#METABOLOMICS WORKBENCH catiapacifico_20200316_045902 DATATRACK_ID:1943 STUDY_ID:ST001349 ANALYSIS_ID:AN002244 PROJECT_ID:PR000919
VERSION             	1
CREATED_ON             	April 7, 2020, 12:44 pm
#PROJECT
PR:PROJECT_TITLE                 	Serum Metabolome of Simmental Dairy Cows Switched to High-Grain Diet during
PR:PROJECT_TITLE                 	Early Lactation
PR:PROJECT_SUMMARY               	In dairy cows, early lactation is associated with an energy deficit that is
PR:PROJECT_SUMMARY               	counteracted by increasing the amounts of grains in the diet. Yet, such diet
PR:PROJECT_SUMMARY               	often increases the odds for cows to develop digestive and systemic metabolic
PR:PROJECT_SUMMARY               	derailments, which can likely be detected as undesirable shifts in the serum
PR:PROJECT_SUMMARY               	metabolome. The present study aimed to identify the metabolic signatures of the
PR:PROJECT_SUMMARY               	serum metabolome of early lactation dairy cows fed high-grain diet.
PR:INSTITUTE                     	Institute of Animal Nutrition and Functional Plant Compounds
PR:DEPARTMENT                    	Department for Farm Animals and Veterinary Public Health
PR:LABORATORY                    	Christian Doppler Laboratory for Innovative Gut Health Concepts of Livestock
PR:LAST_NAME                     	Pacífico
PR:FIRST_NAME                    	Cátia
PR:ADDRESS                       	Veterinaerplatz 1
PR:EMAIL                         	catia.pacifico@vetmeduni.ac.at
PR:PHONE                         	+436608389796
#STUDY
ST:STUDY_TITLE                   	Multiparous and Primiparous Simmental Dairy Cows
ST:STUDY_SUMMARY                 	Targeted ESI-LC-MS/MS-based metabolomics was used to characterize metabolic
ST:STUDY_SUMMARY                 	alterations in the serum of cows, according to parities and feeding phase.
ST:INSTITUTE                     	Institute of Animal Nutrition and Functional Plant Compounds
ST:DEPARTMENT                    	Department for Farm Animals and Veterinary Public Health
ST:LABORATORY                    	Christian Doppler Laboratory for Innovative Gut Health Concepts of Livestock
ST:LAST_NAME                     	Pacífico
ST:FIRST_NAME                    	Cátia
ST:ADDRESS                       	Veterinaerplatz 1
ST:EMAIL                         	catia.pacifico@vetmeduni.ac.at
ST:PHONE                         	06608389796
ST:TOTAL_SUBJECTS                	24
ST:NUM_MALES                     	-
ST:NUM_FEMALES                   	24
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Bos taurus
SU:TAXONOMY_ID                   	9913
SU:GENDER                        	Female
#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           	-	cow 11_Day 7	Day:7 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.05.18
SUBJECT_SAMPLE_FACTORS           	-	cow 14_Day 7	Day:7 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.06.28
SUBJECT_SAMPLE_FACTORS           	-	cow 2_Day 7	Day:7 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.05.09
SUBJECT_SAMPLE_FACTORS           	-	cow 21_Day 7	Day:7 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.08.20
SUBJECT_SAMPLE_FACTORS           	-	cow 1_Day 14	Day:14 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.05.08
SUBJECT_SAMPLE_FACTORS           	-	cow 11_Day 14	Day:14 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.05.18
SUBJECT_SAMPLE_FACTORS           	-	cow 12_Day 14	Day:14 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.05.16
SUBJECT_SAMPLE_FACTORS           	-	cow 13_Day 14	Day:14 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.06.20
SUBJECT_SAMPLE_FACTORS           	-	cow 14_Day 14	Day:14 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.06.28
SUBJECT_SAMPLE_FACTORS           	-	cow 15_Day 14	Day:14 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.28
SUBJECT_SAMPLE_FACTORS           	-	cow 2_Day 14	Day:14 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.05.09
SUBJECT_SAMPLE_FACTORS           	-	cow 21_Day 14	Day:14 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.08.20
SUBJECT_SAMPLE_FACTORS           	-	cow 22_Day 14	Day:14 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.06.22
SUBJECT_SAMPLE_FACTORS           	-	cow 3_Day 14	Day:14 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.27
SUBJECT_SAMPLE_FACTORS           	-	cow 4_Day 14	Day:14 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.02.28
SUBJECT_SAMPLE_FACTORS           	-	cow 5_Day 14	Day:14 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.20
SUBJECT_SAMPLE_FACTORS           	-	cow 1_Day 21	Day:21 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.05.08
SUBJECT_SAMPLE_FACTORS           	-	cow 11_Day 21	Day:21 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.05.18
SUBJECT_SAMPLE_FACTORS           	-	cow 12_Day 21	Day:21 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.05.16
SUBJECT_SAMPLE_FACTORS           	-	cow 13_Day 21	Day:21 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.06.20
SUBJECT_SAMPLE_FACTORS           	-	cow 14_Day 21	Day:21 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.06.28
SUBJECT_SAMPLE_FACTORS           	-	cow 15_Day 21	Day:21 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.28
SUBJECT_SAMPLE_FACTORS           	-	cow 2_Day 21	Day:21 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.05.09
SUBJECT_SAMPLE_FACTORS           	-	cow 21_Day 21	Day:21 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.08.20
SUBJECT_SAMPLE_FACTORS           	-	cow 22_Day 21	Day:21 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.06.22
SUBJECT_SAMPLE_FACTORS           	-	cow 3_Day 21	Day:21 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.27
SUBJECT_SAMPLE_FACTORS           	-	cow 4_Day 21	Day:21 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.02.28
SUBJECT_SAMPLE_FACTORS           	-	cow 5_Day 21	Day:21 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.20
SUBJECT_SAMPLE_FACTORS           	-	cow 1_Day 42	Day:42 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.05.08
SUBJECT_SAMPLE_FACTORS           	-	cow 11_Day 42	Day:42 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.05.18
SUBJECT_SAMPLE_FACTORS           	-	cow 12_Day 42	Day:42 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.05.16
SUBJECT_SAMPLE_FACTORS           	-	cow 13_Day 42	Day:42 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.06.20
SUBJECT_SAMPLE_FACTORS           	-	cow 14_Day 42	Day:42 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.06.28
SUBJECT_SAMPLE_FACTORS           	-	cow 15_Day 42	Day:42 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.28
SUBJECT_SAMPLE_FACTORS           	-	cow 2_Day 42	Day:42 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.05.09
SUBJECT_SAMPLE_FACTORS           	-	cow 21_Day 42	Day:42 | Group:control | Parity:primiparous	Species=cow; Calving date=2018.08.20
SUBJECT_SAMPLE_FACTORS           	-	cow 22_Day 42	Day:42 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.06.22
SUBJECT_SAMPLE_FACTORS           	-	cow 3_Day 42	Day:42 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.27
SUBJECT_SAMPLE_FACTORS           	-	cow 4_Day 42	Day:42 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.02.28
SUBJECT_SAMPLE_FACTORS           	-	cow 5_Day 42	Day:42 | Group:control | Parity:multiparous	Species=cow; Calving date=2018.04.20
SUBJECT_SAMPLE_FACTORS           	-	cow 16_Day 7	Day:7 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2019.05.27
SUBJECT_SAMPLE_FACTORS           	-	cow 17_Day 7	Day:7 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.07.03
SUBJECT_SAMPLE_FACTORS           	-	cow 23_Day 7	Day:7 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.08.04
SUBJECT_SAMPLE_FACTORS           	-	cow 8_Day 7	Day:7 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.03.02
SUBJECT_SAMPLE_FACTORS           	-	cow 10_Day 14	Day:14 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.04.11
SUBJECT_SAMPLE_FACTORS           	-	cow 16_Day 14	Day:14 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.05.27
SUBJECT_SAMPLE_FACTORS           	-	cow 17_Day 14	Day:14 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.07.03
SUBJECT_SAMPLE_FACTORS           	-	cow 18_Day 14	Day:14 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.06.13
SUBJECT_SAMPLE_FACTORS           	-	cow 19_Day 14	Day:14 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.06.07
SUBJECT_SAMPLE_FACTORS           	-	cow 20_Day 14	Day:14 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.05.28
SUBJECT_SAMPLE_FACTORS           	-	cow 23_Day 14	Day:14 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.08.04
SUBJECT_SAMPLE_FACTORS           	-	cow 24_Day 14	Day:14 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.07.16
SUBJECT_SAMPLE_FACTORS           	-	cow 6_Day 14	Day:14 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.04.23
SUBJECT_SAMPLE_FACTORS           	-	cow 7_Day 14	Day:14 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.03.13
SUBJECT_SAMPLE_FACTORS           	-	cow 8_Day 14	Day:14 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.03.02
SUBJECT_SAMPLE_FACTORS           	-	cow 9_Day 14	Day:14 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.05.11
SUBJECT_SAMPLE_FACTORS           	-	cow 10_Day 21	Day:21 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.04.11
SUBJECT_SAMPLE_FACTORS           	-	cow 16_Day 21	Day:21 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.05.27
SUBJECT_SAMPLE_FACTORS           	-	cow 17_Day 21	Day:21 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.07.03
SUBJECT_SAMPLE_FACTORS           	-	cow 18_Day 21	Day:21 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.06.13
SUBJECT_SAMPLE_FACTORS           	-	cow 19_Day 21	Day:21 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.06.07
SUBJECT_SAMPLE_FACTORS           	-	cow 20_Day 21	Day:21 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.05.28
SUBJECT_SAMPLE_FACTORS           	-	cow 23_Day 21	Day:21 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.08.04
SUBJECT_SAMPLE_FACTORS           	-	cow 24_Day 21	Day:21 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.07.16
SUBJECT_SAMPLE_FACTORS           	-	cow 6_Day 21	Day:21 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.04.23
SUBJECT_SAMPLE_FACTORS           	-	cow 7_Day 21	Day:21 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.03.13
SUBJECT_SAMPLE_FACTORS           	-	cow 8_Day 21	Day:21 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.03.02
SUBJECT_SAMPLE_FACTORS           	-	cow 9_Day 21	Day:21 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.05.11
SUBJECT_SAMPLE_FACTORS           	-	cow 10_Day 42	Day:42 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.04.11
SUBJECT_SAMPLE_FACTORS           	-	cow 16_Day 42	Day:42 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.05.27
SUBJECT_SAMPLE_FACTORS           	-	cow 17_Day 42	Day:42 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.07.03
SUBJECT_SAMPLE_FACTORS           	-	cow 18_Day 42	Day:42 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.06.13
SUBJECT_SAMPLE_FACTORS           	-	cow 19_Day 42	Day:42 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.06.07
SUBJECT_SAMPLE_FACTORS           	-	cow 20_Day 42	Day:42 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.05.28
SUBJECT_SAMPLE_FACTORS           	-	cow 23_Day 42	Day:42 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.08.04
SUBJECT_SAMPLE_FACTORS           	-	cow 24_Day 42	Day:42 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.07.16
SUBJECT_SAMPLE_FACTORS           	-	cow 6_Day 42	Day:42 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.04.23
SUBJECT_SAMPLE_FACTORS           	-	cow 7_Day 42	Day:42 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.03.13
SUBJECT_SAMPLE_FACTORS           	-	cow 8_Day 42	Day:42 | Group:treatment | Parity:primiparous	Species=cow; Calving date=2018.03.02
SUBJECT_SAMPLE_FACTORS           	-	cow 9_Day 42	Day:42 | Group:treatment | Parity:multiparous	Species=cow; Calving date=2018.05.11
#COLLECTION
CO:COLLECTION_SUMMARY            	Blood samples were collected before the morning feeding from the jugular vein of
CO:COLLECTION_SUMMARY            	all animals using vacutainer tubes. Samples were allowed to clot at 25°C for 2
CO:COLLECTION_SUMMARY            	h and all tubes were then centrifuged at 2000 × g at 4°C for 15 min to
CO:COLLECTION_SUMMARY            	separate serum. Serum was pipetted into 2 mL tubes and stored at -80°C for
CO:COLLECTION_SUMMARY            	further analysis.
CO:SAMPLE_TYPE                   	Blood (serum)
#TREATMENT
TR:TREATMENT_SUMMARY             	The feed contained either no additive as a control (CON) or a mineral-based
TR:TREATMENT_SUMMARY             	endotoxin binder (EB).
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	Determination of the serum metabolome was carried out using a targeted
SP:SAMPLEPREP_SUMMARY            	metabolomics approach based on the Biocrates MxP® Quant 500 kit. Ten μL
SP:SAMPLEPREP_SUMMARY            	aliquots of the serum samples were processed according to the manufacturer’s
SP:SAMPLEPREP_SUMMARY            	instructions.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	RP-LC-MS/MS
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	Agilent 1290
CH:COLUMN_NAME                   	-
CH:COLUMN_TEMPERATURE            	50 °C
CH:SOLVENT_A                     	1 L of water + 2 mL of formic acid
CH:SOLVENT_B                     	1 L of acetonitrile + 2 ml of formic acid
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
AN:DETECTOR_TYPE                 	pulse counting detector
AN:SOFTWARE_VERSION              	Analyst 1.6.3.
AN:ACQUISITION_DATE              	12.6.2019-14.6.2019
#MS
MS:INSTRUMENT_NAME               	Sciex 6500+ QTrap
MS:INSTRUMENT_TYPE               	Triple quadrupole
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	NEGATIVE
MS:MS_COMMENTS                   	-
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	µM
MS_METABOLITE_DATA_START
Samples	cow 11_Day 7	cow 14_Day 7	cow 2_Day 7	cow 21_Day 7	cow 1_Day 14	cow 11_Day 14	cow 12_Day 14	cow 13_Day 14	cow 14_Day 14	cow 15_Day 14	cow 2_Day 14	cow 21_Day 14	cow 22_Day 14	cow 3_Day 14	cow 4_Day 14	cow 5_Day 14	cow 1_Day 21	cow 11_Day 21	cow 12_Day 21	cow 13_Day 21	cow 14_Day 21	cow 15_Day 21	cow 2_Day 21	cow 21_Day 21	cow 22_Day 21	cow 3_Day 21	cow 4_Day 21	cow 5_Day 21	cow 1_Day 42	cow 11_Day 42	cow 12_Day 42	cow 13_Day 42	cow 14_Day 42	cow 15_Day 42	cow 2_Day 42	cow 21_Day 42	cow 22_Day 42	cow 3_Day 42	cow 4_Day 42	cow 5_Day 42	cow 16_Day 7	cow 17_Day 7	cow 23_Day 7	cow 8_Day 7	cow 10_Day 14	cow 16_Day 14	cow 17_Day 14	cow 18_Day 14	cow 19_Day 14	cow 20_Day 14	cow 23_Day 14	cow 24_Day 14	cow 6_Day 14	cow 7_Day 14	cow 8_Day 14	cow 9_Day 14	cow 10_Day 21	cow 16_Day 21	cow 17_Day 21	cow 18_Day 21	cow 19_Day 21	cow 20_Day 21	cow 23_Day 21	cow 24_Day 21	cow 6_Day 21	cow 7_Day 21	cow 8_Day 21	cow 9_Day 21	cow 10_Day 42	cow 16_Day 42	cow 17_Day 42	cow 18_Day 42	cow 19_Day 42	cow 20_Day 42	cow 23_Day 42	cow 24_Day 42	cow 6_Day 42	cow 7_Day 42	cow 8_Day 42	cow 9_Day 42
Factors	Day:7 | Group:control | Parity:primiparous	Day:7 | Group:control | Parity:primiparous	Day:7 | Group:control | Parity:primiparous	Day:7 | Group:control | Parity:primiparous	Day:14 | Group:control | Parity:multiparous	Day:14 | Group:control | Parity:primiparous	Day:14 | Group:control | Parity:multiparous	Day:14 | Group:control | Parity:multiparous	Day:14 | Group:control | Parity:primiparous	Day:14 | Group:control | Parity:multiparous	Day:14 | Group:control | Parity:primiparous	Day:14 | Group:control | Parity:primiparous	Day:14 | Group:control | Parity:multiparous	Day:14 | Group:control | Parity:multiparous	Day:14 | Group:control | Parity:multiparous	Day:14 | Group:control | Parity:multiparous	Day:21 | Group:control | Parity:multiparous	Day:21 | Group:control | Parity:primiparous	Day:21 | Group:control | Parity:multiparous	Day:21 | Group:control | Parity:multiparous	Day:21 | Group:control | Parity:primiparous	Day:21 | Group:control | Parity:multiparous	Day:21 | Group:control | Parity:primiparous	Day:21 | Group:control | Parity:primiparous	Day:21 | Group:control | Parity:multiparous	Day:21 | Group:control | Parity:multiparous	Day:21 | Group:control | Parity:multiparous	Day:21 | Group:control | Parity:multiparous	Day:42 | Group:control | Parity:multiparous	Day:42 | Group:control | Parity:primiparous	Day:42 | Group:control | Parity:multiparous	Day:42 | Group:control | Parity:multiparous	Day:42 | Group:control | Parity:primiparous	Day:42 | Group:control | Parity:multiparous	Day:42 | Group:control | Parity:primiparous	Day:42 | Group:control | Parity:primiparous	Day:42 | Group:control | Parity:multiparous	Day:42 | Group:control | Parity:multiparous	Day:42 | Group:control | Parity:multiparous	Day:42 | Group:control | Parity:multiparous	Day:7 | Group:treatment | Parity:primiparous	Day:7 | Group:treatment | Parity:primiparous	Day:7 | Group:treatment | Parity:primiparous	Day:7 | Group:treatment | Parity:primiparous	Day:14 | Group:treatment | Parity:multiparous	Day:14 | Group:treatment | Parity:primiparous	Day:14 | Group:treatment | Parity:primiparous	Day:14 | Group:treatment | Parity:multiparous	Day:14 | Group:treatment | Parity:multiparous	Day:14 | Group:treatment | Parity:multiparous	Day:14 | Group:treatment | Parity:primiparous	Day:14 | Group:treatment | Parity:multiparous	Day:14 | Group:treatment | Parity:multiparous	Day:14 | Group:treatment | Parity:multiparous	Day:14 | Group:treatment | Parity:primiparous	Day:14 | Group:treatment | Parity:multiparous	Day:21 | Group:treatment | Parity:multiparous	Day:21 | Group:treatment | Parity:primiparous	Day:21 | Group:treatment | Parity:primiparous	Day:21 | Group:treatment | Parity:multiparous	Day:21 | Group:treatment | Parity:multiparous	Day:21 | Group:treatment | Parity:multiparous	Day:21 | Group:treatment | Parity:primiparous	Day:21 | Group:treatment | Parity:multiparous	Day:21 | Group:treatment | Parity:multiparous	Day:21 | Group:treatment | Parity:multiparous	Day:21 | Group:treatment | Parity:primiparous	Day:21 | Group:treatment | Parity:multiparous	Day:42 | Group:treatment | Parity:multiparous	Day:42 | Group:treatment | Parity:primiparous	Day:42 | Group:treatment | Parity:primiparous	Day:42 | Group:treatment | Parity:multiparous	Day:42 | Group:treatment | Parity:multiparous	Day:42 | Group:treatment | Parity:multiparous	Day:42 | Group:treatment | Parity:primiparous	Day:42 | Group:treatment | Parity:multiparous	Day:42 | Group:treatment | Parity:multiparous	Day:42 | Group:treatment | Parity:multiparous	Day:42 | Group:treatment | Parity:primiparous	Day:42 | Group:treatment | Parity:multiparous
CA	17.4	9.67	14.6	9.54	30.6	11.1	16.6	23.6	9.12	13.4	11.1	6.33	9.74	89.9	6.39	14.6	191	64.1	77.9	153	93.5	193	3.02	127	83.9	218	35.5	17.3	137	142	301	16	25.7	26.5	9.72	21	45.6	20.8	11.8	164	24.5	30.2	31.5	39.6	34	8.85	14.7	132	158	15.2	31.7	82.8	94.3	17.4	22.5	58.3	169	62.3	90.3	205	299	26.9	35.7	244	10.2	27.4	304	46.5	90.8	99.5	50	53.5	75.2	39.6	48.5	91.6	187	313	34.5	24.6
CDCA	0.209	0.119	0.116	0.067	0.362	0.129	0.284	0.294	0.088	0.143	0.106	0.129	0.387	2.02	0.218	0.117	4.2	1.15	1.25	4.17	3.67	5.4	0.079	4.17	2.41	4.93	0.338	0.191	4.87	3.87	15.7	0.351	0.623	0.524	0.158	0.512	1.08	0.634	0.296	2.88	0.215	0.254	0.288	0.919	0.444	0.109	0.247	5.11	3.18	0.135	0.371	1.8	2.03	0.185	0.668	0.725	7.37	2.8	2.3	9.38	6.37	0.906	0.717	6.25	0.115	0.59	7.85	0.547	3.01	2.94	0.907	1.04	1.23	0.941	1.7	2.53	7.34	13	0.887	0.734
DCA	0.652	0.22	0.423	0.208	1.48	0.252	0.704	0.771	0.175	0.548	0.301	0.249	0.61	5.08	0.296	0.467	6.51	2.11	4.39	8.21	5.37	9.61	0.06	5.21	3	9.26	1.12	0.725	4.07	5.75	19.8	0.385	0.759	1.3	0.334	0.548	1.25	0.674	0.437	6.72	0.575	0.817	1.7	2.21	1.2	0.265	0.563	4.8	4.91	0.368	0.916	3.83	8.01	0.625	1.05	3.56	11.5	3.03	4.94	8.17	6.36	1.34	1.25	8.91	0.28	1.78	7.57	1.73	3.13	3.44	1.13	1.41	2.08	0.765	2.33	4.19	8.93	15	0.852	0.841
GCA	9.44	9.04	20.6	10.4	12.3	11.4	7.24	19.4	3.34	15.1	11.2	5.69	2.55	34	20.1	12	6.94	14.3	8	11.2	3.69	17.9	2.65	5.53	1.96	14.3	10.7	15.3	6.27	20	10.9	6.43	5.34	10.8	8.12	3.61	2.05	3.51	7	17.4	18.9	15.1	12.1	12.7	31.1	4.69	11.4	5.75	3.25	13.2	11.9	6.61	11.3	10.8	2.68	27.6	6.07	6.3	18.1	7.33	7.75	10.2	6.39	5.03	6.16	6.13	3.4	17.4	8.61	8.13	8.43	5.21	2.43	8.75	3.81	4.17	7.79	6.85	4.37	4.83
GCDCA	0.673	0.829	1.11	0.693	0.6	0.85	0.448	1.33	0.221	1.02	0.851	0.534	0.267	2.88	1.75	0.839	0.569	1.04	0.967	1.13	0.516	2.78	0.237	0.606	0.304	1.84	1.36	1.1	0.581	2.6	2.04	0.36	0.755	0.889	0.734	0.288	0.307	0.369	1.08	2.47	1.26	0.893	0.401	1.1	1.8	0.393	0.955	0.771	0.309	0.806	1.43	0.645	0.934	0.642	0.244	1.63	0.936	0.687	2.28	1.73	1.33	0.949	0.612	0.621	0.437	0.518	0.505	1.07	1.03	0.89	0.805	0.727	0.281	1.07	0.428	0.418	1.57	1.23	0.512	0.462
GDCA	1.74	1.75	3.06	1.52	2.17	1.75	1.55	3.09	0.586	2.98	1.84	1.09	0.517	7.2	3.53	2.49	1.44	2.04	3.46	3.19	1.02	3.95	0.409	1.09	0.532	3.35	3.13	3.78	0.967	4.4	3.47	0.669	0.97	1.75	1.52	0.522	0.407	0.622	1.35	5.04	3.72	2.36	2.12	3.17	5.55	0.946	2.01	1.08	0.671	2.44	2.41	1.31	3.02	2.51	0.607	5.32	1.76	1.51	3.8	1.62	1.31	2.45	1.1	1.12	1.12	1.67	0.79	3.42	1.27	1.42	1.39	0.968	0.461	0.964	0.895	0.817	2.3	2.42	0.722	0.887
GLCA	0.077	0.081	0.093	0.095	0.078	0.071	0.084	0.125	0.053	0.095	0.084	0.079	0.037	0.233	0.142	0.147	0.149	0.126	0.115	0.204	0.094	0.226	0.028	0.103	0.042	0.213	0.156	0.214	0.13	0.287	0.222	0.105	0.059	0.087	0.116	0.06	0.054	0.071	0.102	0.413	0.112	0.153	0.053	0.209	0.243	0.056	0.129	0.113	0.1	0.096	0.137	0.106	0.14	0.148	0.065	0.177	0.156	0.099	0.357	0.21	0.208	0.123	0.115	0.082	0.084	0.091	0.18	0.149	0.17	0.158	0.191	0.096	0.067	0.138	0.096	0.09	0.199	0.248	0.143	0.107
GLCAS	0.002	0.001	0	0	0	0	0	0.001	0	0.003	0	0	0.001	0	0.004	0.005	0.018	0.004	0	0.007	0.004	0.016	0	0.009	0	0.009	0	0.003	0.008	0.006	0.009	0	0	0.005	0	0	0.002	0.003	0.005	0.014	0	0	0	0.002	0	0	0	0.006	0.012	0	0	0.005	0.003	0	0.002	0	0.007	0.002	0.004	0.015	0.017	0.002	0.003	0	0.002	0.003	0.012	0	0.004	0	0	0.004	0.008	0.005	0.004	0.005	0.013	0.012	0.003	0.004
TCA	4.72	6.16	11	10.3	4.38	5.89	3.05	5.58	2.53	10.6	8.76	4.18	0.722	15	19.3	5.45	2.21	4.37	2.17	1.79	2.06	7.44	2.46	2.4	0.911	5.48	6.91	11.6	2.25	8.77	4.1	1.37	4.27	6.75	7.54	2.08	0.843	2.49	6.79	11.2	10.4	8.28	10.1	5.21	9.15	3.15	5.81	2.32	1.62	11	9.55	1.05	3.52	7.73	0.824	15.2	2.78	2.49	8.34	3.05	2.78	8.59	5.83	1.67	5.19	2.47	1.1	14.3	3.43	3.61	4.94	2.53	1.1	5.36	2.34	1.86	3.81	4.72	1.55	1.99
TCDCA	0.401	0.573	0.695	1.06	0.225	0.53	0.245	0.281	0.222	0.897	0.705	0.537	0.087	1.86	2.73	0.431	0.063	0.228	0.275	0.064	0.249	0.596	0.409	0.184	0.126	0.305	1.28	1.05	0.084	0.694	0.402	0.063	0.581	0.517	0.676	0.134	0.097	0.196	1.37	1.3	1.48	0.613	0.363	0.326	0.943	0.34	0.479	0.174	0.079	1.22	1.46	0.113	0.188	0.609	0.072	0.964	0.135	0.164	0.883	0.43	0.151	1.16	0.64	0.185	0.442	0.221	0.1	1.25	0.263	0.249	0.296	0.353	0.098	0.664	0.179	0.161	0.332	0.159	0.133	0.149
TDCA	1.29	1.42	2.65	2.98	0.784	2	1.38	1.46	0.595	3.26	2.44	1.33	0.19	5.33	7.71	2	0.191	0.573	1.22	0.358	0.424	0.893	0.609	0.309	0.314	0.651	3.21	5.08	0.178	1.61	0.693	0.203	0.791	1.18	1.76	0.318	0.15	0.333	1.59	3.23	5.36	2.02	1.87	1.57	4.32	1.08	1.44	0.327	0.142	4.13	3.4	0.232	0.679	3.15	0.248	3.48	0.319	0.536	1.63	0.382	0.157	3.88	1.12	0.36	1.16	0.684	0.177	3.76	0.455	0.478	0.838	0.398	0.144	0.81	0.438	0.299	0.646	0.523	0.278	0.432
TLCA	0.038	0.03	0.032	0.042	0.023	0.032	0.029	0.035	0.015	0.067	0.037	0.026	0.011	0.16	0.11	0.066	0.026	0.031	0.031	0.037	0.029	0.095	0.027	0.025	0.013	0.043	0.087	0.093	0.021	0.081	0.084	0.018	0.04	0.024	0.042	0.014	0.014	0.024	0.057	0.198	0.078	0.071	0.018	0.033	0.11	0.025	0.066	0.036	0.018	0.055	0.102	0.025	0.028	0.053	0.007	0.069	0.049	0.019	0.115	0.053	0.045	0.056	0.045	0.024	0.042	0.032	0.017	0.074	0.03	0.032	0.039	0.033	0.013	0.039	0.031	0.023	0.049	0.052	0.016	0.014
AA	1.18	1.2	0.81	1.46	1.11	0.579	0.419	0.652	1.07	0.945	1.25	0.608	0.741	0.836	0.479	1.02	1.17	1	1.54	0.78	0.905	0.934	0.882	0.592	0.453	0.964	0.883	0.9	0.756	1.14	1.21	0.627	0.693	1.43	0.713	0.776	0.881	0.636	0.726	1.45	1.15	1.5	1.77	1.16	0.679	0.752	0.512	0.768	1.1	0.554	1.25	0.501	1.2	0.388	0.525	0.708	0.757	0.771	1.21	0.589	1.05	0.86	0.558	1.01	0.637	0.229	0.793	0.669	0.702	1.45	0.947	0.618	0.57	1.28	0.911	0.769	1.37	0.957	1.52	0.537
DHA	0.469	0.207	0.318	0.337	0.249	0.215	0.415	0.41	0.443	0.325	0.223	0.309	0.448	0.332	0.311	0.253	0.485	0.336	0.682	0.359	0.223	0.243	0.651	0.249	0.408	0.187	0.423	0.295	0.366	0.238	0.239	0.386	0.442	0.325	0.45	0.498	0.167	0.453	0.356	0.469	0.334	0.258	0.61	0.207	0.455	0.275	0.26	0.402	0.484	0.504	0.619	0.322	0.342	0.446	0.303	0.454	0.229	0.289	0.386	0.347	0.245	0.324	0.344	1.19	0.223	0.242	0.709	0.155	0.315	0.455	0.375	0.263	0.31	0.559	0.433	0.497	0.323	0.166	0.415	0.493
EPA	0.788	1.09	1.34	0.978	0.698	0.603	0.817	0.775	2.24	0.774	0.974	0.596	0.881	0.874	0.802	1.09	0.573	0.629	1.01	1.23	1.04	0.807	1.04	0.875	1.09	0.815	1.03	0.8	0.651	0.643	0.536	1.16	0.75	0.822	0.642	1.03	0.899	1.04	1.41	1.21	0.682	1.01	1.7	0.979	1.94	0.91	0.912	0.81	1.14	1.31	0.919	0.815	1.01	0.942	0.922	0.832	1.29	2.37	0.775	0.507	1.29	1.53	0.742	1.99	0.763	0.691	2.4	0.935	0.946	1.15	1.51	0.732	0.532	1.13	0.711	0.534	1	0.668	1.01	0.976
FA(12:0)	91.2	60.4	40.9	16.8	42.1	20.5	27.4	22.8	25.5	72.2	18.7		51.8	61	11.3	85	57	15.8	12.7	59.2	27.4	79.3		41.5		66	11.7	21.1	20.9	31.5	23.5	33		29.9	25.3	23.5	39.9	82.1		15.9		34.6	34.3	44.5		49.7	33.6		208	51.9	4.19	35.5	23.5	17.9		23.5	61.7	28.3	118	23.8	54	47.2	31.4	9.94	82.9	32.5	6.09	41.4	38.3			70.3	207	22.3	65.2		79.9	36.2	19.4	36
FA(14:0)	109	144	227	91.2	156	97.4	216	160	98.2	183	115		197	133	64.9	188	230	80.4	43.6	131	92.5	126		78		149	69.1	107	98.5	104	94.9	98.8		206	92.9	117	225	108		164		140	253	182		94	152		237	280	31.1	141	283	149		165	203	98.7	256	116	142	160	106	53.9	178	134	28	154	165			183	294	143	99.3		214	177	135	158
FA(16:0)	254	306	390	306	345	273	277	357	312	321	315	287	271	276	311	270	284	306	310	281	289	286	247	253	326	268	296	393	264	228	254	277	256	370	260	315	317	301	282	322	324	296	475	288	318	279	472	306	292	294	353	281	374	370	240	333	280	274	289	393	280	291	308	255	370	337	244	322	253	283	314	295	270	308	256	345	286	296	288	318
FA(18:0)	262	321	365	328	310	284	294	321	314	322	300	291	257	271	300	277	237	312	302	265	275	283	264	241	362	282	339	397	243	240	262	270	272	369	262	294	294	274	298	304	390	327	515	280	330	265	486	301	265	306	351	271	322	372	247	313	276	287	236	368	307	288	326	289	390	316	253	350	264	304	286	314	265	313	264	367	283	309	267	314
FA(18:1)	33.3	64.7	155	32.5	110	20	60.6	94.1	29.8	52.1	54	20.9	51.9	47.7	49.6	27.4	85.8	23	32.9	19.6	26.3	25.4	57.1	16.5	32.7	27.3	29.5	70.6	27	22.5	49.2	39.6	45.2	130	23.4	21.3	29.9	21.2	20.1	56.7	46.4	79.3	267	56.9	65	19	41.3	35.8	23.6	32.4	68.6	30.1	158	34.1	28.6	98.6	50.4	16.6	21.8	37.9	39.7	23.5	42	39	44.2	29.2	29.9	28.2	41.1	34.5	25.9	41.7	22.2	28.6	22.2	28.8	54	42.8	39.6	25.4
FA(18:2)	50.2	69.1	85.6	43.2	99.7	23.2	52.3	67.2	44.4	68	66.7	37.5	46.7	57.1	49.1	55.8	94.4	31	32.6	42.4	46.1	68.2	39.1	37.2	23.3	45.5	29.9	66.8	49.1	38.1	79.6	42.9	34.2	110	36	33.5	65.8	40.4	35.2	61.6	38.9	68.3	219	63.1	41.9	39.4	65.4	54.2	38.5	44.3	37.8	29.4	91.8	37.1	28	57	94.3	36.3	51.8	80	77.5	53.2	47	27.4	58	44.6	24.8	39.6	56.1	46.6	39.2	85.1	55	62.8	48.1	34	107	68.2	47.5	43.5
FA(20:1)	0.734	0.981	2.05	0.58	1.57	0.471	1.08	1.5	0.923	1.29	0.905	0.747	1.08	1.15	1.36	0.872	1.33	0.922	1.16	0.68	0.572	0.912	0.978	0.407	1.16	1.08	1.01	1.6	0.816	0.508	1.31	0.697	1.39	2.42	0.539	0	0.625	0.561	0.871	1.29	1.86	1.3	3.62	0.762	1.59	0.609	1.09	0.963	0.539	0.746	0	0.543	3.49	0.538	0.704	1.91	1.12	0.76	0.382	0.795	1.37	0.886	0.855	0.951	1.35	0.769	0.986	0.81	0.653	0.924	0.351	0.975	0.681	0.862	0.558	0.738	1.15	1.42	0.819	0.636
FA(20:2)	0.44	0.445	1.06	0.396	0.758	0.185	0.364	0.291	0.195	0.301	0.436	0.25	0.637	0.353	0.422	0.203	0.521	0.196	0.201	0.109	0.228	0.408	0.561	0.366	0.155	0.428	0.185	0.579	0.458	0.189	0.607	0.472	0.153	0.942	0.406	0.298	0.312	0.287	0.228	0.565	0.232	0.355	1.42	0.584	0.345	0.207	0.431	0.244	0.536	0.211	0.668	0.271	0.441	0.201	0.23	1.23	0.848	0.11	0.361	0.505	0.656	0.375	0.346	0.311	0.39	0.268	0.136	0.501	0.4	0.755	0.309	0.83	0.475	0.429	0.283	0.194	0.56	0.731	0.448	0.35
FA(20:3)	0.859	1.2	1.74	0.722	1.51	0.273	0.925	1.25	0.916	1.03	1.01	0.694	0.905	0.804	0.7	1.16	1.27	0.542	0.483	0.933	1.09	1.27	0	0.951	0.491	0.813	0.438	1.72	1.15	1.11	1.89	1.06	1.16	2.61	0.579	0.957	1.54	0.741	0.484	2.29	0	1	3.17	1.31	0	0.883	0.936	0.878	0.748	0.696	0.669	0.755	1.81	0.6	0.661	1.23	2.17	0.992	0.59	0.911	0.963	1.24	0.704	0	1.07	1.16	1.22	0.961	1.39	1.35	0.45	1.39	0.746	1.38	0.628	1.03	2.26	1.72	1.3	1.02
AconAcid	3.82	3.22	3.49	3.06	2.78	3.69	1.81	2.26	2.36	2.95	3.7	2.36	2.58	3.74	1.61	2.84	3.19	5.64	1.58	3.51	2.69	5.62	1.86	4.32	1.85	5.34	2.28	2.29	2.36	4	3.05	2.74	3.44	2.66	3.44	2.59	2.54	2.25	1.55	4.99	3.26	2.39	2.11	5.3	2.7	3.72	1.88	1.83	4.21	2.67	1.49	1.89	2.25	1.89	3.11	2.71	3.93	3.39	2.89	2.22	3.07	3.48	1.42	2.01	1.72	2.44	5.61	2.85	3.13	3.17	2.49	2.44	3.44	5.06	2.63	2.42	3.72	2.84	4.27	3.45
DiCA(12:0)	0.346	0.382	0.533	0.387	0.505	0.452	0.419	0.332	0.418	0.295	0.445	0.449	0.251	0.592	0.318	0.494	0.365	0.319	0.552	0.312	0.311	0.361	0.481	0.327	0.596	0.486	0.73	0.51	0.464	0.407	0.327	0.276	0.728	0.351	0.3	0.224	0.312	0.213	0.256	0.439	0.795	0.478	0.429	0.449	0.861	0.393	0.419	0.449	0.48	0.37	0.997	0.463	0.627	0.343	0.34	0.515	0.407	0.307	0.399	0.267	0.245	0.251	0.255	0.61	0.415	0.402	1.18	0.457	0.35	0.382	0.256	0.273	0.28	0.365	0.251	0.405	0.536	0.537	0.427	0.322
HipAcid	55.5	42.6	34.3	60.7	33.5	85.9	24.8	32.7	37.3	42	61.8	65	36.3	68.3	89.6	42.5	29.5	61.1	32	38.7	45.3	46.7	28.8	19.2	35.2	80	24.1	38.9	47.4	30.9	23.2	28.7	34.3	38	42.8	45.6	32.4	45.8	32.7	30.8	168	47.1	60.8	46	43.4	38.4	28.8	58	72.2	46.5	64	46.4	26.1	79.3	42.5	56.4	30.6	31.3	50.7	25	20.3	28.7	57.8	32.3	59.1	40.1	23.5	31.5	21.5	33.6	28.3	25	34.1	19.1	56.7	46.4	70.5	25.6	39.8	36.4
Lac	534	580	413	381	327	531	296	408	511	398	400	339	621	501	365	466	314	516	337	353	399	526	537	320	427	552	553	418	327	411	278	398	632	327	316	314	333	714	308	349	658	468	602	551	585	500	372	314	618	339	420	302	479	512	364	291	315	381	466	343	323	382	341	472	605	372	516	332	390	349	425	365	1373	420	370	423	399	639	372	385
OH-GlutAcid	0.732	0.938	0.798	1	0.961	0.843	0.809	0.769	0.633	0.798	0.768	0.922	0.827	0.85	0.608	0.916	0.896	0.806	0.955	0.916	0.659	1	1.14	0.784	0.997	1.02	0.976	0.764	0.787	0.647	0.724	0.817	1.15	0.834	0.753	0.591	0.808	0.72	0.488	0.969	1.23	0.738	0.739	1.03	1.21	0.834	0.64	0.777	0.962	0.65	1.03	0.567	0.649	0.731	0.581	0.638	0.875	0.668	0.972	0.773	0.712	0.797	0.6	1.08	0.72	0.918	1.18	0.681	0.823	0.602	0.616	0.765	0.772	0.877	0.737	0.645	0.783	0.753	0.759	0.859
Suc	3.54	4.28	3.18	3.1	3.34	2.76	2.92	3.15	2.85	3.07	3.58	3.62	3.26	3.66	2.56	3.68	3.35	2.98	2.84	4.12	3.16	3.93	3.18	3.41	2.97	4.27	3.02	3.19	3.02	2.89	2.96	3.21	3.27	2.86	3.36	2.14	3.31	3.13	1.96	4.36	3.6	3.11	3.33	4.45	3.07	3.28	2.7	2.75	3.88	2.08	3.05	2.66	2.1	2.38	2.23	2.56	3.55	2.95	4.08	3.57	3.2	3.49	3.15	3.1	2.94	3.55	3.48	3.3	3.63	2.24	2.31	3.4	3.32	3.79	3.33	2.98	3.46	3.39	3.4	3.68
Ind-SO4	2.6	2.15	2.3	1.62	2.24	2.05	1.17	1.62	1.88	1.38	2.96	2.76	2.26	2.57	1.6	2.73	2.65	3.36	0.727	2.82	2.09	1.82	1	3.24	1.5	3.3	0.938	3.01	2.64	2.83	2.33	2.55	1.34	2.11	2.68	3.5	2.19	1.92	1.59	2.57	0.86	2.58	1.43	2.15	1.06	1.88	2.38	1.49	2.35	2.39	1.17	2.26	2.41	2.15	1.98	1.74	2.81	2.65	2.9	1.53	2	2.23	1.55	1.15	3.42	2.96	1.35	2.09	1.96	2.81	2.86	2.14	2.23	3.73	2.74	2.53	3.36	2.72	2.59	2.5
p-Cresol-SO4	38.8	37.2	40.5	45.1	37	50.6	16.8	46.2	35.9	25.3	50.7	45	45.1	55.3	26.1	44.7	55.9	79	10.4	77.9	55	35.1	25.2	59.3	42.7	71.3	27	50.2	43.4	52.8	36.6	61.2	37.5	28.3	44	67	41.6	48.8	33.2	47.5	29.7	45.7	26.3	51.8	44.2	44.5	42	21	68.2	46.8	23.2	46.5	31.2	55.6	63.9	50.8	67.7	52.2	53.6	21.9	51.6	40.6	25.5	40.8	60.9	65.1	56	64.7	46.1	74.8	64.3	30	62.7	60.9	49.2	69.6	42.2	73	59.2	56.4
AbsAcid	0.011	0.011	0.009	0.008	0.006	0	0.017	0.014	0.007	0.006	0.024	0.006	0.013	0	0.019	0.013	0.011	0.008	0.05	0.011	0.008	0.012	0.033	0.006	0.022	0.006	0	0.015	0.024	0.007	0.018	0.015	0.018	0.006	0.012	0.029	0.012	0.006	0.025	0.014	0.041	0.008	0.015	0.013	0.019	0.012	0.021	0.011	0	0.029	0.03	0.022	0.029	0.011	0.016	0.029	0.011	0.012	0.012	0.006	0.006	0.007	0.02	0.031	0.006	0.006	0.066	0.012	0.014	0.011	0.023	0.005	0.011	0.007	0.011	0.009	0.006	0.013	0.008	0.015
DHEAS	1.63	1.69	1.55	1.62	1.68	1.55	1.51	1.53	1.58	1.7	1.58	1.57	1.57	1.7	1.55	1.62	1.64	1.52	1.35	1.6	1.54	1.61	1.31	1.63	1.3	1.72	1.3	1.71	1.51	1.53	1.43	1.45	1.24	1.58	1.56	1.41	1.6	1.65	1.58	1.6	1.36	1.54	1.7	1.62	1.29	1.68	1.75	1.62	1.61	1.64	1.33	1.6	1.47	1.52	1.45	1.52	1.68	1.56	1.66	1.57	1.65	1.54	1.53	1.39	1.64	1.67	1.38	1.65	1.59	1.48	1.5	1.61	1.69	1.52	1.67	1.45	1.57	1.63	1.56	1.5
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name
CA
CDCA
DCA
GCA
GCDCA
GDCA
GLCA
GLCAS
TCA
TCDCA
TDCA
TLCA
AA
DHA
EPA
FA(12:0)
FA(14:0)
FA(16:0)
FA(18:0)
FA(18:1)
FA(18:2)
FA(20:1)
FA(20:2)
FA(20:3)
AconAcid
DiCA(12:0)
HipAcid
Lac
OH-GlutAcid
Suc
Ind-SO4
p-Cresol-SO4
AbsAcid
DHEAS
METABOLITES_END
#END