#METABOLOMICS WORKBENCH kenanazam_20181205_120107 DATATRACK_ID:1583 STUDY_ID:ST001108 ANALYSIS_ID:AN001802 PROJECT_ID:PR000740
VERSION             	1
CREATED_ON             	December 5, 2018, 12:18 pm
#PROJECT
PR:PROJECT_TITLE                 	Chronic Maternal Cortisol Excess During Late Gestation Leads to Metabolic
PR:PROJECT_TITLE                 	Alterations in the Newborn Heart
PR:PROJECT_SUMMARY               	Our laboratory has previously shown in an ovine model of pregnancy that abnormal
PR:PROJECT_SUMMARY               	elevations in maternal cortisol during late gestation lead to increased fetal
PR:PROJECT_SUMMARY               	cardiac arrhythmias and mortality during peripartum. Furthermore, transcriptomic
PR:PROJECT_SUMMARY               	analysis of the fetal heart suggested alterations in TCA cycle intermediates and
PR:PROJECT_SUMMARY               	lipid metabolites in animals exposed to excess cortisol in utero. Therefore, we
PR:PROJECT_SUMMARY               	utilized a sheep model of pregnancy to determine how chronic increases in
PR:PROJECT_SUMMARY               	maternal cortisol alter maternal and fetal serum prior to birth and neonatal
PR:PROJECT_SUMMARY               	cardiac metabolites and lipids at term. Ewes were either infused with 1
PR:PROJECT_SUMMARY               	mg/kg/day of cortisol starting at gestational day 115 (n=9), or untreated (n=6).
PR:PROJECT_SUMMARY               	Serum was collected from the mother and fetus (125 d-birth), and hearts were
PR:PROJECT_SUMMARY               	collected following birth. Proton nuclear magnetic resonance (1H-NMR)
PR:PROJECT_SUMMARY               	spectroscopy was conducted to measure metabolic profiles of newborn heart
PR:PROJECT_SUMMARY               	specimens as well as fetal and maternal serum specimens. Mass spectrometry was
PR:PROJECT_SUMMARY               	conducted to measure lipid profiles of newborn heart specimens. We observed
PR:PROJECT_SUMMARY               	alterations in amino acid and TCA cycle metabolism as well as lipid and
PR:PROJECT_SUMMARY               	glycerophospholipid metabolism in newborn hearts after excess maternal cortisol
PR:PROJECT_SUMMARY               	in late gestation. In addition, we observed alterations in amino acid and TCA
PR:PROJECT_SUMMARY               	cycle metabolites in fetal but not in maternal serum during late gestation.
PR:PROJECT_SUMMARY               	These results suggest that fetal exposure to excess maternal cortisol alters
PR:PROJECT_SUMMARY               	placental and fetal metabolism prior to birth and limits normal cardiac
PR:PROJECT_SUMMARY               	metabolic maturation, which may contribute to increased risk of peripartum
PR:PROJECT_SUMMARY               	cardiac arrhythmias observed in these animals, or later life cardiomyopathies.
PR:INSTITUTE                     	University of Florida
PR:LAST_NAME                     	Keller-Wood
PR:FIRST_NAME                    	Maureen
PR:ADDRESS                       	1345 SW Archer Rd, PO 100487, Gainesville, FL, 32610
PR:EMAIL                         	kellerwd@cop.ufl.edu
PR:PHONE                         	na
#STUDY
ST:STUDY_TITLE                   	NMR Metabolomics of Newborn Heart Tissue Exposed to Excess Maternal Cortisol in
ST:STUDY_TITLE                   	Late Gestation - Fetal (part -III)
ST:STUDY_TYPE                    	Comparison
ST:STUDY_SUMMARY                 	Serum from mothers and fetuses exposed to excess maternal cortisol in late
ST:STUDY_SUMMARY                 	gestation and untreated was compared via NMR metabolomic analysis
ST:INSTITUTE                     	University of Florida
ST:DEPARTMENT                    	Biochemsitry & Molecular Biology
ST:LAST_NAME                     	Walejko
ST:FIRST_NAME                    	Jacquelyn
ST:ADDRESS                       	R3-226 Academic Research Building, Department of Biochemistry and Molecular
ST:ADDRESS                       	Biology, PO Box 100245, Gainesville, FL 32610-0245
ST:EMAIL                         	jwalejko@uga.edu
ST:PHONE                         	NA
ST:NUM_GROUPS                    	2
ST:TOTAL_SUBJECTS                	36
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Ovis aries
SU:TAXONOMY_ID                   	9940
SU:AGE_OR_AGE_RANGE              	Gestational days 125-birth
#SUBJECT_SAMPLE_FACTORS:         	SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data
SUBJECT_SAMPLE_FACTORS           	729	F_729_130	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=130; Batch=1; NMR_ID=4
SUBJECT_SAMPLE_FACTORS           	770	F_770_135	Treatment:Control | Source:Fetal	Gestational Age (days)=135; Batch=1; NMR_ID=6
SUBJECT_SAMPLE_FACTORS           	759	F_759_125	Treatment:Control | Source:Fetal	Gestational Age (days)=125; Batch=1; NMR_ID=7
SUBJECT_SAMPLE_FACTORS           	759	F_759_146	Treatment:Control | Source:Fetal	Gestational Age (days)=146; Batch=1; NMR_ID=8
SUBJECT_SAMPLE_FACTORS           	728	M_728_140	Treatment:Control | Source:Maternal	Gestational Age (days)=140; Batch=1; NMR_ID=10
SUBJECT_SAMPLE_FACTORS           	729	F_729_125	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=125; Batch=1; NMR_ID=11
SUBJECT_SAMPLE_FACTORS           	770	M_770_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=1; NMR_ID=12
SUBJECT_SAMPLE_FACTORS           	734	M_734_140	Treatment:Control | Source:Maternal	Gestational Age (days)=140; Batch=1; NMR_ID=13
SUBJECT_SAMPLE_FACTORS           	759	M_759_135	Treatment:Control | Source:Maternal	Gestational Age (days)=135; Batch=1; NMR_ID=14
SUBJECT_SAMPLE_FACTORS           	770	M_770_140	Treatment:Control | Source:Maternal	Gestational Age (days)=140; Batch=1; NMR_ID=15
SUBJECT_SAMPLE_FACTORS           	734	M_734_125	Treatment:Control | Source:Maternal	Gestational Age (days)=125; Batch=1; NMR_ID=16
SUBJECT_SAMPLE_FACTORS           	728	F_728_146	Treatment:Control | Source:Fetal	Gestational Age (days)=146; Batch=1; NMR_ID=18
SUBJECT_SAMPLE_FACTORS           	759	M_759_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=1; NMR_ID=19
SUBJECT_SAMPLE_FACTORS           	759	M_759_138	Treatment:Control | Source:Maternal	Gestational Age (days)=138; Batch=1; NMR_ID=20
SUBJECT_SAMPLE_FACTORS           	706	M_706_140	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=140; Batch=1; NMR_ID=21
SUBJECT_SAMPLE_FACTORS           	729	F_729_135	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=135; Batch=1; NMR_ID=22
SUBJECT_SAMPLE_FACTORS           	728	M_728_147	Treatment:Control | Source:Maternal	Gestational Age (days)=147; Batch=1; NMR_ID=23
SUBJECT_SAMPLE_FACTORS           	770	M_770_138	Treatment:Control | Source:Maternal	Gestational Age (days)=138; Batch=1; NMR_ID=24
SUBJECT_SAMPLE_FACTORS           	759	F_759_140	Treatment:Control | Source:Fetal	Gestational Age (days)=140; Batch=1; NMR_ID=25
SUBJECT_SAMPLE_FACTORS           	759	M_759_147	Treatment:Control | Source:Maternal	Gestational Age (days)=147; Batch=1; NMR_ID=27
SUBJECT_SAMPLE_FACTORS           	734	M_734_135	Treatment:Control | Source:Maternal	Gestational Age (days)=135; Batch=1; NMR_ID=28
SUBJECT_SAMPLE_FACTORS           	734	F_734_135	Treatment:Control | Source:Fetal	Gestational Age (days)=135; Batch=1; NMR_ID=29
SUBJECT_SAMPLE_FACTORS           	706	F_706_142	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=142; Batch=1; NMR_ID=34
SUBJECT_SAMPLE_FACTORS           	770	F_770_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=1; NMR_ID=35
SUBJECT_SAMPLE_FACTORS           	734	M_734_144	Treatment:Control | Source:Maternal	Gestational Age (days)=144; Batch=1; NMR_ID=37
SUBJECT_SAMPLE_FACTORS           	706	F_706_140	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=140; Batch=1; NMR_ID=38
SUBJECT_SAMPLE_FACTORS           	728	F_728_135	Treatment:Control | Source:Fetal	Gestational Age (days)=135; Batch=1; NMR_ID=40
SUBJECT_SAMPLE_FACTORS           	759	F_759_135	Treatment:Control | Source:Fetal	Gestational Age (days)=135; Batch=1; NMR_ID=41
SUBJECT_SAMPLE_FACTORS           	728	F_728_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=1; NMR_ID=42
SUBJECT_SAMPLE_FACTORS           	729	M_729_130	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=130; Batch=1; NMR_ID=43
SUBJECT_SAMPLE_FACTORS           	728	M_728_135	Treatment:Control | Source:Maternal	Gestational Age (days)=135; Batch=1; NMR_ID=45
SUBJECT_SAMPLE_FACTORS           	759	M_759_145	Treatment:Control | Source:Maternal	Gestational Age (days)=145; Batch=1; NMR_ID=46
SUBJECT_SAMPLE_FACTORS           	728	M_728_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=1; NMR_ID=47
SUBJECT_SAMPLE_FACTORS           	770	F_770_140	Treatment:Control | Source:Fetal	Gestational Age (days)=140; Batch=1; NMR_ID=48
SUBJECT_SAMPLE_FACTORS           	728	F_728_138	Treatment:Control | Source:Fetal	Gestational Age (days)=138; Batch=1; NMR_ID=50
SUBJECT_SAMPLE_FACTORS           	728	F_728_147	Treatment:Control | Source:Fetal	Gestational Age (days)=147; Batch=1; NMR_ID=51
SUBJECT_SAMPLE_FACTORS           	770	F_770_125	Treatment:Control | Source:Fetal	Gestational Age (days)=125; Batch=1; NMR_ID=55
SUBJECT_SAMPLE_FACTORS           	706	M_706_142	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=142; Batch=1; NMR_ID=56
SUBJECT_SAMPLE_FACTORS           	770	F_770_138	Treatment:Control | Source:Fetal	Gestational Age (days)=138; Batch=1; NMR_ID=58
SUBJECT_SAMPLE_FACTORS           	706	M_706_130	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=130; Batch=1; NMR_ID=59
SUBJECT_SAMPLE_FACTORS           	734	F_734_125	Treatment:Control | Source:Fetal	Gestational Age (days)=125; Batch=1; NMR_ID=60
SUBJECT_SAMPLE_FACTORS           	734	F_734_140	Treatment:Control | Source:Fetal	Gestational Age (days)=140; Batch=1; NMR_ID=62
SUBJECT_SAMPLE_FACTORS           	706	F_706_138	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=138; Batch=1; NMR_ID=63
SUBJECT_SAMPLE_FACTORS           	734	M_734_142	Treatment:Control | Source:Maternal	Gestational Age (days)=142; Batch=1; NMR_ID=64
SUBJECT_SAMPLE_FACTORS           	759	F_759_145	Treatment:Control | Source:Fetal	Gestational Age (days)=145; Batch=1; NMR_ID=65
SUBJECT_SAMPLE_FACTORS           	759	F_759_142	Treatment:Control | Source:Fetal	Gestational Age (days)=142; Batch=1; NMR_ID=66
SUBJECT_SAMPLE_FACTORS           	759	F_759_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=1; NMR_ID=67
SUBJECT_SAMPLE_FACTORS           	734	F_734_138	Treatment:Control | Source:Fetal	Gestational Age (days)=138; Batch=1; NMR_ID=68
SUBJECT_SAMPLE_FACTORS           	706	M_706_135	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=135; Batch=1; NMR_ID=69
SUBJECT_SAMPLE_FACTORS           	734	M_734_143	Treatment:Control | Source:Maternal	Gestational Age (days)=143; Batch=1; NMR_ID=71
SUBJECT_SAMPLE_FACTORS           	728	M_728_142	Treatment:Control | Source:Maternal	Gestational Age (days)=142; Batch=1; NMR_ID=72
SUBJECT_SAMPLE_FACTORS           	728	M_728_138	Treatment:Control | Source:Maternal	Gestational Age (days)=138; Batch=1; NMR_ID=73
SUBJECT_SAMPLE_FACTORS           	728	M_728_146	Treatment:Control | Source:Maternal	Gestational Age (days)=146; Batch=1; NMR_ID=74
SUBJECT_SAMPLE_FACTORS           	734	F_734_143	Treatment:Control | Source:Fetal	Gestational Age (days)=143; Batch=1; NMR_ID=75
SUBJECT_SAMPLE_FACTORS           	728	F_728_144	Treatment:Control | Source:Fetal	Gestational Age (days)=144; Batch=1; NMR_ID=76
SUBJECT_SAMPLE_FACTORS           	706	F_706_135	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=135; Batch=1; NMR_ID=77
SUBJECT_SAMPLE_FACTORS           	734	M_734_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=1; NMR_ID=78
SUBJECT_SAMPLE_FACTORS           	734	M_734_138	Treatment:Control | Source:Maternal	Gestational Age (days)=138; Batch=1; NMR_ID=79
SUBJECT_SAMPLE_FACTORS           	706	M_706_138	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=138; Batch=1; NMR_ID=80
SUBJECT_SAMPLE_FACTORS           	728	F_728_140	Treatment:Control | Source:Fetal	Gestational Age (days)=140; Batch=1; NMR_ID=82
SUBJECT_SAMPLE_FACTORS           	770	M_770_135	Treatment:Control | Source:Maternal	Gestational Age (days)=135; Batch=1; NMR_ID=83
SUBJECT_SAMPLE_FACTORS           	759	M_759_146	Treatment:Control | Source:Maternal	Gestational Age (days)=146; Batch=1; NMR_ID=84
SUBJECT_SAMPLE_FACTORS           	728	F_728_142	Treatment:Control | Source:Fetal	Gestational Age (days)=142; Batch=1; NMR_ID=85
SUBJECT_SAMPLE_FACTORS           	759	F_759_138	Treatment:Control | Source:Fetal	Gestational Age (days)=138; Batch=1; NMR_ID=86
SUBJECT_SAMPLE_FACTORS           	759	M_759_142	Treatment:Control | Source:Maternal	Gestational Age (days)=142; Batch=1; NMR_ID=87
SUBJECT_SAMPLE_FACTORS           	734	F_734_142	Treatment:Control | Source:Fetal	Gestational Age (days)=142; Batch=1; NMR_ID=88
SUBJECT_SAMPLE_FACTORS           	759	F_759_147	Treatment:Control | Source:Fetal	Gestational Age (days)=147; Batch=1; NMR_ID=89
SUBJECT_SAMPLE_FACTORS           	759	M_759_144	Treatment:Control | Source:Maternal	Gestational Age (days)=144; Batch=1; NMR_ID=90
SUBJECT_SAMPLE_FACTORS           	734	F_734_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=1; NMR_ID=91
SUBJECT_SAMPLE_FACTORS           	759	F_759_144	Treatment:Control | Source:Fetal	Gestational Age (days)=144; Batch=1; NMR_ID=92
SUBJECT_SAMPLE_FACTORS           	729	M_729_125	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=125; Batch=1; NMR_ID=93
SUBJECT_SAMPLE_FACTORS           	759	M_759_125	Treatment:Control | Source:Maternal	Gestational Age (days)=125; Batch=1; NMR_ID=95
SUBJECT_SAMPLE_FACTORS           	734	F_734_144	Treatment:Control | Source:Fetal	Gestational Age (days)=144; Batch=1; NMR_ID=96
SUBJECT_SAMPLE_FACTORS           	770	M_770_125	Treatment:Control | Source:Maternal	Gestational Age (days)=125; Batch=1; NMR_ID=98
SUBJECT_SAMPLE_FACTORS           	728	M_728_144	Treatment:Control | Source:Maternal	Gestational Age (days)=144; Batch=1; NMR_ID=99
SUBJECT_SAMPLE_FACTORS           	759	M_759_140	Treatment:Control | Source:Maternal	Gestational Age (days)=140; Batch=1; NMR_ID=101
SUBJECT_SAMPLE_FACTORS           	729	M_729_135	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=135; Batch=1; NMR_ID=102
SUBJECT_SAMPLE_FACTORS           	753	M_753_143	Treatment:Control | Source:Maternal	Gestational Age (days)=143; Batch=2; NMR_ID=107
SUBJECT_SAMPLE_FACTORS           	753	M_753_140	Treatment:Control | Source:Maternal	Gestational Age (days)=140; Batch=2; NMR_ID=109
SUBJECT_SAMPLE_FACTORS           	753	M_753_135	Treatment:Control | Source:Maternal	Gestational Age (days)=135; Batch=2; NMR_ID=110
SUBJECT_SAMPLE_FACTORS           	753	F_753_143	Treatment:Control | Source:Fetal	Gestational Age (days)=143; Batch=2; NMR_ID=111
SUBJECT_SAMPLE_FACTORS           	802	M_802_142	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=142; Batch=2; NMR_ID=112
SUBJECT_SAMPLE_FACTORS           	802	F_802_135	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=135; Batch=2; NMR_ID=113
SUBJECT_SAMPLE_FACTORS           	802	F_802_138	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=138; Batch=2; NMR_ID=115
SUBJECT_SAMPLE_FACTORS           	767	F_767_125	Treatment:Control | Source:Fetal	Gestational Age (days)=120; Batch=2; NMR_ID=116
SUBJECT_SAMPLE_FACTORS           	753	F_753_138	Treatment:Control | Source:Fetal	Gestational Age (days)=138; Batch=2; NMR_ID=117
SUBJECT_SAMPLE_FACTORS           	767	F_767_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=2; NMR_ID=118
SUBJECT_SAMPLE_FACTORS           	767	M_767_125	Treatment:Control | Source:Maternal	Gestational Age (days)=125; Batch=2; NMR_ID=119
SUBJECT_SAMPLE_FACTORS           	767	M_767_138	Treatment:Control | Source:Maternal	Gestational Age (days)=138; Batch=2; NMR_ID=120
SUBJECT_SAMPLE_FACTORS           	802	F_802_125	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=125; Batch=2; NMR_ID=121
SUBJECT_SAMPLE_FACTORS           	753	M_753_125	Treatment:Control | Source:Maternal	Gestational Age (days)=125; Batch=2; NMR_ID=122
SUBJECT_SAMPLE_FACTORS           	802	F_802_130	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=130; Batch=2; NMR_ID=125
SUBJECT_SAMPLE_FACTORS           	802	M_802_130	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=130; Batch=2; NMR_ID=126
SUBJECT_SAMPLE_FACTORS           	802	F_802_142	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=142; Batch=2; NMR_ID=127
SUBJECT_SAMPLE_FACTORS           	802	M_802_135	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=135; Batch=2; NMR_ID=129
SUBJECT_SAMPLE_FACTORS           	802	F_802_140	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=140; Batch=2; NMR_ID=130
SUBJECT_SAMPLE_FACTORS           	753	F_753_125	Treatment:Control | Source:Fetal	Gestational Age (days)=125; Batch=2; NMR_ID=131
SUBJECT_SAMPLE_FACTORS           	753	F_753_140	Treatment:Control | Source:Fetal	Gestational Age (days)=140; Batch=2; NMR_ID=132
SUBJECT_SAMPLE_FACTORS           	767	M_767_135	Treatment:Control | Source:Maternal	Gestational Age (days)=135; Batch=2; NMR_ID=133
SUBJECT_SAMPLE_FACTORS           	802	M_802_125	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=125; Batch=2; NMR_ID=134
SUBJECT_SAMPLE_FACTORS           	767	M_767_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=2; NMR_ID=135
SUBJECT_SAMPLE_FACTORS           	802	M_802_140	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=140; Batch=2; NMR_ID=136
SUBJECT_SAMPLE_FACTORS           	767	F_767_135	Treatment:Control | Source:Fetal	Gestational Age (days)=135; Batch=2; NMR_ID=138
SUBJECT_SAMPLE_FACTORS           	802	M_802_138	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=138; Batch=2; NMR_ID=139
SUBJECT_SAMPLE_FACTORS           	802	M_802_147	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=147; Batch=2; NMR_ID=140
SUBJECT_SAMPLE_FACTORS           	802	M_802_144	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=144; Batch=2; NMR_ID=142
SUBJECT_SAMPLE_FACTORS           	753	M_753_138	Treatment:Control | Source:Maternal	Gestational Age (days)=138; Batch=2; NMR_ID=143
SUBJECT_SAMPLE_FACTORS           	753	F_753_135	Treatment:Control | Source:Fetal	Gestational Age (days)=135; Batch=2; NMR_ID=144
SUBJECT_SAMPLE_FACTORS           	753	M_753_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=2; NMR_ID=150
SUBJECT_SAMPLE_FACTORS           	753	F_753_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=2; NMR_ID=151
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_147	Treatment:Control | Source:Fetal	Gestational Age (days)=147; Batch=3; NMR_ID=154
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_144	Treatment:Control | Source:Fetal	Gestational Age (days)=144; Batch=3; NMR_ID=155
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_125	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=125; Batch=3; NMR_ID=157
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_141	Treatment:Control | Source:Maternal	Gestational Age (days)=141; Batch=3; NMR_ID=158
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=3; NMR_ID=159
SUBJECT_SAMPLE_FACTORS           	1577	F_1577_135	Treatment:Control | Source:Fetal	Gestational Age (days)=135; Batch=3; NMR_ID=161
SUBJECT_SAMPLE_FACTORS           	1616	M_1616-10_140	Treatment:Control | Source:Maternal	Gestational Age (days)=140; Batch=3; NMR_ID=162
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_140	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=140; Batch=3; NMR_ID=164
SUBJECT_SAMPLE_FACTORS           	1616	M_1616-10_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=3; NMR_ID=165
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_144	Treatment:Control | Source:Maternal	Gestational Age (days)=144; Batch=3; NMR_ID=166
SUBJECT_SAMPLE_FACTORS           	1577	M_1577_135	Treatment:Control | Source:Maternal	Gestational Age (days)=135; Batch=3; NMR_ID=167
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_146	Treatment:Control | Source:Maternal	Gestational Age (days)=146; Batch=3; NMR_ID=168
SUBJECT_SAMPLE_FACTORS           	1577	F_1577_120	Treatment:Control | Source:Fetal	Gestational Age (days)=120; Batch=3; NMR_ID=169
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_138	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=138; Batch=3; NMR_ID=170
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_138	Treatment:Control | Source:Maternal	Gestational Age (days)=138; Batch=3; NMR_ID=172
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_146	Treatment:Control | Source:Fetal	Gestational Age (days)=146; Batch=3; NMR_ID=173
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_142	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=142; Batch=3; NMR_ID=176
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_138	Treatment:Control | Source:Fetal	Gestational Age (days)=138; Batch=3; NMR_ID=178
SUBJECT_SAMPLE_FACTORS           	1577	M_1577_120	Treatment:Control | Source:Maternal	Gestational Age (days)=120; Batch=3; NMR_ID=179
SUBJECT_SAMPLE_FACTORS           	1577	F_1577_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=3; NMR_ID=180
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_140	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=140; Batch=3; NMR_ID=181
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_120	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=120; Batch=3; NMR_ID=182
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_138	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=138; Batch=3; NMR_ID=183
SUBJECT_SAMPLE_FACTORS           	1616-10	F_1616-10_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=3; NMR_ID=184
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_140	Treatment:Control | Source:Maternal	Gestational Age (days)=140; Batch=3; NMR_ID=185
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_148	Treatment:Control | Source:Fetal	Gestational Age (days)=148; Batch=3; NMR_ID=186
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_140	Treatment:Control | Source:Fetal	Gestational Age (days)=140; Batch=3; NMR_ID=188
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_143	Treatment:Control | Source:Fetal	Gestational Age (days)=143; Batch=3; NMR_ID=189
SUBJECT_SAMPLE_FACTORS           	1577	M_1577_140	Treatment:Control | Source:Maternal	Gestational Age (days)=140; Batch=3; NMR_ID=191
SUBJECT_SAMPLE_FACTORS           	1577	M_1577_138	Treatment:Control | Source:Maternal	Gestational Age (days)=138; Batch=3; NMR_ID=192
SUBJECT_SAMPLE_FACTORS           	1577	F_1577_138	Treatment:Control | Source:Fetal	Gestational Age (days)=138; Batch=3; NMR_ID=193
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_135	Treatment:Control | Source:Fetal	Gestational Age (days)=135; Batch=3; NMR_ID=194
SUBJECT_SAMPLE_FACTORS           	1616-10	F_1616-10_137	Treatment:Control | Source:Fetal	Gestational Age (days)=137; Batch=3; NMR_ID=196
SUBJECT_SAMPLE_FACTORS           	1577	M_1577_125	Treatment:Control | Source:Maternal	Gestational Age (days)=125; Batch=3; NMR_ID=197
SUBJECT_SAMPLE_FACTORS           	1616-10	F_1616-10_140	Treatment:Control | Source:Fetal	Gestational Age (days)=140; Batch=3; NMR_ID=198
SUBJECT_SAMPLE_FACTORS           	1577	M_1577_130	Treatment:Control | Source:Maternal	Gestational Age (days)=130; Batch=3; NMR_ID=199
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_142	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=142; Batch=3; NMR_ID=202
SUBJECT_SAMPLE_FACTORS           	1616-10	M_1616-10_137	Treatment:Control | Source:Maternal	Gestational Age (days)=137; Batch=3; NMR_ID=203
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_135	Treatment:Control | Source:Maternal	Gestational Age (days)=135; Batch=3; NMR_ID=204
SUBJECT_SAMPLE_FACTORS           	1616-10	F_1616-10_125	Treatment:Control | Source:Fetal	Gestational Age (days)=125; Batch=3; NMR_ID=205
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_150	Treatment:Control | Source:Fetal	Gestational Age (days)=150; Batch=3; NMR_ID=207
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_130	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=130; Batch=3; NMR_ID=208
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_149	Treatment:Control | Source:Fetal	Gestational Age (days)=149; Batch=3; NMR_ID=209
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_145	Treatment:Control | Source:Fetal	Gestational Age (days)=145; Batch=3; NMR_ID=211
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_125	Treatment:Control | Source:Fetal	Gestational Age (days)=125; Batch=3; NMR_ID=212
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_141	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=141; Batch=3; NMR_ID=213
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_130	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=130; Batch=3; NMR_ID=215
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_135	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=135; Batch=3; NMR_ID=216
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_149	Treatment:Control | Source:Maternal	Gestational Age (days)=149; Batch=3; NMR_ID=218
SUBJECT_SAMPLE_FACTORS           	1616-10	M_1616-10_125	Treatment:Control | Source:Maternal	Gestational Age (days)=125; Batch=3; NMR_ID=219
SUBJECT_SAMPLE_FACTORS           	1577	F_1577_125	Treatment:Control | Source:Fetal	Gestational Age (days)=125; Batch=3; NMR_ID=220
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_130	Treatment:Control | Source:Fetal	Gestational Age (days)=130; Batch=3; NMR_ID=221
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_143	Treatment:Control | Source:Maternal	Gestational Age (days)=143; Batch=3; NMR_ID=222
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_125	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=125; Batch=3; NMR_ID=223
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_125	Treatment:Control | Source:Maternal	Gestational Age (days)=125; Batch=3; NMR_ID=224
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_144	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=144; Batch=3; NMR_ID=225
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_120	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=120; Batch=3; NMR_ID=226
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_143	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=143; Batch=3; NMR_ID=227
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_142	Treatment:Control | Source:Fetal	Gestational Age (days)=142; Batch=3; NMR_ID=228
SUBJECT_SAMPLE_FACTORS           	1576	M_1576_144	Treatment:Cortisol | Source:Maternal	Gestational Age (days)=144; Batch=3; NMR_ID=229
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_142	Treatment:Control | Source:Maternal	Gestational Age (days)=142; Batch=3; NMR_ID=230
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_148	Treatment:Control | Source:Maternal	Gestational Age (days)=148; Batch=3; NMR_ID=231
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_135	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=135; Batch=3; NMR_ID=232
SUBJECT_SAMPLE_FACTORS           	1618	F_1618_141	Treatment:Control | Source:Fetal	Gestational Age (days)=141; Batch=3; NMR_ID=233
SUBJECT_SAMPLE_FACTORS           	1576	F_1576_143	Treatment:Cortisol | Source:Fetal	Gestational Age (days)=143; Batch=3; NMR_ID=234
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_145	Treatment:Control | Source:Maternal	Gestational Age (days)=145; Batch=3; NMR_ID=235
SUBJECT_SAMPLE_FACTORS           	1618	M_1618_147	Treatment:Control | Source:Maternal	Gestational Age (days)=147; Batch=3; NMR_ID=237
SUBJECT_SAMPLE_FACTORS           	1577	F_1577_140	Treatment:Control | Source:Fetal	Gestational Age (days)=140; Batch=3; NMR_ID=238
#COLLECTION
CO:COLLECTION_SUMMARY            	Blood samples were collected from ewe and fetus on gestational days 125, 130,
CO:COLLECTION_SUMMARY            	135, 138, 140, and every subsequent day until birth (control: 144±1; CORT:
CO:COLLECTION_SUMMARY            	142±2 days gestational age);
CO:SAMPLE_TYPE                   	Blood (serum)
CO:COLLECTION_METHOD             	samples for metabolomics analysis were collected in glass tubes on ice with no
CO:COLLECTION_METHOD             	anticoagulant and spun for 20 min at 4 °C; the resulting serum was stored at
CO:COLLECTION_METHOD             	-20 °C until metabolomic analysis.
CO:COLLECTION_LOCATION           	University of Florida
CO:STORAGE_CONDITIONS            	-20?
CO:COLLECTION_VIALS              	Eppendorf tubes
CO:STORAGE_VIALS                 	Eppendorf tubes
#TREATMENT
TR:TREATMENT_SUMMARY             	The treatment protocol for this study was previous published in Antolic, A., et
TR:TREATMENT_SUMMARY             	al. (2018). "Chronic maternal hypercortisolemia in late gestation alters fetal
TR:TREATMENT_SUMMARY             	cardiac function at birth." Am J Physiol Regul Integr Comp Physiol 314(3):
TR:TREATMENT_SUMMARY             	R342-R352.
TR:TREATMENT_COMPOUND            	Hydrocortisone sodium succinate in sodium phosphate (Solu-Cortef; Pfizer, New
TR:TREATMENT_COMPOUND            	York, NY, USA)
TR:TREATMENT_DOSE                	1 mg/kg/day
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Saline buffer was created by weighing 9 g of NaCl into a 1 L volumetric flask.
SP:SAMPLEPREP_SUMMARY            	Next, 100 mL of D2O was added and filled up to 1 L with water and shaken until
SP:SAMPLEPREP_SUMMARY            	dissolved. Samples were thawed on ice and centrifuged at 3,000 g for 20 min at 4
SP:SAMPLEPREP_SUMMARY            	°C. Two hundred mL of serum was mixed with 400 mL of Saline buffer and
SP:SAMPLEPREP_SUMMARY            	centrifuged for 10 min at 3000 g at 4 °C. For each sample, 500 mL of the
SP:SAMPLEPREP_SUMMARY            	resulting supernatant was transferred into a 5 mm SampleJet NMR tube (Bruker
SP:SAMPLEPREP_SUMMARY            	Biospin, Billerica, MA, USA).
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_TYPE           	-
CH:INSTRUMENT_NAME               	-
CH:COLUMN_NAME                   	-
#ANALYSIS
AN:PROCESSING_PARAMETERS_FILE    	Serum_CORT_raw_data_cpmg.zip
AN:ANALYSIS_TYPE                 	NMR
#NMR
NM:INSTRUMENT_NAME               	Bruker Avance III
NM:INSTRUMENT_TYPE               	FT-NMR
NM:NMR_EXPERIMENT_TYPE           	1D-1H
NM:FIELD_FREQUENCY_LOCK          	H2O+D2O
NM:SPECTROMETER_FREQUENCY        	600 MHz
NM:NMR_PROBE                     	5mm Cryoprobe
NM:NMR_SOLVENT                   	D2O
NM:NMR_TUBE_SIZE                 	5mm
NM:SHIMMING_METHOD               	Topshim
NM:PULSE_SEQUENCE                	cpmgpr1d
NM:WATER_SUPPRESSION             	Presaturation
NM:POWER_LEVEL                   	7.37 W
NM:RECEIVER_GAIN                 	64
NM:OFFSET_FREQUENCY              	2824.2
NM:PRESATURATION_POWER_LEVEL     	6.41E-05
NM:TEMPERATURE                   	4C
NM:NUMBER_OF_SCANS               	128
NM:DUMMY_SCANS                   	16
NM:ACQUISITION_TIME              	1.8173
NM:RELAXATION_DELAY              	4 sec
NM:SPECTRAL_WIDTH                	15.0182 ppm
NM:NUM_DATA_POINTS_ACQUIRED      	32764
NM:REAL_DATA_POINTS              	65536
NM:LINE_BROADENING               	1
#NMR_METABOLITE_DATA
NMR_METABOLITE_DATA:UNITS        	Area under curve
NMR_METABOLITE_DATA_START
Samples	F_729_130	F_770_135	F_759_125	F_759_146	F_729_125	F_728_146	F_729_135	F_759_140	F_734_135	F_706_142	F_770_130	F_706_140	F_728_135	F_759_135	F_728_130	F_770_140	F_728_138	F_728_147	F_770_125	F_770_138	F_734_125	F_734_140	F_706_138	F_759_145	F_759_142	F_759_130	F_734_138	F_734_143	F_728_144	F_706_135	F_728_140	F_728_142	F_759_138	F_734_142	F_759_147	F_734_130	F_759_144	F_734_144	F_753_143	F_802_135	F_802_138	F_767_125	F_753_138	F_767_130	F_802_125	F_802_130	F_802_142	F_802_140	F_753_125	F_753_140	F_767_135	F_753_135	F_753_130	F_1618_147	F_1618_144	F_1576_125	F_1577_135	F_1577_120	F_1576_138	F_1618_146	F_1576_142	F_1618_138	F_1577_130	F_1576_140	F_1576_120	F_1616-10_130	F_1618_148	F_1618_140	F_1618_143	F_1577_138	F_1618_135	F_1616-10_137	F_1616-10_140	F_1616-10_125	F_1618_150	F_1618_149	F_1618_145	F_1618_125	F_1576_130	F_1577_125	F_1618_130	F_1576_144	F_1618_142	F_1576_135	F_1618_141	F_1576_143	F_1577_140
Factors	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal	Treatment:Cortisol | Source:Fetal	Treatment:Control | Source:Fetal
Very low density lipoprotein	4.678740619	1.387599374	2.277671479	1.97053018	2.966746705	1.275344012	4.322844623	2.051035209	1.472621187	1.923236796	2.270630611	2.038149091	1.410050447	1.945687869	1.66923413	0.991318017	1.028249367	0.636737203	3.462530152	1.590588953	1.923369643	1.394108857	1.922174024	1.861463135	1.702578622	2.163954805	1.026920902	0.806528421	0.973782268	1.910882064	0.959169144	1.017355948	1.740439898	0.783014575	1.68517572	1.807527423	2.062460015	0.770128457	1.64325207	1.946575757	1.2541465	1.000084997	4.089020976	1.465382745	2.832900969	1.989401015	1.84424178	0.685332483	0.835220888	0.927833794	2.451414617	3.023381414	1.589917545	2.167478936	1.538612712	1.84919467	1.807648887	1.823987116	1.709697312	1.371418166	1.274703628	1.438404906	1.403005409	1.523674902	1.25628033	1.788509818	1.673986611	1.491309648	1.141827144	1.373907801	1.310344309	1.712498152	1.511693534	1.545148003	1.843670792	7.824551916	1.788587619	1.455521146	3.414319232	1.540168733	1.447040827	2.11286257	1.373440994	1.371262563	1.437471292	1.251643385	1.570744563
Isoleucine	0.928659208	1.12935272	0.719191602	0.787692755	0.952589332	0.769230422	1.655542044	0.85577528	0.86993173	1.016237821	1.124397536	1.247166501	0.673441581	0.8815935	1.11798997	0.969761609	0.850683401	0.658917765	0.797509146	1.069634205	0.929009489	0.878714367	1.147891945	1.073051573	0.994964702	0.764958711	0.902473622	0.698636131	0.743284051	1.126618825	0.834476531	0.842977235	0.87350288	0.899961856	0.767205631	0.776338548	1.039048756	0.895399669	1.235695927	0.909400368	0.906780889	0.835000764	0.653713622	1.16903763	0.714494063	0.903181767	0.823032086	0.857053373	0.854061204	1.092731982	0.877785595	0.72466318	1.278927986	1.357788049	0.684267646	0.92254594	1.235320993	1.069046551	0.70292814	1.249479733	0.938907152	1.00933781	0.879392035	0.79914707	1.089498065	1.022286402	0.862522561	0.976373358	0.905882192	0.883869585	0.809179203	0.874757165	0.804229694	0.790663927	0.915321352	1.057308108	0.594510912	0.994150443	1.133426466	0.978200682	0.706534384	0.846463887	1.10922349	0.875144413	1.048474022	0.854874421	1.113459011
Valine	1.617677987	1.451388687	1.517460969	1.329775779	1.193861992	1.040432398	1.204726226	1.26082115	1.168419729	1.367800599	1.771772737	1.858354033	1.127512562	1.541517487	1.303391211	1.095318953	1.237762367	0.855707159	2.203016321	1.350728231	1.317470371	1.430214516	2.073421527	1.292305257	1.263925217	1.254613016	1.411479255	1.569786668	1.252506685	2.440255721	1.489191788	1.470234808	1.352612843	1.715899533	1.154185365	1.357158084	1.270798508	1.517460969	1.60363924	0.722662507	1.254648835	1.307778336	1.1319773	1.963767637	1.511334735	1.730509927	1.689670624	1.550253694	1.483041676	1.385104163	1.51069462	1.03473111	1.624122903	1.031519471	1.186390791	0.985949115	1.536951573	1.681894157	1.443010449	1.276598032	1.555451271	1.321574361	1.61833327	1.557148491	1.331842542	1.778635695	1.578278879	1.138189745	2.208965815	1.589565392	1.492399549	1.745370184	1.66763751	1.23645878	1.964820724	0.934947655	0.963545811	1.748085736	0.836339176	1.327938936	1.402616614	1.972712797	1.04424862	1.705570376	1.275409978	1.711340924	1.254873617
Branched-chain amino acids	17.30020689	15.24666326	12.37062231	12.0574614	15.16117393	11.80909241	22.73192879	12.98254592	13.15442446	13.67095997	15.51572967	16.67118542	11.5040305	14.00301852	15.58862057	13.47658424	12.16544792	11.51752881	15.98367125	14.50335605	13.43428952	13.74745042	16.60009429	13.66736042	13.64036379	13.46218604	13.1589239	12.87365951	12.50740523	18.26488646	12.81876636	13.41989132	13.20481817	13.74835031	13.48468323	13.58457076	14.34587572	13.35869896	15.67026147	13.58615984	13.47980373	11.56539386	13.69968602	18.59087179	13.77019175	13.41407805	12.26447612	11.83546666	11.98842825	14.17291093	15.58183055	13.76063165	17.5129706	17.83283631	10.82216627	11.09362851	16.69016969	16.03992294	11.92590226	15.49173758	13.89979044	13.83139879	14.14600038	12.87707226	14.66788126	15.47805925	14.15546999	13.06856887	16.05991435	13.53152772	12.13318156	14.35327968	14.82991686	13.74091138	15.8547394	14.75626431	9.357848476	15.45596348	19.48370548	12.98755107	11.33878626	14.84043865	13.62517167	14.07024347	14.07760873	14.37011455	14.82044725
3-Hydroxyisobutyrate	0.464659966	0.222874572	0.417172664	0.48783682	0.39464505	0.27366991	0.372230796	0.33970694	0.325227847	0.283326074	0.308615535	0.287716176	0.344674145	0.411875686	0.288107781	0.208261509	0.292734908	0.435145289	0.858274881	0.23938383	0.286871133	0.32773206	0.347157747	0.486012764	0.330442382	0.427838757	0.298124634	0.325928615	0.246772805	0.376445706	0.277194358	0.227182231	0.340418013	0.307069725	0.504768599	0.418069234	0.363842197	0.354948633	0.350823604	0.062864341	0.373907822	0.383159258	0.51072702	0.263711462	0.514199082	0.409094339	0.432167465	0.422982586	0.413243064	0.372698702	0.434696634	0.238209002	0.265752546	0.456650608	0.262023077	0.415842508	0.303044686	0.393173404	0.345356633	0.273561855	0.275901173	0.25187675	0.411117457	0.350415872	0.257075234	0.437954632	0.45566661	0.315493199	0.525437693	0.329649785	0.252795767	0.455378836	0.352671643	0.283383276	0.49940814	0.771103199	0.293511037	0.353674208	0.193820822	0.307806869	0.35191972	0.532910514	0.20221266	0.3871116	0.277729925	0.399281623	0.246733964
Lactate	5.554262402	7.874120446	7.36111672	7.302142083	4.650797439	7.789438917	4.657035141	8.27068707	6.465911986	9.069112913	6.033620342	9.143776315	7.705135431	7.993203846	6.473661858	10.04559679	7.624045306	7.113876899	8.028739844	8.6770828	6.663628234	7.602496881	7.726872877	7.936497465	7.399677059	7.410829314	7.121626771	7.669599432	7.807963001	7.178333152	8.497134551	9.181580569	9.455472388	8.510744082	9.263048736	7.42065842	7.519894586	7.949917975	5.2885779	14.99826881	8.251530656	8.535647006	12.95731754	8.229269994	11.11729805	5.020278336	5.000595224	12.53202173	9.445405133	4.82725496	6.020777953	11.5203332	7.459519718	8.877549609	11.47575822	10.44063508	5.427469325	6.748068531	6.859009958	6.756488193	7.792899046	8.543734778	7.951386799	5.528406213	7.458787051	7.008780885	8.307984245	5.443615265	7.847379211	8.320861375	6.349273721	7.667099392	10.0404535	8.962736776	6.969158947	1.222393005	22.1944831	6.263591279	9.612536566	6.103716758	6.383447643	8.684392659	9.739326769	8.737882276	6.931121886	6.421286594	9.62244205
N-acetyl-alanine	8.13384303	6.639083886	5.137238396	5.66135201	7.294248912	5.31817033	10.45135471	5.375505322	6.202031111	6.474625409	6.238935336	7.345693953	5.530852782	5.837222267	7.126385306	6.560305791	5.060945123	5.125182402	6.774920883	6.40661488	5.652701144	6.094079352	6.462661446	5.484653478	5.445816613	5.631994285	5.839523029	5.006831198	5.439190418	6.707738628	4.951612907	5.400077462	6.035732024	5.047416642	6.974166884	5.850474657	5.700096844	5.22347096	6.185350702	5.309932095	5.753707055	5.449499956	6.188585719	8.172228594	6.076168891	5.108321237	5.23090526	4.593722521	4.971064103	6.483780986	7.529037967	6.346985998	7.416852211	9.578978451	5.066777809	4.659127091	7.029563438	6.226015208	5.26926289	6.714701199	6.052810047	6.142917971	5.999095828	5.171834987	6.19116798	6.377982118	5.547112836	5.875584052	5.746917361	5.409373494	5.234931153	5.657634225	6.123638587	5.867336188	5.679697263	5.216579654	5.467520941	6.310762019	9.830435229	5.96847563	4.969246808	5.874449971	5.750835097	5.962805223	6.390353915	5.42854978	6.086110802
Alanine	1.13363544	1.817246468	1.531326877	1.945693951	1.39738094	2.063865636	1.675638751	1.862135483	1.849425943	2.49040142	1.660134915	2.637597729	2.160223783	1.655808262	1.79867792	2.362134214	2.115154491	3.157246671	1.78912323	1.865741027	1.486257584	2.098478853	1.955519057	1.449661319	1.809764965	1.519789138	1.722060122	2.548270391	2.058727737	1.762261931	2.248830012	1.828153237	1.752977657	2.167344732	2.597486059	1.513569576	1.684201917	3.366638603	1.760375385	2.945299405	2.424696473	2.283552374	1.284089127	1.750400916	1.380176512	1.883608341	2.081381684	2.438961036	2.2915963	1.560135238	1.708465245	1.730237474	1.502755228	1.112396861	2.027117191	2.20679831	1.152690981	2.021751942	1.816558513	2.759528526	1.854115261	2.574372663	1.680237372	1.994816198	2.644339899	1.148749165	1.612131549	2.293627759	2.041789507	1.929666737	1.840756885	2.060951113	2.327680671	2.726132584	1.801557713	1.35186219	2.822488089	1.973574189	1.700712917	1.575231771	1.956711976	1.594721862	2.643792425	1.844041731	2.151174904	2.044636374	2.553678128
Arginine	0.038676395	0.040270951	0.102379465	0.098271562	0.054931618	0.135438677	0.014244563	0.087837175	0.059042656	0.041132513	0.037660394	0.054967679	0.069908217	0.073219626	0.068692309	0.034944004	0.098279402	0.087453039	0.04725909	0.032305225	0.03804061	0.040561013	0.061728472	0.070321359	0.071414187	0.069023136	0.052744395	0.073931453	0.133016269	0.048920282	0.115949656	0.108823542	0.081761555	0.058319854	0.052031783	0.047365707	0.069201877	0.059420521	0.052608107	0.048850417	0.10398768	0.067397048	0.051483839	0.110901677	0.027177865	0.063467173	0.067329946	0.062251747	0.08500299	0.084312983	0.058610536	0.019805551	0.081359246	0.067328599	0.037617167	0.09029237	0.092798684	0.063252231	0.083370105	0.052602804	0.071622191	0.090271748	0.070683182	0.082798176	0.065918025	0.068959147	0.036258836	0.05955669	0.05589827	0.077961528	0.091390859	0.049118987	0.056999508	0.075915782	0.027495675	0.082811925	0.00746304	0.086874545	0.020053725	0.073383347	0.099708575	0.033653535	0.094447104	0.06040221	0.074990522	0.039921381	0.097624334
Acetate	0.48916247	0.299241292	0.200617807	0.484980663	0.325919388	0.273524707	0.502883069	0.500502187	0.440430686	0.081573675	0.258720501	0.150008789	0.122918618	0.34733207	0.259025743	0.17613745	0.225372882	0.211514924	0.276149783	0.324881567	0.246953447	0.450244196	0.285184928	0.423825556	0.426404845	0.323095905	0.403572791	0.539435723	0.34379127	0.22897473	0.29701303	0.136425548	0.498304449	0.495450442	0.316991078	0.294906865	0.477242795	0.375887399	0.154456167	0.234005418	0.209226283	0.359653613	0.340802574	0.449657038	0.396563246	0.220625295	0.130088494	0.301180341	0.344673361	0.597767991	0.338699548	0.370595445	0.517411056	0.365031029	0.322026887	0.215648991	0.274375629	0.206772561	0.353633136	0.245430111	0.413847731	0.344917962	0.413195375	0.30057246	0.449837221	0.283193421	0.221505529	0.316243647	0.295456235	0.416178618	0.368021602	0.319153592	0.179659501	0.243788228	0.187297189	1.307281324	0.274053117	0.342139954	0.333234205	0.283039494	0.313656215	0.303812247	0.327560912	0.333520068	0.320802805	0.275013325	0.361835221
N-acetyl-glycoproteins	9.290002952	17.19345945	11.76055961	14.62543965	13.91994952	14.61292144	10.39339308	13.47734165	17.01194552	16.9493545	15.94789831	18.90398239	14.6200747	12.38021063	18.53111879	16.18663832	13.99148211	13.60162952	16.01853674	16.30287877	16.3189736	17.01462799	17.57526462	13.87971245	14.0335075	11.63627174	15.44627606	15.93895674	14.1130875	17.25336799	13.90564301	15.16014572	13.38077266	15.88798977	13.06424097	16.23224034	15.2611855	15.37384932	17.90378589	10.55642377	16.53727979	14.84403974	14.23479825	14.02539969	11.31486173	16.53366947	15.57332437	15.27998587	15.52458505	16.58331137	12.15326828	11.55828755	15.8287545	17.35750964	11.01639651	11.89386813	17.38941769	17.3673275	12.68297898	18.12207582	14.81713724	16.89116108	14.74104879	13.2965955	16.96847676	15.32398449	14.45755796	16.5058099	14.94722394	14.26856407	13.77030745	13.33709419	14.57169063	15.59643022	14.80118321	12.95051578	12.91738049	15.30925769	11.15875554	14.62323442	13.12846457	13.16528157	17.70604382	13.80835168	15.86764872	13.59604036	18.78846336
Methionine	0.211418311	0.503460565	0.443536396	0.418582274	0.298057957	0.547646784	0.170488219	0.370759093	0.491007306	0.499956895	0.490245638	0.610884205	0.478382671	0.477973275	0.526796144	0.514295281	0.540534716	0.598973634	0.464291828	0.478230338	0.445421522	0.453590403	0.489103137	0.429921595	0.433482389	0.384231082	0.477792379	0.497433873	0.558843292	0.500223479	0.551845475	0.488960325	0.42125763	0.425979967	0.498166977	0.379451621	0.463016035	0.560852189	0.589725409	0.318778253	0.557113875	0.48634077	0.379107565	0.460559428	0.284068238	0.522023054	0.480215473	0.503736289	0.550251274	0.540301718	0.352977827	0.318413652	0.43966374	0.551769202	0.387071049	0.44267902	0.579863064	0.444901407	0.516404272	0.537891366	0.43602394	0.489542385	0.423523016	0.573050967	0.538918012	0.52187569	0.348614103	0.436784865	0.526078899	0.414138265	0.611652852	0.432074372	0.532661511	0.459117432	0.588776766	0.496318247	0.349978938	0.439466223	0.177200478	0.512237297	0.533724391	0.524182624	0.477427963	0.342116038	0.394414586	0.47472245	0.436531223
Acetone	0.20324255	0.137741914	0.201285143	0.115159238	0.231044979	0.05900522	0.106332782	0.229468179	0.223614082	0.080491386	0.184339074	0.122898245	0.158838411	0.164511267	0.207501723	0.039523584	0.159273391	0.149268866	0.415548707	0.107927707	0.159219018	0.13509579	0.10680401	0.13299339	0.141584232	0.181203598	0.143106659	0.131851569	0.074417987	0.158385308	0.111679403	0.018892877	0.23775091	0.128299238	0.018606515	0.09727615	0.1238407	0.140605528	-0.076726288	0.155466985	0.150674832	0.169556587	0.384039145	0.198275753	0.1631783	0.175749262	0.135319697	0.142507925	0.198697597	0.129582613	0.113755012	0.073004844	0.153813355	0.175913803	0.122811553	0.154523933	0.152725048	0.092397744	0.129697911	0.117991103	0.09697928	0.091143443	0.098506224	0.102533338	0.089963627	0.146955967	0.166216687	0.138600988	0.136977775	0.105479013	0.096872471	0.123141817	0.13477133	0.110922046	0.15382827	1.032534535	0.147328392	0.113219841	0.111744193	0.124961783	0.148860255	0.155725532	0.109080999	0.099816038	0.136429677	0.085512089	0.111020423
Glutamate	0.153283074	0.090216068	0.107071189	0.230813569	0.158814631	0.285750154	0.177965429	0.098709346	0.14575177	0.230136236	0.102684649	0.136760974	0.223854774	0.108304904	0.1250044	0.165797617	0.223201631	0.207066579	0.136293292	0.079729494	0.12248859	0.149549676	0.110135317	0.0920489	0.08650928	0.089822569	0.129479639	0.165410569	0.132705037	0.104466681	0.159169424	0.186883653	0.122827257	0.200623847	0.262728878	0.156556852	0.101249347	0.245198842	0.165364691	0.053198966	0.097794472	0.189243414	0.102848266	0.122355045	0.110313685	0.206303636	0.178121434	0.199666777	0.174111373	0.146809428	0.172336887	0.200868397	0.144517965	0.109077242	0.086008884	0.149303378	0.124818435	0.15780289	0.183765478	0.16868373	0.144589569	0.174887396	0.151696919	0.169904924	0.155006355	0.112997275	0.131437307	0.205429462	0.146299241	0.133757576	0.179784385	0.134551353	0.140620688	0.163579138	0.141536583	0.125258065	0.06723913	0.132011269	0.241222664	0.148326423	0.172652611	0.151941158	0.361034024	0.133623245	0.16283421	0.13679835	0.200898832
Pyruvate	0.335068449	0.291285791	0.311263321	0.636365354	0.47713189	0.56945462	0.356400082	0.424078141	0.455032932	0.489670882	0.312166057	0.436915036	0.469079492	0.422778202	0.443703605	0.488316779	0.461659008	0.553837301	0.931749344	0.354215463	0.381983598	0.47300639	0.349692759	0.466145602	0.477583257	0.240470826	0.506218018	0.5051889	0.47423411	0.327205625	0.375854026	0.543230162	0.434667225	0.592952818	0.706887029	0.588944673	0.426668991	0.633133562	0.316617494	0.523606405	0.534525752	0.509941416	0.72835545	0.465613744	0.613453935	0.307107095	0.334319661	0.649382109	0.501505791	0.291708016	0.418106908	0.578925677	0.341752765	0.457243388	0.647381751	0.491123557	0.239559977	0.403255577	0.370780521	0.440030761	0.484861116	0.57776812	0.37464458	0.358316205	0.38644268	0.526251368	0.382505942	0.499687475	0.388235409	0.541743944	0.396205788	0.488737288	0.443349734	0.42077103	0.365705158	0.781775911	0.824474371	0.369193713	0.450423748	0.370053739	0.380022769	0.40518155	0.736170321	0.525791072	0.525088516	0.458067075	0.556885242
Glutamine	0.062653734	0.074003171	0.075535718	0.186169337	0.074919835	0.122623565	0.084279349	0.066026291	0.075352385	0.063762324	0.091857099	0.102667041	0.069498153	0.061213809	0.095047278	0.085277175	0.060392631	0.064797389	0.119988158	0.080098027	0.067252328	0.075382941	0.063912237	0.044760658	0.067451894	0.092542686	0.056074765	0.062531512	0.040439927	0.068270207	0.057757225	0.070408133	0.066450248	0.066153287	0.063074826	0.086445921	0.09208149	0.052030944	0.052149876	0.042623592	0.105405179	0.100594679	0.046989598	0.051531739	0.069181869	0.093216918	0.111154515	0.094222221	0.095559856	0.134093701	0.064320689	0.07844478	0.055228928	0.034537275	0.119464142	0.073511206	0.054900138	0.118514274	0.073940936	0.065592902	0.070039316	0.100983402	0.041461095	0.096552251	0.067587742	0.04708868	0.079779864	0.057210818	0.066084861	0.097079433	0.097687631	0.074763999	0.044410499	0.050682679	0.046172861	0.068780654	0.078458972	0.067418668	0.052564802	0.09784966	0.112006095	0.081191163	0.071700704	0.072319469	0.108049291	0.0584777	0.140699381
Citrate	0.227482386	0.521206429	0.492093506	0.848501365	0.325481148	0.627619183	0.199722167	0.816257654	0.909500682	0.611931214	0.557831542	0.576931049	0.603891555	0.616491275	0.256825014	0.610008502	0.546414375	0.734363733	1.165663779	0.558341996	0.922517272	0.942510074	0.624973327	0.705046628	0.610153131	0.54471286	0.722376559	0.904481212	0.553297004	0.581414541	0.621332085	0.59482248	0.590960041	0.632247304	0.715383332	0.901758788	0.596660116	0.976795604	0.858957396	0.681399908	0.829072417	0.813122569	0.380692803	0.510432226	0.413253578	0.534430451	0.569855904	0.87265118	0.853437909	0.906974834	0.445100808	0.371196347	0.435268566	0.81350151	0.592809766	0.778538981	0.405125894	0.740294105	0.921364108	0.600112066	0.563403869	0.566956672	0.428876811	0.800605696	0.640692695	0.580725319	0.725959959	1.26971088	0.581794848	0.499822224	0.655948847	0.511365759	0.677019795	0.780764092	0.61913001	0.23675501	0.991276872	0.523843596	0.284084734	0.653932724	0.73726992	0.519073743	0.749428127	0.481418952	0.542234574	0.46430649	0.612835771
Dimethylamine	0.775228203	1.841804721	1.320296518	1.138151116	1.709155353	1.281149655	1.00334192	1.452945887	1.932067487	0.97589412	1.927657841	1.215544913	1.164968967	1.330645688	1.306077657	1.48696316	1.074436222	1.100354145	1.608273438	1.744702504	2.312377007	1.978683751	1.08919504	1.268100701	1.266480831	1.466174826	1.674238151	1.745152468	1.436297221	1.044198646	1.21545492	1.180987683	1.304997744	1.552027946	1.072546374	1.769630506	1.18026774	1.472474321	1.26344077	1.327013117	1.791962559	1.420927973	1.164121754	1.58001215	0.7122675	1.62204451	1.563148103	1.592021396	1.454477206	1.456610764	1.426051066	0.731558948	1.506385254	0.851858185	1.189088336	1.184763949	0.953048853	0.953851953	1.587446793	1.361549027	1.633676554	1.143373383	1.368550417	1.698954213	1.070682488	0.98110589	1.7609371	2.124082687	1.413750562	1.423943761	1.568810742	1.458641823	2.083824699	1.900038231	2.079191427	0.887956525	1.317069613	1.511564088	1.331175353	1.1226781	1.682171471	1.502091621	1.028159345	1.352694329	1.075109837	1.645208254	1.199899305
Sarcosine	0.056537818	0.101342993	0.099972648	0.048385542	0.037249148	0.063429547	0.080872932	0.076855523	0.121693893	0.066794978	0.09520623	0.09584459	0.102211162	0.067067345	0.099308754	0.076506554	0.063272936	0.088635384	0.049905689	0.094584894	0.115089	0.112858998	0.094610428	0.064221113	0.088184276	0.078770602	0.097240469	0.123872827	0.072667885	0.080787818	0.086873511	0.04993633	0.067816353	0.133771654	0.039879189	0.062666069	0.077153424	0.107292503	0.081517826	0.106439079	0.102052602	0.091250586	0.047152597	0.089549879	0.047379919	0.118512416	0.068168959	0.078200605	0.103568083	0.10591708	0.092614519	0.032276461	0.092126197	0.045194036	0.082371606	0.094163394	0.058460276	0.06928056	0.105822905	0.102195567	0.088522501	0.084438072	0.052559237	0.116510912	0.068156203	0.053289702	0.061589369	0.075106642	0.066069161	0.070584227	0.121208227	0.074098394	0.072966688	0.050574784	0.069182087	0.053971665	0.084368993	0.067800524	0.094181031	0.086822003	0.112549942	0.069429005	0.075136036	0.070919329	0.083908962	0.101941301	0.075512292
Trimethylamine	0.954777024	0.211192427	0.663256093	0.047918917	0.654724188	0.093997575	0.931218777	0.239639188	0.141345408	0.163517043	0.345538108	0.088917342	0.076780953	0.259879472	0.150252264	0.220488385	0.06871526	0.083858332	0.398271795	0.170407654	0.248015454	0.121564969	0.082298394	0.207131636	0.156718402	0.43863917	0.124062285	0.114044724	0.061376123	0.103432901	0.063080382	0.04402084	0.216010195	0.115841659	0.052151619	0.21844384	0.168398482	0.133513882	0.077738707	0.125045875	0.238021834	0.102526901	0.378245751	0.239528873	0.448938007	0.247566414	0.400539535	0.205646478	0.050490749	0.194161802	0.092618552	0.40829992	0.231474009	0.37695527	0.109689142	0.476804695	0.750885301	0.236276729	0.147419018	0.195293612	0.167496703	0.076790999	0.15623549	0.296317283	0.121912852	0.364134812	0.251445679	0.405849426	0.158468482	0.153521249	0.280205086	0.171173441	0.360804573	0.352642599	0.244669701	0.319705957	0.108765145	0.128842829	0.17773767	0.192579371	0.153790748	0.189133632	0.093673194	0.11633037	0.202839588	0.175408427	0.101334669
Creatine	0.265276413	0.504736484	0.461881739	0.424647289	0.319258694	0.948877016	0.337225871	0.350129938	0.448622366	0.528655035	0.407059644	0.563846476	0.624264641	0.363857668	0.305353311	0.532119268	0.575151666	0.820458135	0.405945275	0.535018242	0.429750775	0.565558405	0.52003079	0.498316751	0.433303834	0.462963807	0.63195217	0.706832902	0.851636233	0.472976975	0.618757398	0.882337899	0.506731042	0.568740008	0.580642758	0.331702478	0.512440163	0.575846128	0.57441421	0.212174836	0.496818692	0.501667496	0.571074248	0.599053753	0.594673715	0.356261963	0.451978239	0.613951741	0.412513953	0.482565258	0.591626733	0.714458225	0.634972992	0.402702814	0.66082948	0.351660344	0.547243193	0.644315034	0.253161329	0.559584054	0.703428835	0.470031862	0.590849965	0.236850765	0.481389292	0.3583045	0.539411724	0.644722798	0.572284706	0.693978302	0.277003535	0.505723214	0.602531207	0.573184185	0.527430655	0.580164147	0.624310607	0.743245799	0.311519567	0.476316227	0.236670869	0.449271873	0.532695609	0.73086896	0.52662712	0.634204883	0.514142343
Creatinine	1.02724279	0.910951237	0.633454951	0.956238616	0.717948983	2.161906331	1.436896648	0.961758045	0.920792659	1.123786015	0.604379724	1.15091541	0.825568484	0.766426404	0.717687044	0.880098567	1.109098722	2.011572065	0.731934653	0.941457774	0.765799622	1.059891614	1.039310694	0.905965042	0.973077551	0.760289548	0.99403267	1.303588416	1.970129576	0.827224313	1.171683429	1.425951341	0.724619072	0.96316129	0.959980602	0.891867112	0.942954568	1.115179449	0.863270323	1.264784955	0.795274437	0.747939005	0.779556019	1.940453849	0.915007255	0.685717407	0.653894475	0.736673567	0.74736415	1.090638268	1.409356648	1.159234748	1.628573667	0.894164652	1.256225813	0.321816642	1.030693908	0.939223578	0.373554919	1.420658858	1.305579454	1.187771363	0.944004712	0.669878452	1.322663407	0.709420685	0.817891921	1.062607681	1.49385885	1.204855316	0.917085622	0.684043897	1.066404115	1.196550616	0.891115641	1.015745449	1.467877005	1.596599844	1.176026145	0.772583855	0.490900319	0.460600031	1.435132763	1.178517555	0.97695064	1.458504559	1.249937969
Lysine	0.14547024	0.2766332	0.20908464	0.169791608	0.171892255	0.215665859	0.15471066	0.16665885	0.250356895	0.181278384	0.30008031	0.165080329	0.123417086	0.191247352	0.14261676	0.179432729	0.146077364	0.155621345	0.264272166	0.282182309	0.246459163	0.182286209	0.14345459	0.128723346	0.164825337	0.193651561	0.238275138	0.227456197	0.162226849	0.134897792	0.114562797	0.159664788	0.158159121	0.218932183	0.159421938	0.23149964	0.118598954	0.214694461	0.152917801	0.264208841	0.222519043	0.192781059	0.170637458	0.188660685	0.130823658	0.185326524	0.21526234	0.189489535	0.170920563	0.185887618	0.185577226	0.130750323	0.180145358	0.054525497	0.223968148	0.107216046	0.152576208	0.120429322	0.221483402	0.145779924	0.31948767	0.187238802	0.192920434	0.214834191	0.140671101	0.107494709	0.219718536	0.203865701	0.198888468	0.306491132	0.214145274	0.212573923	0.236933724	0.264234968	0.234859231	0.141708347	0.229943924	0.237359459	0.110730298	0.153404457	0.234015502	0.197998295	0.248776906	0.255333229	0.173112131	0.176324497	0.181557171
Citrulline	0.343111801	0.214569502	0.256674611	0.112011555	0.208871338	0.235613041	0.27064954	0.167812094	0.22083568	0.116763031	0.291693078	0.179569067	0.197384848	0.156424781	0.254970571	0.183265661	0.189117099	0.215498159	0.371837043	0.237208887	0.261254781	0.229896844	0.238200656	0.141791678	0.154837951	0.15516253	0.215912899	0.220880761	0.218707884	0.112777922	0.162411461	0.130106834	0.204065765	0.193453835	0.15083481	0.178667459	0.138852435	0.184437752	0.224333035	0.372150667	0.222982392	0.134500548	0.188815219	0.20835452	0.129166736	0.202616334	0.156260633	0.150055861	0.147395504	0.289515879	0.182062005	0.196886334	0.191221819	0.208855119	0.216543456	0.155356554	0.238595791	0.309736225	0.191586342	0.128664568	0.210240885	0.129126934	0.204084886	0.167908397	0.124823064	0.204791094	0.175690006	0.292200954	0.187322447	0.201220081	0.229215221	0.136075751	0.161525878	0.260581503	0.20455125	0.296931213	0.196063433	0.232906156	0.237063454	0.113870182	0.20229938	0.168961046	0.124579223	0.166469332	0.136062426	0.173837877	0.140899283
Dimethylsulfone	0.247468349	0.356195982	0.450365261	0.495609812	0.122369332	0.112943384	0.122270111	0.362879836	0.392483627	0.115252516	0.396497547	0.269639622	0.235056766	0.384248325	0.201989277	0.299378713	0.314676711	0.143728801	0.227155205	0.339400657	0.335386736	0.225080595	0.239539728	0.404534408	0.40888207	0.517609704	0.252248973	0.275746193	0.25358394	0.235697189	0.21431968	0.227074025	0.391608682	0.2300326	0.540349239	0.34196235	0.402261357	0.192590389	0.651207545	0.161998572	0.32077989	0.252322768	0.228203259	0.191897153	0.369259141	0.249363083	0.254148547	0.235496768	0.268130174	0.375774291	0.233584504	0.347138381	0.241973481	0.202326113	0.331536299	0.231490996	0.240419259	0.245934115	0.400152724	0.143009477	0.464461756	0.31399325	0.322642867	0.444573442	0.240117393	0.18716316	0.23736577	0.145134149	0.24513301	0.461350216	0.444666324	0.451574407	0.17729447	0.26584565	0.344713903	0.221599085	0.026741209	0.275203491	0.284062092	0.348928415	0.392582858	0.399548992	0.338305059	0.473401629	0.225952919	0.329701883	0.269688634
Choline	1.360931128	0.347031941	0.819695041	0.342522382	1.336801031	0.513153811	1.265004105	0.55409586	0.775904849	0.777892616	0.738473532	0.626001569	0.656460872	0.691301171	1.062568418	0.774015977	0.68506097	0.566259802	1.202404305	0.396913993	0.778031067	0.652109543	0.503017192	0.640677415	0.680462406	0.808243134	0.727347975	0.4199167	0.652178768	0.656302641	0.647787882	0.598479414	0.736663774	0.558397742	0.423259312	0.944291388	0.794941913	0.593198483	0.936049775	1.434668955	0.498436004	0.596561156	0.719574698	0.545516779	0.732316873	0.684063099	1.009835198	0.510137615	0.499731979	0.34285282	0.763467565	0.799518365	0.87380515	0.800114255	0.727000998	0.716013949	1.041479561	0.562915386	0.710818762	0.580321835	0.522732414	0.505151078	0.564808286	0.602820595	0.462128756	0.942585831	0.651665641	0.7043685	0.526940001	0.521847689	0.534933388	0.685202889	0.675512065	0.679081827	0.663856328	1.880990933	0.89277376	0.522814714	1.053670248	0.60024872	0.597244771	0.864832912	0.540262313	0.630452818	0.561989511	0.635534843	0.528174501
Betaine	6.651933579	15.32818052	6.626505234	6.299762958	6.474493153	5.01399743	12.76940349	5.807298021	4.789685948	5.744643855	9.348932394	5.378204665	4.714437178	5.016787374	6.061342333	15.50115704	4.449791081	5.441257395	9.537851446	12.98223635	5.49139667	4.314518663	4.949988148	5.30757923	5.425314859	6.431528019	3.976377474	4.274024621	3.849235749	5.81439245	4.226595577	3.976457187	5.373182766	4.216711204	6.265725644	5.037831521	4.856564887	4.349113966	5.924003527	15.33682759	6.951211908	5.641345307	6.159131618	6.179179242	3.963584895	5.025312363	5.541107188	5.251014089	5.731891529	5.867976393	5.830270928	7.251527968	5.246765585	4.311692167	5.614261661	4.458572482	8.096103211	3.417337161	1.661309942	7.887574177	6.499388584	7.864119467	7.721853194	2.612186954	7.804008763	5.732304217	9.304469361	3.039754781	6.68433474	5.860728367	2.03607263	6.674722153	5.815485129	7.027439978	9.329462085	12.46137079	8.01522932	6.824037657	13.98784945	6.919138175	2.228708854	5.050579615	8.725663513	6.220751756	7.7449234	7.053842547	8.590190134
Scylloinositol	1.005699045	0.181770848	0.35683495	0.322284454	0.201364598	0.204529319	0.184577818	0.16086993	0.087085151	0.120017512	0.174010402	0.098202953	0.113825667	0.246661385	0.143629082	0.112353384	0.390133318	0.115174113	0.13288279	0.105349719	0.35402798	0.088056583	0.13570352	0.313602111	0.315019356	0.158228076	0.087694704	0.07427216	0.128245786	0.207019816	0.139377348	0.094339242	0.197415577	0.081174003	0.166937939	0.39964124	0.258604766	0.118669066	0.305020144	0.14089609	0.297959539	0.199184889	0.206639222	0.165888361	0.171631492	0.181557983	0.259627834	0.174592024	0.137229497	0.184662378	0.112869462	0.414639354	0.142743584	0.077120628	0.063809294	0.136169463	0.794690888	0.087451769	0.218914797	0.497470773	0.109327738	0.578713799	0.101431372	0.260009944	0.508282948	0.438976978	0.106300921	0.091729276	0.090189965	0.041120006	0.064521965	0.089605323	0.136872513	0.09500031	0.226818563	0.08118352	0.052874269	0.078793148	0.077372246	0.559272605	0.201471746	0.065539538	0.459010215	0.110460019	0.67159786	0.098641371	0.506854646
Glycine	2.588621585	3.755343538	1.626596117	1.214642439	1.087303301	1.041730725	3.836485929	2.545329638	2.38664585	3.469744728	2.555812531	3.849689572	2.584860547	1.950605526	2.993693363	3.209112807	2.807882089	3.08699911	2.266372661	3.120528363	2.125453775	2.605666288	3.394443949	2.511800386	2.811082972	6.201058425	2.667603379	2.10256746	2.843331871	3.638111188	2.991932877	2.57229708	2.168665699	2.292699926	1.218963632	2.211877623	2.542928976	2.006460939	3.356335016	4.855809735	2.166824779	2.956877216	3.277551352	1.765766685	3.529659079	2.99122197	2.618969154	2.718310432	2.424348883	1.846150643	2.353320485	2.179134726	1.465157765	1.93865291	1.282560898	2.396461667	2.386495049	2.315679601	3.098190301	4.335755826	1.588641001	1.968028207	2.403018653	3.077076807	3.51823082	2.645889412	2.434361046	4.060755836	3.182119721	1.854198931	2.650085883	2.245388711	3.848571771	1.42602775	4.522105366	3.538819756	1.354163184	3.098059162	2.635529374	2.502029141	3.333848376	2.733359604	1.90573684	2.030975272	2.479866528	3.599799725	2.182310507
Myoinositol	1.85741063	3.27477682	1.374214986	0.754525811	1.686375078	0.935458559	2.353078819	1.795625336	1.6673198	1.567770411	2.800242666	1.701734786	1.600684072	1.304461121	2.073832388	1.592138069	1.506331577	1.565229707	4.101775866	2.118987622	0.908261481	1.95361091	1.777032004	1.064549402	1.204449786	1.980057325	1.688338349	1.358624304	1.518111203	1.787656765	1.515108553	1.259767834	1.653923363	1.295222199	1.150864035	1.64468444	1.135850786	1.099749697	2.146484354	2.000648636	1.630506477	1.689542179	2.622130909	1.495045845	1.019647707	2.851844085	1.713653295	1.464066715	1.621154287	1.543706461	1.00759215	0.739008933	1.712484271	1.074653423	1.386362644	1.039937764	1.617420966	1.007905048	2.910680897	1.383517098	1.544087185	1.248475623	1.506851185	3.137186346	1.097173886	1.872381873	2.210432718	1.268069238	1.391809832	1.936853811	2.558321022	2.137830648	1.233597483	1.111808121	2.143359138	0.687480326	0.954083581	1.180101221	2.04669188	2.286530744	3.381008973	2.833200749	0.899611703	1.687258791	1.770673934	1.591323245	0.94164448
Fructose	17.14614047	13.92203546	46.51708522	24.55105224	24.80677441	28.35178567	15.78329173	30.07565395	51.07595967	16.41307025	17.78293881	21.10231286	35.42275438	32.86152135	38.09429893	11.50922158	34.01377536	22.68678748	22.12620437	12.07281318	53.35439406	41.31639827	20.89673229	24.48687099	27.24566193	38.47236661	39.57849035	31.37532427	31.37833276	20.67610925	34.16420017	31.62603228	30.06963695	32.80536276	26.19369112	49.18562128	26.41130568	25.61305137	19.56281082	14.79861518	33.55113306	38.26625375	22.58091992	25.46260067	26.91129304	60.05454771	40.03197026	28.06749874	36.16290162	30.5889694	19.48232791	20.65521909	24.2838205	29.4835701	19.0508805	38.25277379	48.52090993	20.29251118	28.77648886	32.96013601	24.82221926	29.14149836	32.34480579	27.55979052	32.81453113	56.42845184	14.0005851	38.57988613	29.6590938	29.35292463	22.99916634	33.26032142	16.24250138	14.46233209	18.40962063	16.28039854	17.08222269	27.42914504	15.33097492	41.97866312	28.93904773	43.90742918	18.74471132	30.43997478	35.15717408	31.14705603	25.71579443
Glucose	1.219008439	0.253113138	0.977032839	1.819692392	1.431279004	1.917478152	1.464195393	1.138885131	2.157687506	1.089430264	0.312972795	1.051857411	1.021188971	1.057477282	1.275367719	0.866915476	1.016853641	1.623960305	0.487076406	0.004473977	1.508030389	1.536290313	0.814843355	1.780032158	1.570009541	0.808452758	1.624923711	1.162809726	1.666831894	1.079153928	1.434811495	1.625565982	1.300897991	1.229445342	2.374453969	1.306357295	1.351797968	0.850810531	2.528948344	3.744427699	0.932895287	0.999505504	0.889614356	1.048756218	1.300665375	1.185747041	0.97892546	0.796768512	1.016315157	0.881995027	1.01545111	1.467112367	0.948055395	1.22758503	0.961263888	1.309668568	1.569344852	0.877208986	0.988047254	1.247553593	1.0518022	1.601804388	0.985455589	0.714138058	1.366430269	1.416819024	0.76081351	1.486411589	0.99609416	0.976652427	0.992635774	1.186033426	0.683335488	0.818433435	0.720672451	5.42999024	1.125600909	1.086912881	1.422767107	1.379091187	0.807276531	1.083904851	1.224356071	1.039149779	1.420897709	1.097075605	1.635878403
Anserine	0.234772972	0.086887324	0.143854819	0.277282434	0.125445727	0.18920992	0.160665977	0.16028291	0.146536287	0.115792445	0.152544962	0.126540203	0.22721014	0.189472595	0.230482624	0.103720371	0.177761697	0.156977591	0.141950431	0.115354655	0.170286424	0.160118738	0.130950943	0.155259263	0.179928761	0.182533614	0.140855954	0.125817849	0.212172035	0.114873085	0.187787101	0.20798019	0.222941682	0.182916681	0.284899989	0.135372628	0.204072909	0.141676811	0.164188876	0.069047012	0.151883427	0.169771401	0.298625633	0.13534221	0.175929556	0.146811366	0.17080319	0.171085575	0.159258008	0.138090029	0.213030538	0.19589197	0.143520501	0.171577595	0.06634564	0.185679027	0.231715791	0.182899717	0.079669755	0.22307499	0.153877314	0.171764664	0.193883334	0.186329314	0.205989364	0.216545394	0.177394547	0.212661488	0.205116376	0.070968379	0.147560621	0.171292538	0.198025574	0.182721556	0.198658045	0.081033577	0.167666964	0.193669541	0.076564412	0.16181438	0.071384385	0.114634714	0.153262659	0.177118398	0.199531033	0.187977302	0.186275865
1-Methylhistidine	0.107018262	0.115967157	0.092944979	0.098745606	0.16062898	0.305982776	0.061332313	0.141649208	0.181329404	0.095867834	0.087016618	0.150695781	0.270600453	0.116155001	0.396238129	0.073822445	0.28751394	0.273771262	0.106913069	0.102427351	0.343378787	0.119994535	0.191390336	0.131858771	0.115200753	0.106109096	0.125066327	0.074401005	0.270006866	0.206222509	0.27725765	0.223181078	0.085739277	0.097115119	0.127771282	0.183839002	0.131926395	0.115260863	0.33152243	0.163700632	0.080963241	0.08426151	0.259118005	0.229716805	0.163675232	0.099317719	0.0775621	0.091995994	0.086989535	0.153921399	0.170228588	0.196823021	0.161465379	0.207847244	0.16442727	0.116420043	0.132206777	0.373233619	0.134257568	0.075475217	0.145942721	0.11547613	0.128524712	0.195713532	0.114559648	0.123816444	0.121980252	0.21514038	0.186209866	0.146110528	0.238423555	0.136929567	0.107464976	0.117576941	0.080761127	0.12078463	0.248379008	0.165443791	0.069032409	0.092252656	0.145884634	0.147680488	0.202022417	0.280520438	0.186000108	0.146421938	0.111753727
Histidine	0.095818086	0.127092923	0.103315707	0.092999181	0.052552893	0.16432249	0.094258514	0.094625472	0.093299419	0.18545594	0.084634204	0.185330841	0.102598471	0.08163182	0.103015469	0.178834015	0.088720783	0.129161233	0.070148533	0.139828037	0.08729465	0.09691896	0.109770833	0.108094502	0.092523803	0.082774394	0.09109767	0.126008729	0.109779173	0.115025006	0.105675915	0.110546449	0.090005136	0.126892764	0.093974956	0.098528572	0.115575443	0.130295467	0.126548412	0.116724676	0.129863402	0.122397413	0.079121953	0.088967158	0.056183485	0.127633203	0.141844092	0.144501136	0.11296895	0.098019291	0.076386613	0.081732271	0.086200247	0.111295141	0.094185619	0.110472872	0.101117511	0.156735463	0.117261863	0.079369548	0.092297446	0.065324209	0.136846391	0.15994489	0.089070449	0.085898505	0.100415889	0.112305993	0.078229851	0.104596342	0.185714006	0.139540435	0.110197611	0.124125818	0.086855477	0.126128781	0.128928244	0.052275665	0.131458303	0.066173418	0.110750475	0.103172013	0.119581083	0.102113136	0.08953078	0.083514862	0.096507182
Tyrosine	0.324935334	0.206430105	0.413373269	0.384388397	0.17306543	0.147738746	0.152800074	0.366859165	0.224410347	0.173837157	0.188930939	0.154754448	0.229802415	0.362549519	0.167282487	0.132153865	0.250989835	0.112779503	0.346934571	0.17170238	0.204495775	0.153992743	0.247020952	0.263908749	0.32516585	0.332532337	0.228770104	0.15447382	0.204826516	0.186315085	0.304690022	0.293244406	0.368683247	0.231586407	0.217685295	0.166129908	0.265823033	0.142296566	0.1298444	0.250724521	0.144497381	0.141697034	0.315402317	0.32380336	0.450395818	0.194875728	0.200197319	0.266996308	0.173654489	0.207249357	0.351481214	0.241476861	0.253571386	0.251776229	0.294969116	0.243035298	0.122914035	0.299523817	0.318868499	0.166362805	0.263342097	0.290864769	0.179719847	0.268633737	0.226157319	0.141460365	0.230241196	0.218890269	0.142954716	0.305224868	0.361989739	0.165011748	0.333433304	0.144367185	0.14474589	0.461998675	0.281540427	0.139433779	0.198358295	0.229780609	0.30728216	0.239258479	0.221029443	0.256709634	0.207897577	0.146670123	0.190743245
Phenylalanine	0.398104394	0.154430995	0.217976793	0.275322444	0.097160481	0.127254201	0.23685497	0.175698799	0.082510103	0.104613805	0.163686267	0.080991261	0.184997006	0.198078898	0.11888984	0.102566322	0.12966932	0.107820546	0.160569422	0.120371113	0.119881381	0.066623989	0.080724257	0.196079717	0.190283432	0.236479285	0.086920378	0.061314753	0.106696174	0.128096809	0.12780297	0.099864072	0.190618865	0.104863368	0.235379065	0.077144514	0.154178749	0.08036333	0.108224633	0.137903714	0.054528669	0.084445717	0.381610859	0.178224483	0.209124596	0.121486636	0.131477703	0.135024932	0.054054516	0.126219247	0.300113707	0.143295859	0.175630906	0.130060163	0.226521075	0.151734181	0.031725735	0.18279714	0.209853354	0.048015848	0.149538587	0.107719778	0.126232824	0.180610089	0.090052507	0.057522685	0.186966206	0.120158631	0.11158129	0.171229691	0.199968908	0.165710804	0.077348816	0.036988326	0.143780491	0.494836358	0.207973857	0.101585784	0.244854714	0.131597933	0.246512089	0.175039944	0.123430665	0.161456306	0.122841186	0.120713937	0.073948635
Formate	0.169395916	0.245149761	0.352622707	0.288568171	0.213738825	0.316182059	0.174183497	0.473511888	0.297560019	0.23012666	0.162198035	0.34040612	0.263837837	0.231425361	0.269615952	0.223776236	0.280996088	0.262186947	0.256188713	0.199089926	0.308620983	0.254427763	0.307014116	0.367656813	0.356452772	0.224447598	0.254548828	0.32302775	0.313639689	0.305099084	0.293190663	0.291022494	0.323864201	0.356045553	0.248418523	0.488303863	0.3960081	0.225449138	0.302703252	0.136428398	0.389810835	0.372646134	0.369815923	0.254117976	0.282302153	0.290399699	0.265111246	0.34953275	0.282878677	0.309529824	0.183480644	0.234738897	0.254720706	0.254515008	0.181279634	0.226817886	0.275681153	0.22285508	0.275315487	0.338754396	0.257814511	0.334885133	0.302970089	0.273470146	0.501076367	0.269651906	0.3139656	0.248757884	0.329757296	0.28980609	0.302111198	0.181296642	0.272007479	0.375031928	0.222974134	0.243255877	0.174442518	0.463701835	0.200566423	0.277262874	0.291464346	0.243111311	0.260391186	0.353831767	0.270672371	0.325437327	0.46351475
NMR_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	KEGG ID
Very low density lipoprotein
Isoleucine	C00407
Valine	C00183
Branched-chain amino acids
3-Hydroxyisobutyrate	C06001
Lactate	C00186
N-acetyl-alanine
Alanine	C00041
Arginine	C00062
Acetate	C00033
N-acetyl-glycoproteins
Methionine	C00073
Acetone	C00207
Glutamate	C00025
Pyruvate	C00022
Glutamine	C00064
Citrate	C00158
Dimethylamine	C00543
Sarcosine	C00213
Trimethylamine	C00565
Creatine	C00300
Creatinine	C00791
Lysine	C00047
Citrulline	C00327
Dimethylsulfone	C11142
Choline	C00114
Betaine	C00719
Scylloinositol	C06153
Glycine	C00037
Myoinositol	C00137
Fructose	C02336
Glucose	C00031
Anserine	C01262
1-Methylhistidine	C01152
Histidine	C00135
Tyrosine	C00082
Phenylalanine	C00079
Formate	C00058
METABOLITES_END
#END