E+00
Hexadecadienoylcarnitine	6.15E+03	2.41E+03	5.21E+03	1.42E+04	3.85E+02	1.43E+03	2.74E+02	1.94E+03	7.35E+02	7.49E+03	1.71E+03	7.78E+02	2.77E+03	2.55E+02	3.13E+02	6.54E+03	9.09E+03	1.07E+03	3.84E+03	4.73E+03	3.70E+02	4.58E+03	1.10E+04	1.28E+04	2.70E+04	2.82E+03	1.01E+04	2.19E+03	4.15E+03	4.37E+03	1.09E+03	1.32E+04	1.82E+03	2.59E+03	1.28E+03	1.12E+03	6.66E+03	1.18E+03	1.69E+03	4.11E+03	3.27E+03	2.50E+03	4.31E+03	1.50E+04	6.25E+03	5.28E+02	8.49E+03	3.45E+02	3.36E+02	1.06E+03	6.96E+03	2.92E+02	1.58E+03	1.18E+04	2.86E+03	5.32E+03	1.10E+04	1.03E+04	5.26E+03	4.50E+04	7.21E+03	1.23E+03	5.40E+03	1.38E+04	2.50E+03
Sphingosine	8.25E+03	4.93E+03	3.22E+03	9.41E+03	2.23E+03	2.53E+03	1.91E+03	2.58E+03	2.93E+03	3.24E+04	5.02E+03	2.33E+03	4.71E+03	3.16E+03	3.87E+03	1.86E+04	1.48E+04	1.45E+03	5.41E+03	7.68E+03	3.84E+03	1.48E+04	1.24E+04	1.76E+04	1.83E+04	2.10E+04	6.11E+03	3.67E+03	1.63E+04	5.29E+03	4.51E+03	2.32E+03	3.14E+03	3.30E+03	2.14E+03	1.77E+03	2.14E+04	3.35E+03	4.68E+03	1.93E+04	3.66E+03	5.42E+03	7.43E+03	2.81E+04	2.28E+04	4.52E+03	4.85E+04	3.59E+03	4.37E+03	5.28E+03	2.34E+04	4.07E+03	4.20E+03	3.53E+04	1.06E+04	2.13E+04	1.89E+04	1.73E+04	1.64E+04	2.47E+04	2.31E+04	3.73E+03	1.40E+04	2.90E+04	2.56E+03
Biliverdin	1.13E+04	7.14E+03	5.94E+03	2.13E+04	5.18E+03	3.20E+03	3.42E+03	3.39E+03	0.00E+00	1.03E+04	5.26E+03	1.75E+03	7.78E+03	9.82E+03	1.45E+03	5.29E+03	1.65E+04	9.50E+02	1.02E+04	1.01E+04	1.09E+04	1.53E+04	3.83E+04	5.76E+03	1.35E+04	1.76E+04	1.10E+04	7.79E+03	1.62E+04	9.52E+03	5.77E+03	3.70E+03	3.11E+03	1.37E+04	2.15E+03	1.01E+03	2.19E+04	5.34E+03	1.05E+04	7.13E+03	6.56E+03	7.06E+03	9.23E+03	4.92E+04	1.64E+03	5.26E+03	1.06E+04	4.98E+03	7.23E+02	2.34E+03	2.32E+04	1.78E+03	2.57E+03	7.17E+03	1.94E+04	1.31E+04	4.95E+04	4.26E+04	2.34E+04	1.81E+04	2.41E+04	4.03E+03	4.55E+04	3.99E+04	7.81E+03
Bilirubin	2.39E+05	1.13E+05	1.22E+05	5.00E+05	9.79E+04	9.52E+04	3.44E+04	5.15E+04	3.27E+04	2.16E+05	5.96E+04	2.78E+04	7.19E+04	1.47E+05	6.29E+03	9.32E+04	3.44E+05	2.10E+04	2.12E+05	1.64E+05	9.86E+04	2.52E+05	5.46E+05	1.27E+05	2.71E+05	3.41E+05	2.00E+05	1.43E+05	2.90E+05	8.46E+04	9.70E+04	2.35E+04	4.67E+04	1.21E+05	3.61E+04	4.49E+04	5.86E+05	3.77E+04	8.46E+04	1.07E+05	3.83E+03	2.58E+04	4.71E+04	6.22E+05	2.59E+04	5.34E+04	1.30E+05	3.50E+04	1.20E+04	6.34E+04	4.01E+05	4.24E+04	2.56E+04	1.34E+05	2.51E+05	2.21E+05	7.45E+05	2.44E+05	1.81E+05	2.46E+05	4.39E+05	8.38E+04	1.94E+05	6.21E+05	1.33E+05
trimethylamineoxide	5.24E+06	4.12E+06	3.37E+06	1.95E+07	1.60E+06	5.09E+06	1.68E+06	8.83E+05	1.06E+06	4.23E+06	5.94E+05	1.96E+06	1.08E+06	9.24E+05	1.29E+06	2.58E+07	5.99E+06	6.16E+05	1.86E+06	2.65E+06	1.24E+06	1.12E+07	1.42E+07	2.64E+06	8.28E+06	2.09E+07	7.09E+06	9.13E+06	1.86E+07	9.16E+05	4.41E+06	1.16E+06	1.53E+06	1.73E+06	1.63E+06	1.01E+07	1.01E+07	6.41E+06	1.99E+06	4.14E+07	1.79E+06	4.69E+06	3.00E+06	1.47E+07	1.29E+08	1.32E+06	6.53E+06	9.43E+05	8.14E+06	3.54E+07	2.62E+06	7.15E+05	2.02E+06	7.58E+07	8.91E+06	4.94E+06	8.55E+06	6.23E+06	4.46E+06	2.24E+07	1.10E+07	4.40E+06	3.78E+06	1.87E+07	1.46E+06
4-Imidazolone-5-propanoate	1.88E+05	7.23E+04	2.32E+05	1.59E+05	6.64E+04	1.39E+05	1.00E+05	8.74E+04	5.61E+04	1.33E+05	1.55E+05	1.58E+05	7.30E+04	7.22E+04	8.63E+04	1.44E+05	6.67E+04	6.73E+04	1.47E+05	1.46E+05	9.20E+04	8.08E+04	1.08E+05	7.11E+04	5.33E+04	1.64E+05	1.17E+05	1.96E+05	9.46E+04	9.29E+04	7.06E+04	1.25E+05	9.87E+04	2.11E+05	7.88E+04	1.81E+05	1.88E+05	6.91E+04	1.13E+05	7.68E+04	1.75E+05	1.69E+05	1.30E+05	7.97E+04	2.44E+05	8.47E+04	1.46E+05	8.57E+04	2.06E+05	1.52E+05	8.05E+04	1.03E+05	1.04E+05	1.17E+05	1.62E+05	1.13E+05	9.40E+04	2.77E+05	1.23E+05	2.11E+05	1.10E+05	8.90E+04	1.41E+05	6.41E+04	7.76E+04
phenyllactate (PLA)	6.21E+04	0.00E+00	0.00E+00	1.39E+05	0.00E+00	0.00E+00	0.00E+00	0.00E+00	3.19E+04	2.61E+05	0.00E+00	4.78E+04	0.00E+00	0.00E+00	0.00E+00	2.02E+05	1.64E+05	0.00E+00	0.00E+00	9.73E+04	0.00E+00	1.28E+05	1.52E+05	1.92E+05	1.74E+05	1.40E+05	6.45E+04	0.00E+00	1.56E+05	0.00E+00	2.89E+04	0.00E+00	2.33E+04	0.00E+00	0.00E+00	9.38E+04	2.43E+05	6.36E+04	5.39E+04	2.39E+05	0.00E+00	1.59E+05	4.60E+04	2.76E+05	1.65E+06	5.80E+04	2.10E+05	9.62E+04	1.22E+05	1.64E+05	3.95E+05	0.00E+00	5.77E+04	7.65E+05	4.24E+05	3.76E+05	3.05E+05	3.71E+05	0.00E+00	6.83E+05	2.47E+05	0.00E+00	2.45E+05	2.04E+05	0.00E+00
Theobromine	2.25E+06	6.45E+04	6.48E+06	8.98E+05	2.17E+06	1.09E+04	1.74E+06	7.62E+05	8.99E+06	2.10E+07	5.97E+04	4.36E+06	2.64E+05	1.30E+06	5.59E+04	1.59E+06	4.02E+06	9.32E+04	4.02E+06	5.60E+06	2.37E+04	3.14E+06	4.16E+05	1.06E+06	3.28E+04	2.49E+06	9.65E+06	2.34E+06	2.23E+06	1.80E+06	5.11E+05	2.15E+05	1.78E+05	5.37E+06	2.82E+06	9.85E+05	5.08E+06	3.50E+06	2.25E+06	9.13E+05	5.73E+06	9.29E+06	2.11E+07	6.92E+06	1.40E+06	1.22E+06	4.94E+06	1.11E+06	2.16E+06	7.76E+06	9.35E+04	5.61E+06	6.03E+06	4.66E+06	1.47E+06	1.01E+07	8.82E+05	3.19E+06	1.32E+07	7.04E+06	5.17E+06	3.45E+06	2.87E+06	7.95E+05	2.65E+05
1-Methylxanthine	1.70E+04	3.09E+03	8.81E+04	1.39E+04	7.57E+04	3.18E+03	5.93E+04	2.55E+04	1.49E+05	1.26E+05	5.34E+03	1.03E+05	1.26E+04	5.94E+04	7.35E+03	7.81E+03	1.36E+04	3.24E+03	1.87E+05	5.79E+04	4.76E+03	3.79E+04	7.83E+03	2.25E+04	3.07E+03	2.04E+04	5.29E+05	1.14E+05	0.00E+00	6.11E+04	1.43E+04	3.50E+04	8.57E+03	6.95E+04	5.18E+04	6.87E+04	7.11E+04	1.39E+05	7.09E+04	8.24E+03	1.88E+05	4.50E+05	2.71E+05	3.33E+04	3.19E+04	5.01E+04	2.67E+04	4.38E+04	1.02E+05	3.31E+05	2.95E+03	7.98E+04	1.75E+05	3.37E+04	3.69E+04	9.22E+03	1.12E+04	3.17E+04	9.60E+04	1.37E+04	2.51E+04	1.27E+05	4.18E+04	2.07E+04	2.00E+04
Caffeine	1.20E+06	8.19E+04	4.55E+06	4.32E+05	2.03E+06	3.22E+04	2.10E+06	8.13E+05	8.10E+06	1.61E+07	5.78E+04	2.92E+06	1.61E+05	8.60E+05	5.85E+04	2.13E+06	1.77E+07	8.75E+04	5.20E+06	9.26E+06	5.10E+04	1.33E+06	3.42E+05	3.65E+05	1.57E+05	1.61E+06	7.68E+06	1.17E+06	1.43E+06	2.18E+06	2.98E+05	1.61E+05	1.40E+05	1.63E+07	1.86E+06	3.57E+05	3.90E+06	1.51E+06	2.46E+06	6.99E+05	6.83E+06	4.82E+06	2.18E+07	6.65E+06	8.78E+05	5.07E+05	2.92E+06	8.62E+05	1.57E+06	4.50E+06	1.19E+05	4.85E+06	4.27E+06	2.74E+06	3.04E+06	3.97E+07	3.56E+05	2.53E+06	2.60E+07	1.02E+07	3.45E+06	2.02E+06	5.60E+06	3.90E+05	9.60E+04
Riboflavin	1.25E+04	5.70E+04	8.82E+04	0.00E+00	1.91E+04	2.76E+04	3.77E+04	2.64E+04	1.82E+04	5.75E+04	1.23E+04	2.41E+04	6.22E+04	2.43E+04	8.87E+03	0.00E+00	0.00E+00	7.30E+04	2.44E+04	9.73E+04	3.00E+04	0.00E+00	2.95E+04	0.00E+00	0.00E+00	1.45E+05	3.64E+04	4.30E+04	1.20E+05	1.39E+04	4.04E+04	1.21E+04	1.57E+05	3.09E+04	3.32E+04	1.48E+04	6.30E+05	6.93E+04	7.25E+04	2.91E+04	1.99E+04	4.52E+04	8.10E+04	3.76E+04	2.00E+05	7.74E+04	2.70E+04	2.34E+04	0.00E+00	3.80E+04	0.00E+00	0.00E+00	0.00E+00	5.83E+04	0.00E+00	4.52E+04	0.00E+00	2.75E+05	3.44E+05	2.01E+04	1.37E+05	0.00E+00	2.47E+05	9.49E+04	2.75E+04
N-Acetyl-L-glutamate	1.31E+05	8.78E+04	1.24E+05	2.26E+05	4.79E+04	4.25E+04	5.81E+04	5.40E+04	4.30E+04	2.42E+05	5.92E+04	3.85E+04	5.54E+04	5.75E+04	6.83E+04	3.06E+05	1.27E+05	8.25E+04	1.56E+05	9.28E+04	1.03E+05	1.51E+05	2.88E+05	1.77E+05	2.87E+05	2.30E+05	8.04E+04	5.87E+04	1.66E+05	5.35E+04	8.33E+04	2.63E+05	1.48E+05	8.45E+04	1.04E+05	9.29E+04	1.41E+05	1.05E+05	1.19E+05	1.51E+05	5.85E+04	4.68E+04	7.98E+04	1.23E+05	1.70E+05	6.09E+04	9.64E+04	8.80E+04	1.01E+05	7.30E+04	1.33E+05	8.14E+04	1.01E+05	1.80E+05	2.70E+05	1.76E+05	2.32E+05	2.11E+05	1.90E+05	1.10E+05	2.57E+05	3.16E+04	1.03E+05	2.71E+05	7.18E+04
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	KEGG_HMDB	M.z	Rt
L-alanine	C00041	90.05494	0.6894616
L-arginine	C00062	175.1191	0.6580484
L-asparagine	C00152	133.0607	0.7001029
L-aspartate	C00049	134.0449	0.720399
L-cysteine	C00097	122.0272	0.700775
L-glutamate	C00025	148.0605	0.6970667
L-glutamine	C00064	147.0763	0.6961851
glycine	C00037	76.03933	0.696449
L-histidine	C00135	156.0768	0.6356379
L-leucine	C00123	132.1018	0.8234196
L-lysine	C00047	147.1131	0.6248515
L-methionine	C00073	150.0585	0.7169002
L-phenylalanine	C00079	166.0862	1.199372
L-proline	C00148	116.0705	0.6992943
L-serine	C00065	106.0498	0.6937205
L-threonine	C00188	120.0655	0.6944706
L-tryptophan	C00078	205.0974	1.719916
L-tyrosine	C00082	182.0814	0.7346248
L-valine	C00183	118.0861	0.7127898
L-cystine	C00491	241.0303	0.7055169
Adenosine	C00212	268.1035	0.9056617
Adenine	C00147	136.0618	0.7338234
Hypoxanthine	C00262	137.0458	0.7833512
Xanthine	C00385	153.0405	0.6190669
Allantoate	C00499	177.0609	0.6403657
5-Hydroxyisourate	C11821	185.0312	0.6856924
Nicotimide	C00153	123.0554	0.8470407
Phosphate	C00009	98.98428	0.779631
5-Oxoproline	C01879	130.0499	0.6969548
L-Homocysteine	C00155	136.0429	0.7192472
Dimethylglycine	C01026	104.0705	0.6982512
Ornithine	C01602	133.0971	0.6242961
L-Citrulline	C00327	176.1031	0.6906725
Spermidine	C00315	146.1652	0.6258916
Spermine	C00750	203.2229	0.6201852
D-Glucosamine	C00329	180.0867	0.7573672
Asymmetric dimethyl arginine	C03626	203.1503	0.6829484
Carnosine	C00386	227.1147	0.6579108
5-Guanidino-2-oxopentanoate	C03771	174.0873	0.7417704
Phosphocreatine	C02305	212.0429	0.7662995
Creatine	C00300	132.0769	0.6926473
Creatinine	C00791	114.0663	0.6903187
4-Acetamidobutanoate	C02946	146.0813	0.7017526
N-Acetyl-L-ornithine	C00437	175.1077	0.7053686
trans-4-Hydroxy-L-proline	C01157	132.0656	0.6941764
L-1-Pyrroline-3-hydroxy-5-carboxylate	C04281	130.0499	0.9006798
Taurine	C00245	126.0222	0.7199693
Hypotaurine	C00519	110.027	0.7045771
3-Sulfino-L-alanine	C00606	154.0175	0.7070231
L-Cysteate	C00506	170.0123	0.6037756
L-Methionine S-oxide	C02989	166.0533	0.8591872
5-Hydroxyindoleacetate	C05635	192.0656	1.261607
3-Methyldioxyindole	C05834	164.0704	1.762277
Indole	C00463	118.0652	1.723582
Indole-3-acetate	C00954	176.0704	1.868166
Indoxyl	C05658	134.0602	1.823513
L-Tryptophamide	C00977	204.114	1.739771
Kynurenine	C00328	209.0918	1.247485
Kynurenic acid	C01717	190.0501	1.780446
Anthranilate	C00108	138.0549	0.7075785
g-Oxalo-crotote	C03453	159.0279	0.7252541
2-Aminomucote	C00322	161.0438	0.7095807
8-Methoxykynurete	C05830	220.0605	1.810785
Serotonin	C00780	177.1021	0.9905966
Diethanolamine	C06772	106.0862	0.689442
Triethanolamine	C06771	150.1126	0.6798533
Phosphodimethyl-ethanolamine	C13482	170.0577	0.6978632
Acetylcarnitine	HMDB0000201	204.123	0.7091627
Propionylcarnitine	HMDB0000824	218.1387	0.8079266
Butyrylcarnitine	HMDB0002013	232.1542	1.558154
Tiglylcarnitine	HMDB02366	244.1543	1.752271
Valerylcarnitine	HMDB0013128	246.1699	1.745132
Hexenoylcarnitine	HMDB0013161	258.1699	1.77574
Hexanoylcarnitine	HMDB0000705	260.1854	1.781802
Methylmalonylcarnitine	HMDB0013133	262.1283	0.7564021
Octenoylcarnitine	HMDB0013324	286.2011	1.818865
Octanoylcarnitine	HMDB0000791	288.2166	1.86391
Dimethylheptanoyl carnitine	HMDB0006320	302.2325	1.889744
Pimelylcarnitine	HMDB0013328	304.1746	1.74492
Hydroxyoctanoyl carnitine	HMDB0061634	304.2118	1.777047
Decanoylcarnitine	HMDB0000651	316.2485	1.986911
Dimethylnonoyl carnitine	HMDB0006202	330.2642	2.016355
Hydroxydecanoyl carnitine	HMDB0061636	332.2428	1.852122
Dodecenoylcarnitine	HMDB0013326	342.2643	2.156984
Dodecanoylcarnitine	HMDB0002250	344.28	2.544364
Hydroxyundecanoyl carnitine	HMDB0061637	346.2582	1.867206
Hydroxydodecanoyl carnitine	HMDB0061638	360.2739	1.965731
Tetradecenoylcarnitine	HMDB0062588	370.2957	2.781676
Tetradecanoylcarnitine	HMDB0005066	372.3113	3.246308
Hydroxytetradecenoylcarnitine	HMDB0013330	386.2898	2.087305
Pentadecanoylcarnitine	HMDB0062517	386.3267	3.478756
Hydroxytetradecanoyl carnitine	HMDB0061640	388.3056	2.516538
Hexadecenoylcarnitine	HMDB0013207	398.3271	3.44066
Palmitoylcarnitine	HMDB0000222	400.3421	2.203361
Hydroxyhexadecenoylcarnitine	HMDB0013333	414.3214	2.721848
Heptadecanoyl carnitine	HMDB0006210	414.3578	2.470115
Hydroxyhexadecanoyl carnitine	HMDB0061642	416.3371	3.22541
Stearidonyl carnitine	HMDB0006463	420.3109	2.757905
Gamma-linolenyl carnitine	HMDB0006318	422.3271	3.072593
Linoelaidyl carnitine	HMDB0006461	424.3426	3.586252
Octadecenylcarnitine	HMDB0013338	426.3582	2.061977
Stearoylcarnitine	HMDB0000848	428.374	3.102711
Hydroxyoctadecenoylcarnitine	HMDB0013339	442.3532	3.381475
Arachidyl carnitine	HMDB0006460	456.4047	2.846769
Cervonyl carnitine	HMDB0006510	472.3426	3.247421
Tetracosatetraenoyl carnitine	HMDB0060158	504.4044	2.440003
Arachidonyl carnitine	HMDB0006455	505.4085	2.4385
Hexadecadienoylcarnitine	HMDB0013334	396.3114	2.908078
Sphingosine	C00319	300.2894	2.66913
Biliverdin	C00500	583.2548	1.996499
Bilirubin	C00486	585.2704	1.929518
trimethylamineoxide	C01104	76.07578	0.6910763
4-Imidazolone-5-propanoate	C03680	157.0607	0.6987821
phenyllactate (PLA)	C05607	167.0703	1.906482
Theobromine	C07480	181.0722	1.720218
1-Methylxanthine	C16358	167.0563	1.120161
Caffeine	C07481	195.0879	1.762733
Riboflavin	C00255	377.1426	1.740249
N-Acetyl-L-glutamate	C00624	190.0716	1.854342
METABOLITES_END
#END