#METABOLOMICS WORKBENCH shuohan_20210206_090454 DATATRACK_ID:2456 STUDY_ID:ST001683 ANALYSIS_ID:AN002749 PROJECT_ID:PR001082
VERSION             	1
CREATED_ON             	February 8, 2021, 12:16 pm
#PROJECT
PR:PROJECT_TITLE                 	A gut microbe-focused metabolomics pipeline enables mechanistic interrogation of
PR:PROJECT_TITLE                 	microbiome metabolism.
PR:PROJECT_SUMMARY               	Gut microbes modulate host phenotypes and are associated with numerous health
PR:PROJECT_SUMMARY               	effects in humans, ranging from cancer immunotherapy response to metabolic
PR:PROJECT_SUMMARY               	disease and obesity. However, difficulty in accurate and high-throughput
PR:PROJECT_SUMMARY               	functional analysis of human gut microbes has hindered defining mechanistic
PR:PROJECT_SUMMARY               	connections between individual microbial strains and host phenotypes. One key
PR:PROJECT_SUMMARY               	way the gut microbiome influences host physiology is through the production of
PR:PROJECT_SUMMARY               	small molecules hindered by limited tools calibrated to detect products of
PR:PROJECT_SUMMARY               	anaerobic biochemistry in the gut. Here we construct a microbiome-focused,
PR:PROJECT_SUMMARY               	integrated mass-spectrometry pipeline to accelerate the identification of
PR:PROJECT_SUMMARY               	microbiota-dependent metabolites (MDMs) in diverse sample types. We report the
PR:PROJECT_SUMMARY               	metabolic profiles of 178 gut microbe strains using our library of 833
PR:PROJECT_SUMMARY               	metabolites. Leveraging this metabolomics resource we establish deviations in
PR:PROJECT_SUMMARY               	the relationships between phylogeny and metabolism, use machine learning to
PR:PROJECT_SUMMARY               	discover novel metabolism in Bacteroides, and employ comparative genomics-based
PR:PROJECT_SUMMARY               	discovery of candidate biochemical pathways. MDMs can be detected in diverse
PR:PROJECT_SUMMARY               	body fluids in gnotobiotic and conventional mice and traced back to
PR:PROJECT_SUMMARY               	corresponding metabolomic profiles of cultured bacteria. Collectively, our
PR:PROJECT_SUMMARY               	microbiome-focused metabolomics pipeline and interactive metabolomics profile
PR:PROJECT_SUMMARY               	explorer are a powerful tool for characterizing microbe and microbe-host
PR:PROJECT_SUMMARY               	interactions.
PR:INSTITUTE                     	Stanford University
PR:DEPARTMENT                    	Microbiology & Immunology
PR:LABORATORY                    	Justin Sonnenburg
PR:LAST_NAME                     	Han
PR:FIRST_NAME                    	Shuo
PR:ADDRESS                       	299 Campus Drive, Stanford, CA, 94305-5124, USA
PR:EMAIL                         	shuohan@stanford.edu
PR:PHONE                         	-
PR:PUBLICATIONS                  	not published, status to be updated
#STUDY
ST:STUDY_TITLE                   	A gut microbe-focused metabolomics pipeline enables mechanistic interrogation of
ST:STUDY_TITLE                   	microbiome metabolism.
ST:STUDY_SUMMARY                 	Gut microbes modulate host phenotypes and are associated with numerous health
ST:STUDY_SUMMARY                 	effects in humans, ranging from cancer immunotherapy response to metabolic
ST:STUDY_SUMMARY                 	disease and obesity. However, difficulty in accurate and high-throughput
ST:STUDY_SUMMARY                 	functional analysis of human gut microbes has hindered defining mechanistic
ST:STUDY_SUMMARY                 	connections between individual microbial strains and host phenotypes. One key
ST:STUDY_SUMMARY                 	way the gut microbiome influences host physiology is through the production of
ST:STUDY_SUMMARY                 	small molecules hindered by limited tools calibrated to detect products of
ST:STUDY_SUMMARY                 	anaerobic biochemistry in the gut. Here we construct a microbiome-focused,
ST:STUDY_SUMMARY                 	integrated mass-spectrometry pipeline to accelerate the identification of
ST:STUDY_SUMMARY                 	microbiota-dependent metabolites (MDMs) in diverse sample types. We report the
ST:STUDY_SUMMARY                 	metabolic profiles of 178 gut microbe strains using our library of 833
ST:STUDY_SUMMARY                 	metabolites. Leveraging this metabolomics resource we establish deviations in
ST:STUDY_SUMMARY                 	the relationships between phylogeny and metabolism, use machine learning to
ST:STUDY_SUMMARY                 	discover novel metabolism in Bacteroides, and employ comparative genomics-based
ST:STUDY_SUMMARY                 	discovery of candidate biochemical pathways. MDMs can be detected in diverse
ST:STUDY_SUMMARY                 	body fluids in gnotobiotic and conventional mice and traced back to
ST:STUDY_SUMMARY                 	corresponding metabolomic profiles of cultured bacteria. Collectively, our
ST:STUDY_SUMMARY                 	microbiome-focused metabolomics pipeline and interactive metabolomics profile
ST:STUDY_SUMMARY                 	explorer are a powerful tool for characterizing microbe and microbe-host
ST:STUDY_SUMMARY                 	interactions.
ST:INSTITUTE                     	Stanford University
ST:DEPARTMENT                    	Microbiology & Immunology
ST:LABORATORY                    	Justin Sonnenburg
ST:LAST_NAME                     	Han
ST:FIRST_NAME                    	Shuo
ST:ADDRESS                       	299 Campus Drive, Stanford, CA, 94305-5124, USA
ST:EMAIL                         	shuohan@stanford.edu
ST:PHONE                         	-
ST:PUBLICATIONS                  	not published, status to be updated
#SUBJECT
SU:SUBJECT_TYPE                  	Mammal
SU:SUBJECT_SPECIES               	Mus musculus
SU:TAXONOMY_ID                   	10090
SU:GENOTYPE_STRAIN               	Swiss Webster
SU:AGE_OR_AGE_RANGE              	10-14 weeks
SU:GENDER                        	Male
#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           	-	s0022	Experiment:community | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s0022
SUBJECT_SAMPLE_FACTORS           	-	s0029	Experiment:community | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s0029
SUBJECT_SAMPLE_FACTORS           	-	s0034	Experiment:community | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s0034
SUBJECT_SAMPLE_FACTORS           	-	s0054	Experiment:community | Sample_type:feces | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0054
SUBJECT_SAMPLE_FACTORS           	-	s0070	Experiment:community | Sample_type:feces | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0070
SUBJECT_SAMPLE_FACTORS           	-	s0082	Experiment:community | Sample_type:feces | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0082
SUBJECT_SAMPLE_FACTORS           	-	s0092	Experiment:community | Sample_type:feces | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0092
SUBJECT_SAMPLE_FACTORS           	-	s0100	Experiment:community | Sample_type:feces | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0100
SUBJECT_SAMPLE_FACTORS           	-	s0161	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0161
SUBJECT_SAMPLE_FACTORS           	-	s0162	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0162
SUBJECT_SAMPLE_FACTORS           	-	s0163	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0163
SUBJECT_SAMPLE_FACTORS           	-	s0167	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0167
SUBJECT_SAMPLE_FACTORS           	-	s0168	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0168
SUBJECT_SAMPLE_FACTORS           	-	s0169	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0169
SUBJECT_SAMPLE_FACTORS           	-	s0170	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0170
SUBJECT_SAMPLE_FACTORS           	-	s0171	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0171
SUBJECT_SAMPLE_FACTORS           	-	s0172	Experiment:community | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s0172
SUBJECT_SAMPLE_FACTORS           	-	s0176	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0176
SUBJECT_SAMPLE_FACTORS           	-	s0177	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0177
SUBJECT_SAMPLE_FACTORS           	-	s0178	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0178
SUBJECT_SAMPLE_FACTORS           	-	s0185	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0185
SUBJECT_SAMPLE_FACTORS           	-	s0186	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0186
SUBJECT_SAMPLE_FACTORS           	-	s0187	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0187
SUBJECT_SAMPLE_FACTORS           	-	s0194	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0194
SUBJECT_SAMPLE_FACTORS           	-	s0195	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0195
SUBJECT_SAMPLE_FACTORS           	-	s0196	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0196
SUBJECT_SAMPLE_FACTORS           	-	s0200	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0200
SUBJECT_SAMPLE_FACTORS           	-	s0201	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0201
SUBJECT_SAMPLE_FACTORS           	-	s0202	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0202
SUBJECT_SAMPLE_FACTORS           	-	s0212	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0212
SUBJECT_SAMPLE_FACTORS           	-	s0213	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0213
SUBJECT_SAMPLE_FACTORS           	-	s0214	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0214
SUBJECT_SAMPLE_FACTORS           	-	s0218	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0218
SUBJECT_SAMPLE_FACTORS           	-	s0219	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0219
SUBJECT_SAMPLE_FACTORS           	-	s0220	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0220
SUBJECT_SAMPLE_FACTORS           	-	s0227	Experiment:community | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s0227
SUBJECT_SAMPLE_FACTORS           	-	s0231	Experiment:community | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s0231
SUBJECT_SAMPLE_FACTORS           	-	s0236	Experiment:community | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s0236
SUBJECT_SAMPLE_FACTORS           	-	s0245	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0245
SUBJECT_SAMPLE_FACTORS           	-	s0250	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0250
SUBJECT_SAMPLE_FACTORS           	-	s0254	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0254
SUBJECT_SAMPLE_FACTORS           	-	s0259	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0259
SUBJECT_SAMPLE_FACTORS           	-	s0272	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0272
SUBJECT_SAMPLE_FACTORS           	-	s0277	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0277
SUBJECT_SAMPLE_FACTORS           	-	s0281	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0281
SUBJECT_SAMPLE_FACTORS           	-	s0286	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0286
SUBJECT_SAMPLE_FACTORS           	-	s0290	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0290
SUBJECT_SAMPLE_FACTORS           	-	s0295	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0295
SUBJECT_SAMPLE_FACTORS           	-	s0304	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0304
SUBJECT_SAMPLE_FACTORS           	-	s0309	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0309
SUBJECT_SAMPLE_FACTORS           	-	s0314	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0314
SUBJECT_SAMPLE_FACTORS           	-	s0355	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0355
SUBJECT_SAMPLE_FACTORS           	-	s0356	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0356
SUBJECT_SAMPLE_FACTORS           	-	s0357	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0357
SUBJECT_SAMPLE_FACTORS           	-	s0358	Experiment:community | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s0358
SUBJECT_SAMPLE_FACTORS           	-	s0359	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0359
SUBJECT_SAMPLE_FACTORS           	-	s0360	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0360
SUBJECT_SAMPLE_FACTORS           	-	s0361	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0361
SUBJECT_SAMPLE_FACTORS           	-	s0362	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0362
SUBJECT_SAMPLE_FACTORS           	-	s0363	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0363
SUBJECT_SAMPLE_FACTORS           	-	s0364	Experiment:community | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s0364
SUBJECT_SAMPLE_FACTORS           	-	s0365	Experiment:community | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s0365
SUBJECT_SAMPLE_FACTORS           	-	s0366	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0366
SUBJECT_SAMPLE_FACTORS           	-	s0367	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0367
SUBJECT_SAMPLE_FACTORS           	-	s0368	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0368
SUBJECT_SAMPLE_FACTORS           	-	s0369	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0369
SUBJECT_SAMPLE_FACTORS           	-	s0370	Experiment:community | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s0370
SUBJECT_SAMPLE_FACTORS           	-	s0371	Experiment:community | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s0371
SUBJECT_SAMPLE_FACTORS           	-	s0372	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0372
SUBJECT_SAMPLE_FACTORS           	-	s0373	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0373
SUBJECT_SAMPLE_FACTORS           	-	s0374	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	RAW_FILE_NAME=s0374
SUBJECT_SAMPLE_FACTORS           	-	s1001	Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1001
SUBJECT_SAMPLE_FACTORS           	-	s1002	Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1002
SUBJECT_SAMPLE_FACTORS           	-	s1003	Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1003
SUBJECT_SAMPLE_FACTORS           	-	s1004	Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1004
SUBJECT_SAMPLE_FACTORS           	-	s1005	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	RAW_FILE_NAME=s1005
SUBJECT_SAMPLE_FACTORS           	-	s1006	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	RAW_FILE_NAME=s1006
SUBJECT_SAMPLE_FACTORS           	-	s1007	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	RAW_FILE_NAME=s1007
SUBJECT_SAMPLE_FACTORS           	-	s1008	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	RAW_FILE_NAME=s1008
SUBJECT_SAMPLE_FACTORS           	-	s1009	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	RAW_FILE_NAME=s1009
SUBJECT_SAMPLE_FACTORS           	-	s1010	Experiment:mono-colonization | Sample_type:feces | Colonization:Cs	RAW_FILE_NAME=s1010
SUBJECT_SAMPLE_FACTORS           	-	s1011	Experiment:mono-colonization | Sample_type:feces | Colonization:Cs	RAW_FILE_NAME=s1011
SUBJECT_SAMPLE_FACTORS           	-	s1012	Experiment:mono-colonization | Sample_type:feces | Colonization:Cs	RAW_FILE_NAME=s1012
SUBJECT_SAMPLE_FACTORS           	-	s1013	Experiment:mono-colonization | Sample_type:feces | Colonization:Cs	RAW_FILE_NAME=s1013
SUBJECT_SAMPLE_FACTORS           	-	s1014	Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1014
SUBJECT_SAMPLE_FACTORS           	-	s1015	Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1015
SUBJECT_SAMPLE_FACTORS           	-	s1016	Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1016
SUBJECT_SAMPLE_FACTORS           	-	s1017	Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1017
SUBJECT_SAMPLE_FACTORS           	-	s1018	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	RAW_FILE_NAME=s1018
SUBJECT_SAMPLE_FACTORS           	-	s1019	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	RAW_FILE_NAME=s1019
SUBJECT_SAMPLE_FACTORS           	-	s1020	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	RAW_FILE_NAME=s1020
SUBJECT_SAMPLE_FACTORS           	-	s1021	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	RAW_FILE_NAME=s1021
SUBJECT_SAMPLE_FACTORS           	-	s1022	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	RAW_FILE_NAME=s1022
SUBJECT_SAMPLE_FACTORS           	-	s1023	Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs	RAW_FILE_NAME=s1023
SUBJECT_SAMPLE_FACTORS           	-	s1024	Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs	RAW_FILE_NAME=s1024
SUBJECT_SAMPLE_FACTORS           	-	s1025	Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs	RAW_FILE_NAME=s1025
SUBJECT_SAMPLE_FACTORS           	-	s1026	Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs	RAW_FILE_NAME=s1026
SUBJECT_SAMPLE_FACTORS           	-	s1027	Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1027
SUBJECT_SAMPLE_FACTORS           	-	s1028	Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1028
SUBJECT_SAMPLE_FACTORS           	-	s1029	Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1029
SUBJECT_SAMPLE_FACTORS           	-	s1030	Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1030
SUBJECT_SAMPLE_FACTORS           	-	s1031	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	RAW_FILE_NAME=s1031
SUBJECT_SAMPLE_FACTORS           	-	s1032	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	RAW_FILE_NAME=s1032
SUBJECT_SAMPLE_FACTORS           	-	s1033	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	RAW_FILE_NAME=s1033
SUBJECT_SAMPLE_FACTORS           	-	s1034	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	RAW_FILE_NAME=s1034
SUBJECT_SAMPLE_FACTORS           	-	s1035	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	RAW_FILE_NAME=s1035
SUBJECT_SAMPLE_FACTORS           	-	s1036	Experiment:mono-colonization | Sample_type:serum | Colonization:Cs	RAW_FILE_NAME=s1036
SUBJECT_SAMPLE_FACTORS           	-	s1037	Experiment:mono-colonization | Sample_type:serum | Colonization:Cs	RAW_FILE_NAME=s1037
SUBJECT_SAMPLE_FACTORS           	-	s1038	Experiment:mono-colonization | Sample_type:serum | Colonization:Cs	RAW_FILE_NAME=s1038
SUBJECT_SAMPLE_FACTORS           	-	s1039	Experiment:mono-colonization | Sample_type:serum | Colonization:Cs	RAW_FILE_NAME=s1039
SUBJECT_SAMPLE_FACTORS           	-	s1040	Experiment:mono-colonization | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1040
SUBJECT_SAMPLE_FACTORS           	-	s1041	Experiment:mono-colonization | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1041
SUBJECT_SAMPLE_FACTORS           	-	s1042	Experiment:mono-colonization | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1042
SUBJECT_SAMPLE_FACTORS           	-	s1043	Experiment:mono-colonization | Sample_type:urine | Colonization:Bt	RAW_FILE_NAME=s1043
SUBJECT_SAMPLE_FACTORS           	-	s1044	Experiment:mono-colonization | Sample_type:urine | Colonization:Bt	RAW_FILE_NAME=s1044
SUBJECT_SAMPLE_FACTORS           	-	s1045	Experiment:mono-colonization | Sample_type:urine | Colonization:Bt	RAW_FILE_NAME=s1045
SUBJECT_SAMPLE_FACTORS           	-	s1046	Experiment:mono-colonization | Sample_type:urine | Colonization:Bt	RAW_FILE_NAME=s1046
SUBJECT_SAMPLE_FACTORS           	-	s1047	Experiment:mono-colonization | Sample_type:urine | Colonization:Cs	RAW_FILE_NAME=s1047
SUBJECT_SAMPLE_FACTORS           	-	s1048	Experiment:mono-colonization | Sample_type:urine | Colonization:Cs	RAW_FILE_NAME=s1048
SUBJECT_SAMPLE_FACTORS           	-	s1049	Experiment:mono-colonization | Sample_type:urine | Colonization:Cs	RAW_FILE_NAME=s1049
SUBJECT_SAMPLE_FACTORS           	-	s1050	Experiment:conventional | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1050
SUBJECT_SAMPLE_FACTORS           	-	s1051	Experiment:conventional | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1051
SUBJECT_SAMPLE_FACTORS           	-	s1052	Experiment:conventional | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1052
SUBJECT_SAMPLE_FACTORS           	-	s1053	Experiment:conventional | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1053
SUBJECT_SAMPLE_FACTORS           	-	s1054	Experiment:conventional | Sample_type:urine | Colonization:conventional	RAW_FILE_NAME=s1054
SUBJECT_SAMPLE_FACTORS           	-	s1055	Experiment:conventional | Sample_type:urine | Colonization:conventional	RAW_FILE_NAME=s1055
SUBJECT_SAMPLE_FACTORS           	-	s1056	Experiment:conventional | Sample_type:urine | Colonization:conventional	RAW_FILE_NAME=s1056
SUBJECT_SAMPLE_FACTORS           	-	s1057	Experiment:conventional | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1057
SUBJECT_SAMPLE_FACTORS           	-	s1058	Experiment:conventional | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1058
SUBJECT_SAMPLE_FACTORS           	-	s1059	Experiment:conventional | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1059
SUBJECT_SAMPLE_FACTORS           	-	s1060	Experiment:conventional | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1060
SUBJECT_SAMPLE_FACTORS           	-	s1061	Experiment:conventional | Sample_type:serum | Colonization:conventional	RAW_FILE_NAME=s1061
SUBJECT_SAMPLE_FACTORS           	-	s1062	Experiment:conventional | Sample_type:serum | Colonization:conventional	RAW_FILE_NAME=s1062
SUBJECT_SAMPLE_FACTORS           	-	s1063	Experiment:conventional | Sample_type:serum | Colonization:conventional	RAW_FILE_NAME=s1063
SUBJECT_SAMPLE_FACTORS           	-	s1064	Experiment:conventional | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1064
SUBJECT_SAMPLE_FACTORS           	-	s1065	Experiment:conventional | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1065
SUBJECT_SAMPLE_FACTORS           	-	s1066	Experiment:conventional | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1066
SUBJECT_SAMPLE_FACTORS           	-	s1067	Experiment:conventional | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1067
SUBJECT_SAMPLE_FACTORS           	-	s1068	Experiment:conventional | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1068
SUBJECT_SAMPLE_FACTORS           	-	s1069	Experiment:conventional | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1069
SUBJECT_SAMPLE_FACTORS           	-	s1070	Experiment:conventional | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1070
SUBJECT_SAMPLE_FACTORS           	-	s1071	Experiment:conventional | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1071
SUBJECT_SAMPLE_FACTORS           	-	s1072	Experiment:conventional | Sample_type:caecal | Colonization:conventional	RAW_FILE_NAME=s1072
SUBJECT_SAMPLE_FACTORS           	-	s1073	Experiment:conventional | Sample_type:caecal | Colonization:conventional	RAW_FILE_NAME=s1073
SUBJECT_SAMPLE_FACTORS           	-	s1074	Experiment:conventional | Sample_type:caecal | Colonization:conventional	RAW_FILE_NAME=s1074
SUBJECT_SAMPLE_FACTORS           	-	s1075	Experiment:conventional | Sample_type:feces | Colonization:conventional	RAW_FILE_NAME=s1075
SUBJECT_SAMPLE_FACTORS           	-	s1076	Experiment:conventional | Sample_type:feces | Colonization:conventional	RAW_FILE_NAME=s1076
SUBJECT_SAMPLE_FACTORS           	-	s1077	Experiment:conventional | Sample_type:feces | Colonization:conventional	RAW_FILE_NAME=s1077
SUBJECT_SAMPLE_FACTORS           	-	s1078	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1078
SUBJECT_SAMPLE_FACTORS           	-	s1079	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1079
SUBJECT_SAMPLE_FACTORS           	-	s1080	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1080
SUBJECT_SAMPLE_FACTORS           	-	s1081	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1081
SUBJECT_SAMPLE_FACTORS           	-	s1082	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1082
SUBJECT_SAMPLE_FACTORS           	-	s1083	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1083
SUBJECT_SAMPLE_FACTORS           	-	s1084	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1084
SUBJECT_SAMPLE_FACTORS           	-	s1085	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1085
SUBJECT_SAMPLE_FACTORS           	-	s1086	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1086
SUBJECT_SAMPLE_FACTORS           	-	s1087	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1087
SUBJECT_SAMPLE_FACTORS           	-	s1088	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1088
SUBJECT_SAMPLE_FACTORS           	-	s1089	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1089
SUBJECT_SAMPLE_FACTORS           	-	s1090	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1090
SUBJECT_SAMPLE_FACTORS           	-	s1091	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1091
SUBJECT_SAMPLE_FACTORS           	-	s1092	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1092
SUBJECT_SAMPLE_FACTORS           	-	s1093	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1093
SUBJECT_SAMPLE_FACTORS           	-	s1094	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1094
SUBJECT_SAMPLE_FACTORS           	-	s1095	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1095
SUBJECT_SAMPLE_FACTORS           	-	s1096	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1096
SUBJECT_SAMPLE_FACTORS           	-	s1097	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1097
SUBJECT_SAMPLE_FACTORS           	-	s1098	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1098
SUBJECT_SAMPLE_FACTORS           	-	s1099	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1099
SUBJECT_SAMPLE_FACTORS           	-	s1100	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1100
SUBJECT_SAMPLE_FACTORS           	-	s1101	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1101
SUBJECT_SAMPLE_FACTORS           	-	s1102	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1102
SUBJECT_SAMPLE_FACTORS           	-	s1103	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1103
SUBJECT_SAMPLE_FACTORS           	-	s1104	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1104
SUBJECT_SAMPLE_FACTORS           	-	s1105	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1105
SUBJECT_SAMPLE_FACTORS           	-	s1106	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1106
SUBJECT_SAMPLE_FACTORS           	-	s1107	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1107
SUBJECT_SAMPLE_FACTORS           	-	s1108	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1108
SUBJECT_SAMPLE_FACTORS           	-	s1109	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1109
SUBJECT_SAMPLE_FACTORS           	-	s1110	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1110
SUBJECT_SAMPLE_FACTORS           	-	s1111	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1111
SUBJECT_SAMPLE_FACTORS           	-	s1112	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1112
SUBJECT_SAMPLE_FACTORS           	-	s1113	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1113
SUBJECT_SAMPLE_FACTORS           	-	s1114	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1114
SUBJECT_SAMPLE_FACTORS           	-	s1115	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1115
SUBJECT_SAMPLE_FACTORS           	-	s1116	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1116
SUBJECT_SAMPLE_FACTORS           	-	s1117	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1117
SUBJECT_SAMPLE_FACTORS           	-	s1118	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1118
SUBJECT_SAMPLE_FACTORS           	-	s1119	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1119
SUBJECT_SAMPLE_FACTORS           	-	s1120	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1120
SUBJECT_SAMPLE_FACTORS           	-	s1121	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1121
SUBJECT_SAMPLE_FACTORS           	-	s1122	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1122
SUBJECT_SAMPLE_FACTORS           	-	s1123	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1123
SUBJECT_SAMPLE_FACTORS           	-	s1124	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1124
SUBJECT_SAMPLE_FACTORS           	-	s1125	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1125
SUBJECT_SAMPLE_FACTORS           	-	s1126	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1126
SUBJECT_SAMPLE_FACTORS           	-	s1127	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1127
SUBJECT_SAMPLE_FACTORS           	-	s1128	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1128
SUBJECT_SAMPLE_FACTORS           	-	s1129	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1129
SUBJECT_SAMPLE_FACTORS           	-	s1130	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1130
SUBJECT_SAMPLE_FACTORS           	-	s1131	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1131
SUBJECT_SAMPLE_FACTORS           	-	s1132	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1132
SUBJECT_SAMPLE_FACTORS           	-	s1133	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1133
SUBJECT_SAMPLE_FACTORS           	-	s1134	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1134
SUBJECT_SAMPLE_FACTORS           	-	s1135	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1135
SUBJECT_SAMPLE_FACTORS           	-	s1136	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1136
SUBJECT_SAMPLE_FACTORS           	-	s1137	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1137
SUBJECT_SAMPLE_FACTORS           	-	s1138	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1138
SUBJECT_SAMPLE_FACTORS           	-	s1139	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1139
SUBJECT_SAMPLE_FACTORS           	-	s1140	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1140
SUBJECT_SAMPLE_FACTORS           	-	s1141	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1141
SUBJECT_SAMPLE_FACTORS           	-	s1142	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1142
SUBJECT_SAMPLE_FACTORS           	-	s1143	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1143
SUBJECT_SAMPLE_FACTORS           	-	s1144	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1144
SUBJECT_SAMPLE_FACTORS           	-	s1145	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	RAW_FILE_NAME=s1145
SUBJECT_SAMPLE_FACTORS           	-	s1146	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1146
SUBJECT_SAMPLE_FACTORS           	-	s1147	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1147
SUBJECT_SAMPLE_FACTORS           	-	s1148	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1148
SUBJECT_SAMPLE_FACTORS           	-	s1149	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1149
SUBJECT_SAMPLE_FACTORS           	-	s1150	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	RAW_FILE_NAME=s1150
SUBJECT_SAMPLE_FACTORS           	-	s1151	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1151
SUBJECT_SAMPLE_FACTORS           	-	s1152	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1152
SUBJECT_SAMPLE_FACTORS           	-	s1153	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1153
SUBJECT_SAMPLE_FACTORS           	-	s1154	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1154
SUBJECT_SAMPLE_FACTORS           	-	s1155	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	RAW_FILE_NAME=s1155
SUBJECT_SAMPLE_FACTORS           	-	s1156	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1156
SUBJECT_SAMPLE_FACTORS           	-	s1157	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1157
SUBJECT_SAMPLE_FACTORS           	-	s1158	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1158
SUBJECT_SAMPLE_FACTORS           	-	s1159	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	RAW_FILE_NAME=s1159
SUBJECT_SAMPLE_FACTORS           	-	s1160	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1160
SUBJECT_SAMPLE_FACTORS           	-	s1161	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1161
SUBJECT_SAMPLE_FACTORS           	-	s1162	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1162
SUBJECT_SAMPLE_FACTORS           	-	s1163	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1163
SUBJECT_SAMPLE_FACTORS           	-	s1164	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	RAW_FILE_NAME=s1164
SUBJECT_SAMPLE_FACTORS           	-	s1165	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1165
SUBJECT_SAMPLE_FACTORS           	-	s1166	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1166
SUBJECT_SAMPLE_FACTORS           	-	s1167	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1167
SUBJECT_SAMPLE_FACTORS           	-	s1168	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1168
SUBJECT_SAMPLE_FACTORS           	-	s1169	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	RAW_FILE_NAME=s1169
SUBJECT_SAMPLE_FACTORS           	-	s1170	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1170
SUBJECT_SAMPLE_FACTORS           	-	s1171	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1171
SUBJECT_SAMPLE_FACTORS           	-	s1172	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1172
SUBJECT_SAMPLE_FACTORS           	-	s1173	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	RAW_FILE_NAME=s1173
SUBJECT_SAMPLE_FACTORS           	-	s1174	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1174
SUBJECT_SAMPLE_FACTORS           	-	s1175	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1175
SUBJECT_SAMPLE_FACTORS           	-	s1176	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1176
SUBJECT_SAMPLE_FACTORS           	-	s1177	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1177
SUBJECT_SAMPLE_FACTORS           	-	s1178	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	RAW_FILE_NAME=s1178
SUBJECT_SAMPLE_FACTORS           	-	s1179	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1179
SUBJECT_SAMPLE_FACTORS           	-	s1180	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1180
SUBJECT_SAMPLE_FACTORS           	-	s1181	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1181
SUBJECT_SAMPLE_FACTORS           	-	s1182	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1182
SUBJECT_SAMPLE_FACTORS           	-	s1183	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	RAW_FILE_NAME=s1183
SUBJECT_SAMPLE_FACTORS           	-	s1184	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1184
SUBJECT_SAMPLE_FACTORS           	-	s1185	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1185
SUBJECT_SAMPLE_FACTORS           	-	s1186	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1186
SUBJECT_SAMPLE_FACTORS           	-	s1187	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	RAW_FILE_NAME=s1187
SUBJECT_SAMPLE_FACTORS           	-	s1188	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1188
SUBJECT_SAMPLE_FACTORS           	-	s1189	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1189
SUBJECT_SAMPLE_FACTORS           	-	s1190	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1190
SUBJECT_SAMPLE_FACTORS           	-	s1191	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1191
SUBJECT_SAMPLE_FACTORS           	-	s1192	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	RAW_FILE_NAME=s1192
SUBJECT_SAMPLE_FACTORS           	-	s1193	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1193
SUBJECT_SAMPLE_FACTORS           	-	s1194	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1194
SUBJECT_SAMPLE_FACTORS           	-	s1195	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1195
SUBJECT_SAMPLE_FACTORS           	-	s1196	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1196
SUBJECT_SAMPLE_FACTORS           	-	s1197	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	RAW_FILE_NAME=s1197
#COLLECTION
CO:COLLECTION_SUMMARY            	For all experiments, mice were euthanized by CO2 asphyxiation nine days
CO:COLLECTION_SUMMARY            	(mono-colonization with Citrobacter portucalensis BEI HM-34 or Anaerostipes sp.
CO:COLLECTION_SUMMARY            	BEI HM-220) or four weeks (all other experiments) following colonization, and
CO:COLLECTION_SUMMARY            	four sample types (serum, urine, feces, and cecal contents) were harvested from
CO:COLLECTION_SUMMARY            	each mouse. Prior to euthanization, urine and feces were collected. Whole blood
CO:COLLECTION_SUMMARY            	was collected by cardiac puncture and serum was obtained using microcontainer
CO:COLLECTION_SUMMARY            	serum separator tubes from Becton Dickinson following manufacturer’s
CO:COLLECTION_SUMMARY            	instructions. The intact cecum was harvested and snap-frozen in liquid nitrogen.
CO:COLLECTION_SUMMARY            	A single cecal sample was harvested for mono-association and conventional
CO:COLLECTION_SUMMARY            	experiments, and three samples at three different sections of the cecum were
CO:COLLECTION_SUMMARY            	harvested for the defined-community experiment. All mouse experiments were
CO:COLLECTION_SUMMARY            	conducted under a protocol approved by the Stanford University Institutional
CO:COLLECTION_SUMMARY            	Animal Care and Use Committee.
CO:SAMPLE_TYPE                   	Feces;Urine;Serum;Cecal contents
#TREATMENT
TR:TREATMENT_SUMMARY             	Mouse experiments were performed on gnotobiotic Swiss Webster germ-free mice
TR:TREATMENT_SUMMARY             	(males, 10-14 weeks of age, n = 3-8 per group for all experiments) maintained in
TR:TREATMENT_SUMMARY             	aseptic isolators, and originally obtained from Taconic Bioscience. For
TR:TREATMENT_SUMMARY             	mono-association experiments, mice were colonized with Bacteroides
TR:TREATMENT_SUMMARY             	thetaiotaomicron VPI 5482, Clostridium sporogenes ATCC 15579, Citrobacter
TR:TREATMENT_SUMMARY             	portucalensis BEI HM-34, or Anaerostipes sp. BEI HM-220904a, by oral gavage (200
TR:TREATMENT_SUMMARY             	uL, ~1 x 107 CFU) and were maintained on a standard chow (LabDiet 5K67). For the
TR:TREATMENT_SUMMARY             	defined-community experiment, mice with a six-member community were colonized
TR:TREATMENT_SUMMARY             	with a 200 uL mixture consisting of equal volumes from saturated cultures of
TR:TREATMENT_SUMMARY             	Bacteroides thetaiotaomicron VPI 5482 (8.7 x 109 CFU), Clostridium sporogenes
TR:TREATMENT_SUMMARY             	ATCC 15579 (1.4 x 108 CFU), Edwardsiella tarda ATCC 23685 (3.6 x 1010 CFU),
TR:TREATMENT_SUMMARY             	Collinsella aerofaciens ATCC 25986 (1.4 x 109), Eubacterium rectale ATCC 33656
TR:TREATMENT_SUMMARY             	(6.9 x 106 CFU), and Parabacteroides distasonis ATCC 8503 (1.5 x 109 CFU). Mice
TR:TREATMENT_SUMMARY             	with a five-member community were colonized with all cultures mixed at the same
TR:TREATMENT_SUMMARY             	volumes as described above except for Clostridium sporogenes ATCC 15579, which
TR:TREATMENT_SUMMARY             	was not included. Successful colonization and stable community members were
TR:TREATMENT_SUMMARY             	determined by 16S amplicon sequencing of the V4 (515f, 806r) region of microbial
TR:TREATMENT_SUMMARY             	populations present in the feces and cecal contents from individual mice.
#SAMPLEPREP
SP:SAMPLEPREP_SUMMARY            	All samples were stored at -80oC until use, and were thawed on ice immediately
SP:SAMPLEPREP_SUMMARY            	before extraction. 200 µL of serum and bacterial supernatant samples were used
SP:SAMPLEPREP_SUMMARY            	for extraction directly without dilution. Urine samples were diluted 1:20 in
SP:SAMPLEPREP_SUMMARY            	LC-MS grade water (Fisher) to reach a final volume of 200 µL prior to
SP:SAMPLEPREP_SUMMARY            	extraction. Protein precipitation for bacterial, serum, and urine samples was
SP:SAMPLEPREP_SUMMARY            	conducted by adding 1 mL of extraction buffer (see composition below) in 100%
SP:SAMPLEPREP_SUMMARY            	methanol (LC-MS grade, Fisher) to 200 µL of each sample in a 2 mL 96-well
SP:SAMPLEPREP_SUMMARY            	microplate (Fisher), sealed with a silicone mat (Agilent), and vortexed to mix.
SP:SAMPLEPREP_SUMMARY            	For feces and cecal contents, ~ 20 mg of feces or cecal contents were added to ~
SP:SAMPLEPREP_SUMMARY            	20 mg of acid-washed glass beads (150-212 µm, Sigma) in a 2 mL autoclaved screw
SP:SAMPLEPREP_SUMMARY            	top vial. In the same vial, 600 µL of water (LC-MS grade, Fisher) and 600 µL
SP:SAMPLEPREP_SUMMARY            	of recovery buffer in 100% methanol (see composition below) were added. Fecal
SP:SAMPLEPREP_SUMMARY            	and cecal slurries were homogenized at 4oC using a Mini Beadbeater operating at
SP:SAMPLEPREP_SUMMARY            	3,500 oscillations per minute for 5 minutes. For all sample types, samples were
SP:SAMPLEPREP_SUMMARY            	subsequently incubated at room temperature for 5 minutes, followed by
SP:SAMPLEPREP_SUMMARY            	centrifugation at 5,000 x g for 10 minutes. Two 440 µL aliquots of the same
SP:SAMPLEPREP_SUMMARY            	supernatant were transferred to two separate 2 mL plates and dried under air in
SP:SAMPLEPREP_SUMMARY            	a Biotage TurboVap. One of these dried plates was sealed and archived at -80oC.
SP:SAMPLEPREP_SUMMARY            	The dried extracts were reconstituted in 200 µL reconstitution buffer (see
SP:SAMPLEPREP_SUMMARY            	composition below) in 50% methanol in water (v/v, LC-MS grade, Fisher) by
SP:SAMPLEPREP_SUMMARY            	vortexing at max speed for 5 seconds. Reconstituted sample extracts were
SP:SAMPLEPREP_SUMMARY            	centrifuged at 2,000 x g for 1 minute, and filtered through a 96-well Durapore
SP:SAMPLEPREP_SUMMARY            	PVDF 0.22-µm filter plate (Millipore) into in a 1 mL 96-well plate (Agilent) by
SP:SAMPLEPREP_SUMMARY            	centrifugation at 2,000 x g for 10 minutes. Plates were then sealed with 96-well
SP:SAMPLEPREP_SUMMARY            	cap mats (Agilent) and stored at -80oC until LC-MS analysis. QC samples were
SP:SAMPLEPREP_SUMMARY            	generated by pooling 4 µL from each well of the experiment into a single
SP:SAMPLEPREP_SUMMARY            	designated well on the same plate for LC-MS analysis. The extraction buffer
SP:SAMPLEPREP_SUMMARY            	consisted of 4-Chloro-phenylalanine (6.8 µM, Carbosynth), Tridecanoic acid (6.8
SP:SAMPLEPREP_SUMMARY            	µM, Sigma), and 2-Flurophenylglycine (3.4 µM, SCBT) in 100% methanol. The
SP:SAMPLEPREP_SUMMARY            	reconstitution buffer included the internal standards:
SP:SAMPLEPREP_SUMMARY            	Phenylalanine-2,3,4,5,6-d5 (12.5 µM, CIL), Glucose-1,2,3,4,5,6,6-d7 (25 µM,
SP:SAMPLEPREP_SUMMARY            	CIL), Methionine-methyl-d3 (12.5 µM, CIL), 4-Hydroxyphenyl-d4-alanine (3.125
SP:SAMPLEPREP_SUMMARY            	µM, CDN), Tryptophan-2,4,5,6,7-d5 (12.5 µM, CDN), Leucine-5,5,5-d3 (12.5 µM,
SP:SAMPLEPREP_SUMMARY            	CDN), N-Benzoyl-d5-glycine (6.25 µM, CDN), 4-Bromo-phenylalanine (12.5 µM,
SP:SAMPLEPREP_SUMMARY            	Sigma), Progesterone-d9 (3.125 µM, CIL), Di-N-octyl phthalate-3,4,5,6-d4 (12.5
SP:SAMPLEPREP_SUMMARY            	µM, CDN), d19-Decanoic acid (12.5 µM, CDN), d15-Octanoic acid (25 µM, CDN),
SP:SAMPLEPREP_SUMMARY            	Indole-2,4,5,6,7-d5-3-acetic acid (12.5 µM, CDN), Carnitine-trimethyl-d9 (3.125
SP:SAMPLEPREP_SUMMARY            	µM, CDN), and d27-Tetradecanoic acid (12.5 µM, CDN), in 50% methanol in water.
SP:SAMPLEPREP_SUMMARY            	The final concentration for each internal standard in these buffers was
SP:SAMPLEPREP_SUMMARY            	determined by choosing a concentration falling within its linear dynamic range
SP:SAMPLEPREP_SUMMARY            	as measured by each analytical method.
#CHROMATOGRAPHY
CH:CHROMATOGRAPHY_SUMMARY        	Published HILIC method was implemented with minor modifications. The HILIC
CH:CHROMATOGRAPHY_SUMMARY        	(Hydrophilic Interaction Liquid Chromatography) positive method (ESI+) used
CH:CHROMATOGRAPHY_SUMMARY        	mobile phase solvents (LC-MS grade) consisting of 0.125% formic acid and 10 mM
CH:CHROMATOGRAPHY_SUMMARY        	ammonium formate (Sigma) in water at pH 3 (A) and 0.125% formic acid in 10 mM
CH:CHROMATOGRAPHY_SUMMARY        	ammonium formate in 95:5 v/v acetonitrile:water (B). The gradient profile was
CH:CHROMATOGRAPHY_SUMMARY        	held at 100% B for 2 minutes, from 100% B to 70% B in 5 minutes, holding at 70%
CH:CHROMATOGRAPHY_SUMMARY        	B for 0.7 minute, from 70% B to 40% B for 1.3 minutes, holding at 40% B for 0.5
CH:CHROMATOGRAPHY_SUMMARY        	minutes, from 40% B to 30% B for 0.75 minutes, before returning to 100% B for
CH:CHROMATOGRAPHY_SUMMARY        	2.5 minutes and holding at 100% B for 4 minutes. The flow rate was 400 µL per
CH:CHROMATOGRAPHY_SUMMARY        	minute. The sample injection volume was 3 µL. LC separations were made at 40oC
CH:CHROMATOGRAPHY_SUMMARY        	on separate columns fitted with a Vanguard pre-column of the same composition
CH:CHROMATOGRAPHY_SUMMARY        	dedicated to each analytical method: Waters Acquity BEH Amide 1.7 µm particle
CH:CHROMATOGRAPHY_SUMMARY        	size, 2.1 mm id x 150 mm length. Data were collected at a mass range of 70-1000
CH:CHROMATOGRAPHY_SUMMARY        	m/z at an acquisition rate of 2 spectra per second. Specific ion source
CH:CHROMATOGRAPHY_SUMMARY        	parameters included Fragmentor (140V), Gas Temp (250oC), Sheath Gas Temp
CH:CHROMATOGRAPHY_SUMMARY        	(200oC), and VCap (4000V).
CH:CHROMATOGRAPHY_TYPE           	HILIC
CH:INSTRUMENT_NAME               	Agilent qTOF 6545
CH:COLUMN_NAME                   	Waters Acquity BEH Amide (150 x 2.1mm, 1.7um)
#ANALYSIS
AN:ANALYSIS_TYPE                 	MS
#MS
MS:INSTRUMENT_NAME               	Agilent qTOF 6545
MS:INSTRUMENT_TYPE               	QTOF
MS:MS_TYPE                       	ESI
MS:ION_MODE                      	POSITIVE
MS:MS_COMMENTS                   	The MS-DIAL software (v. 3.83) was used for analyzing all in vitro and in vivo
MS:MS_COMMENTS                   	data on a per-experimental run and per-analytical method basis. QC samples from
MS:MS_COMMENTS                   	each experimental run were used for peak alignment. Chemical assignment of
MS:MS_COMMENTS                   	molecular features in samples was performed by comparison of recorded RT and m/z
MS:MS_COMMENTS                   	information to our reference library constructed from authentic standards.
MS:MS_COMMENTS                   	Tolerance windows were set to 0.1 minute RT and 0.01 Da m/z for the C18 methods
MS:MS_COMMENTS                   	and 0.2 minute RT and 0.01 Da m/z for the HILIC method. The minimal peak count
MS:MS_COMMENTS                   	(height) filter was set to 3000 for all experiments except for select
MS:MS_COMMENTS                   	experiments in which the MS exhibited reduced sensitivity. For experiments where
MS:MS_COMMENTS                   	detection of internal standards goes beyond the 0.1 (C18 methods) or 0.2 (HILIC
MS:MS_COMMENTS                   	method) window, RT correction of the mz-RT reference library was conducted prior
MS:MS_COMMENTS                   	to feature annotation in MS-DIAL. The MS-DIAL analysis generated a list of m/z,
MS:MS_COMMENTS                   	RT, and ion counts (area under the curve) for high-confidence annotations
MS:MS_COMMENTS                   	(matched to the reference library) as well as unknown molecular features. Based
MS:MS_COMMENTS                   	on the list of annotations for each experiment, each set of aligned peaks was
MS:MS_COMMENTS                   	manually checked using the MS-DIAL graphical user interface. Select metabolite
MS:MS_COMMENTS                   	features were removed from this list when: 1) two adjacent but distinct peaks
MS:MS_COMMENTS                   	were concurrently assigned to a single molecular feature, 2) odd curvature/shape
MS:MS_COMMENTS                   	of the peak led to integration of several “peaks” from separate sections of
MS:MS_COMMENTS                   	the same peak, or 3) features were only detected in blank controls. Annotated
MS:MS_COMMENTS                   	peaks that passed this inspection were reported in the final output file. After
MS:MS_COMMENTS                   	MS-DIAL analysis, data were analyzed with a set of custom bioinformatics
MS:MS_COMMENTS                   	pipelines. In short, these pipelines implemented a set of filtration and
MS:MS_COMMENTS                   	normalization procedures with the goal of reducing technical variability and
MS:MS_COMMENTS                   	controlling for batch effects.
#MS_METABOLITE_DATA
MS_METABOLITE_DATA:UNITS	Raw ion count (peak area)
MS_METABOLITE_DATA_START
Samples	s0022	s0029	s0034	s0054	s0070	s0082	s0092	s0100	s0161	s0162	s0163	s0167	s0168	s0169	s0170	s0171	s0172	s0176	s0177	s0178	s0185	s0186	s0187	s0194	s0195	s0196	s0200	s0201	s0202	s0212	s0213	s0214	s0218	s0219	s0220	s0227	s0231	s0236	s0245	s0250	s0254	s0259	s0272	s0277	s0281	s0286	s0290	s0295	s0304	s0309	s0314	s0355	s0356	s0357	s0358	s0359	s0360	s0361	s0362	s0363	s0364	s0365	s0366	s0367	s0368	s0369	s0370	s0371	s0372	s0373	s0374	s1001	s1002	s1003	s1004	s1005	s1006	s1007	s1008	s1009	s1010	s1011	s1012	s1013	s1014	s1015	s1016	s1017	s1018	s1019	s1020	s1021	s1022	s1023	s1024	s1025	s1026	s1027	s1028	s1029	s1030	s1031	s1032	s1033	s1034	s1035	s1036	s1037	s1038	s1039	s1040	s1041	s1042	s1043	s1044	s1045	s1046	s1047	s1048	s1049	s1050	s1051	s1052	s1053	s1054	s1055	s1056	s1057	s1058	s1059	s1060	s1061	s1062	s1063	s1064	s1065	s1066	s1067	s1068	s1069	s1070	s1071	s1072	s1073	s1074	s1075	s1076	s1077	s1078	s1079	s1080	s1081	s1082	s1083	s1084	s1085	s1086	s1087	s1088	s1089	s1090	s1091	s1092	s1093	s1094	s1095	s1096	s1097	s1098	s1099	s1100	s1101	s1102	s1103	s1104	s1105	s1106	s1107	s1108	s1109	s1110	s1111	s1112	s1113	s1114	s1115	s1116	s1117	s1118	s1119	s1120	s1121	s1122	s1123	s1124	s1125	s1126	s1127	s1128	s1129	s1130	s1131	s1132	s1133	s1134	s1135	s1136	s1137	s1138	s1139	s1140	s1141	s1142	s1143	s1144	s1145	s1146	s1147	s1148	s1149	s1150	s1151	s1152	s1153	s1154	s1155	s1156	s1157	s1158	s1159	s1160	s1161	s1162	s1163	s1164	s1165	s1166	s1167	s1168	s1169	s1170	s1171	s1172	s1173	s1174	s1175	s1176	s1177	s1178	s1179	s1180	s1181	s1182	s1183	s1184	s1185	s1186	s1187	s1188	s1189	s1190	s1191	s1192	s1193	s1194	s1195	s1196	s1197
Factors	Experiment:community | Sample_type:feces | Colonization:germ-free	Experiment:community | Sample_type:feces | Colonization:germ-free	Experiment:community | Sample_type:feces | Colonization:germ-free	Experiment:community | Sample_type:feces | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:feces | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:feces | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:feces | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:feces | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:germ-free	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:caecal | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:germ-free	Experiment:community | Sample_type:urine | Colonization:germ-free	Experiment:community | Sample_type:urine | Colonization:germ-free	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:urine | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:germ-free	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:germ-free	Experiment:community | Sample_type:serum | Colonization:germ-free	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:germ-free	Experiment:community | Sample_type:serum | Colonization:germ-free	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Cs_Bt_Ca_Er_Pd_Et	Experiment:community | Sample_type:serum | Colonization:Bt_Ca_Er_Pd_Et	Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	Experiment:mono-colonization | Sample_type:feces | Colonization:Bt	Experiment:mono-colonization | Sample_type:feces | Colonization:Cs	Experiment:mono-colonization | Sample_type:feces | Colonization:Cs	Experiment:mono-colonization | Sample_type:feces | Colonization:Cs	Experiment:mono-colonization | Sample_type:feces | Colonization:Cs	Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	Experiment:mono-colonization | Sample_type:caecal | Colonization:Bt	Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs	Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs	Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs	Experiment:mono-colonization | Sample_type:caecal | Colonization:Cs	Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	Experiment:mono-colonization | Sample_type:serum | Colonization:Bt	Experiment:mono-colonization | Sample_type:serum | Colonization:Cs	Experiment:mono-colonization | Sample_type:serum | Colonization:Cs	Experiment:mono-colonization | Sample_type:serum | Colonization:Cs	Experiment:mono-colonization | Sample_type:serum | Colonization:Cs	Experiment:mono-colonization | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization | Sample_type:urine | Colonization:Bt	Experiment:mono-colonization | Sample_type:urine | Colonization:Bt	Experiment:mono-colonization | Sample_type:urine | Colonization:Bt	Experiment:mono-colonization | Sample_type:urine | Colonization:Bt	Experiment:mono-colonization | Sample_type:urine | Colonization:Cs	Experiment:mono-colonization | Sample_type:urine | Colonization:Cs	Experiment:mono-colonization | Sample_type:urine | Colonization:Cs	Experiment:conventional | Sample_type:urine | Colonization:germ-free	Experiment:conventional | Sample_type:urine | Colonization:germ-free	Experiment:conventional | Sample_type:urine | Colonization:germ-free	Experiment:conventional | Sample_type:urine | Colonization:germ-free	Experiment:conventional | Sample_type:urine | Colonization:conventional	Experiment:conventional | Sample_type:urine | Colonization:conventional	Experiment:conventional | Sample_type:urine | Colonization:conventional	Experiment:conventional | Sample_type:serum | Colonization:germ-free	Experiment:conventional | Sample_type:serum | Colonization:germ-free	Experiment:conventional | Sample_type:serum | Colonization:germ-free	Experiment:conventional | Sample_type:serum | Colonization:germ-free	Experiment:conventional | Sample_type:serum | Colonization:conventional	Experiment:conventional | Sample_type:serum | Colonization:conventional	Experiment:conventional | Sample_type:serum | Colonization:conventional	Experiment:conventional | Sample_type:caecal | Colonization:germ-free	Experiment:conventional | Sample_type:caecal | Colonization:germ-free	Experiment:conventional | Sample_type:caecal | Colonization:germ-free	Experiment:conventional | Sample_type:caecal | Colonization:germ-free	Experiment:conventional | Sample_type:feces | Colonization:germ-free	Experiment:conventional | Sample_type:feces | Colonization:germ-free	Experiment:conventional | Sample_type:feces | Colonization:germ-free	Experiment:conventional | Sample_type:feces | Colonization:germ-free	Experiment:conventional | Sample_type:caecal | Colonization:conventional	Experiment:conventional | Sample_type:caecal | Colonization:conventional	Experiment:conventional | Sample_type:caecal | Colonization:conventional	Experiment:conventional | Sample_type:feces | Colonization:conventional	Experiment:conventional | Sample_type:feces | Colonization:conventional	Experiment:conventional | Sample_type:feces | Colonization:conventional	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:As	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:feces | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:As	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:caecal | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:As	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:urine | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:germ-free	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:As	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp	Experiment:mono-colonization_2 | Sample_type:serum | Colonization:Cp
1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID	116385	54814	36861	17345	14905	14800	21920	13814	166066	101639	100867	102111	73847	92310	83209	132410	138367	15390	21925	28441	20457	18414	18234	15873	13496	10749	15388	45031	12488	20043	24130	12579	18803	28573	72489																	60558	55082	54231	107675	47194	245	35685	52530	57754	73187	83009	86736	35315	51567	105	79866	75165	0	113	50177																											37251	38892	42062	58700	31029	31547	28152	51654	30348	30858	31345	32017	25861
1-HYDROXY-2-NAPHTHOIC ACID																																																																																																																																																																																					702	320	317	7355	838	7038	561	776	826	26715	27553	359	1279	432	264	2126
1-METHYLGUANIDINE																																																				29004	14639	7931	9127	20744	0	9216	9192	10563	8203	7819	22548	5953	14669	0	7430	16311	0	0	6172	12708	9846	9793	10180	20176	10822	14237	12744	13928	12769	12355	15817	14500	16571	17406	15898	16525	16593	19092	19292	17616	21687	14924	17968	19452	19471														76986	63346	48828	73078	54807	61479	58828	55174	53933	45293	2234692	2191664	2004288	1573146	895769	1176759	1054552	41964	40951	41151	39675	19516	23733	26160	109592	96437	122224	105097	94942	78137	114875	88859	130648	134156	117586	161224	178365	141040	738029	870878	729611	749697	697085	807912	758454	862120	862860	1001119	795468	972699	546163	706391	569448	572873	908347	966184	644899	667177	621444	967082	653684	924613	848578	918507	596461	998821	655636	681816	783925	659230	11974949	14900107	17848926	18158862	30746218	27546556	30960922	23634890	23029162	22560806	28522610	25637102	26609200	26525680	29239096	25019186	948578	456192	743336	776111	700156	710622	531193	978754	196811	1498052	936460	407855	512634	449973	456838	199359																													53357	36851	80430	73236	58477	71750	61636	61699	76923	51467	72155	60916	55924	70121
1-METHYLNICOTINAMIDE	102121	73166	99233	403862	165408	120157	115276	89904	99004	82503	83917	90602	79153	89907	135578	206911	194406	58139	72611	77578	528193	373258	449349	184879	176686	146766	112532	126373	107480	78805	75388	119430	71204	75952	69252																	215780	190989	255507	311874	243705	105	200153	157695	150408	169300	200675	159398	185384	123389	0	166813	300838	0	0	242287	677419	706166	520016	812384	776810	969702	1316243	1129201	1486710	824004	347429	263288	466670	820539	728699	599031	824265	679659	1198495	1599146	1025364	2345963	370904	892331	584886	350852	140580	184462	174106	186198	240124	119787	185499	164544	126899	217651	159441	156597	140264	5418150	7276284	6081880	10153178	7496330	5352136	7397082	5018702	9380138	7087325	8419710	8799144	11175789	9476162	6752804	7064061	5634910	192591	161897	192423	201484	334796	199814	248555	442569	437379	308396	506922	473670	493033	283136	574778	137398	146691	181915	165021	203039	241726	1408224	1728905	1494426	1409935	3767019	3811395	2204914	4170156	1765664	4974808	2756830	2362445	2669278	5687588	3867132	1366754	1463996	2029385	1572376	1412382	3147631	5236884	2674380	1847828	5539990	5574308	2599667	2269296	2950358	4840059	3231836	1520807	13624710	24131496	39349928	29007856	32610262	34129924	44072248	27965460	42254532	17301864	28003062	44059620	42630920	50463276	53363752	50501468	1291230	1011084	809049	1177899	1437978	1482058	1314111	1227078	1174305	1119508	1284630	1289466	786456	995233	1109656	678638	312858	300704	312887	426965	200505	259707	273163	581277	349354	1643535	1254684	1203117	1055507	837061	249916	227945	342250	418455	246708	172454	297328	718136	308916	1160617	1355057	1112478	1166794	887306	4182877	3142331	7868418	6606171	9649679	9611772	2829162	3210241	5275342	8211670	5327759	6421180	5308845	5549243	241324	273166	310875	229827	328341	395125	237001	253158	267665	417840	362725	304805	283974	250092
1-OLEOYL-RAC-GLYCEROL																																																				32850	15258	62353	116427	35286	0	26781	49466	38255	67527	90119	35294	27905	19828	0	80097	72812	116	0	56289																											442783	232751	261046	177459	202225	104406	221784	98974	156107	342978	305262	309002	216739																									3742	543	797	437	933	971	1807	1397	6741	9271	10786	16052	9558	10130																																																	587119	481663	409985	503746	791002	621352	790164	781648	950568	381844	640143	278736	215037	181412	244935	247546																																											225902	230274	268979	195913	219560	173633	232178	167254	189294	237137	167525	283212	250738	220268
1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE																																																																																																																																25860	38083	26920	17354	10071	41360	5404
1,3-DIAMINOPROPANE																																																																																																																																																					1351	4086	4849	1730	3229	7598	7844	4068	2822	5062	5733	207295	170319	146468	179310	84313	4617	4402	3615	3944	2404	3791	2759	2091	3397	9252	5788	268099	204496	83630	202708	149055
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE, 2-PHENYLACETAMIDE, N-BENZYLFORMAMIDE																																																																																																																									820	4241	4235	1992	14966	18466	29418	20741	21992	23176	25560	24862	35877	25341
2-AMINO-2-METHYLPROPANOIC ACID																																				47836	39650	33974	52387	42921	48988	49771	39445	36422	129049	41935	45093	35371	47587	37638	40461
2-AMINOPHENOL																																																																								23419	17677	14100	19936	27162	14632	17903	15203	26097	18660	18064	20388	17127	11274	15217	18163	13287	15776	13133	13417	17817	15868	16786	15076	14659	21151														14647	11937	9302	25561	17670	21593	22619	9719	14655	8281	45744	47902	34661	24906	58695	62328	60073								36186	37045	42302	38151	29900	28916	32736	37660	35213	30608	25972	23184	21070	22272																																	48712	68317	96219	81607	197145	192644	237834	149114	131042	120733	185766	93737	93608	105401	97433	88727																																													14548	14498	28332	22787	32211	35942	16063	20510	39509	11091	19856	16775	17800	22461
2-DEOXY-GLUCOSE, 6-DEOXY-GALACTOSE																																																																								37695	4021	4297	25298	1584	10102	5613	1544	2914	20201	6043	3965	9789	416	449	1776	721	567	832	2764	1614	828	634	523	146	338														1697	22295	1938	1385	2157	951	3788	669	446	990
2-METHOXYCINNAMALDEHYDE																																																				8598	17148	13039	19301	7249	3578	12848	12038	10317	15342	16424	5477	14054	4971	2847	12621	13264	3115	1454	12874																																																									22611	20224	19279	12035	14972	25771	8141															13403	76481	16558	18158	25949	23478	28084	25145	22075	22798	27061	31652	32433	30043	28402	27954	11731	12770	9044	16222	18536	26562	25040	16817	16776	34347	20844	20891	18070	16965	19456	13424	2478	3319	7303	9069	11968	14043	16589	10107	17363	8332	12891	7291	8843	11015	9071	9861	14546	19220	16758	16846	13802	14321	14650	14595	19747	6954	12293	12600	12102	13557	4939	14414
2'-DEOXYGUANOSINE 5'-MONOPHOSPHATE																																																				0	49749	103035	12688	73444	121	58765	393	109	108	142	126	0	11666	0	35712	5736	0	0	0																																																									0	0	0	0	6139	638	54084
25-HYDROXYCHOLESTEROL																																																				9186	14172	9668	16657	6837	0	6870	12456	10903	11026	12037	10735	11754	8450	0	12081	16165	0	0	11351																											24391	10771	11918	10778	16109	10329	12515	12250	12194	31400	30361	17645	13553
3-(4-HYDROXYPHENYL)PROPIONIC ACID, METHYL 4-HYDROXYPHENYLACETATE																																																																																																																																																																																																					7278	6986	12204	13907	9169	7734	13715	14876	14089	12287	10510	17815	27339	26648	25199	16708
3-AMINOISOBUTANOIC ACID																																				40903	37979	40299	45593	35852	44076	36299	37626	50183	26568	39280	45081	35167	52490	35920	37876
3-CHLORO-TYROSINE																																																																																																																																																																																					10495	15759	20392	14729	15874	16542	19729	16075	18948	16845	21369	21056	18001	20556	20642	19413	18566	24610	27785	24253	19433	20754	37754	27859	33243	29393	31469	19933	24489	27504	21040	28913
3-HYDROXYANTHRANILIC ACID, SALICYLHYDROXAMIC ACID																																																				1045	2247	7176	17359	807	123	1735	189	1101	15770	21780	20835	689	446	0	23258	19572	0	0	20014	11416	10687	12743	12504	11609	11109	13512	9438	12484	16889	20477	15894	13145	16231	23122	21341	16872	22580	23297	19507	24649	24852	21790	19165	23637	23299																																						23214	24047	29438	28163	13133	21134	22441	24229	22871	25888	25395	39509	20431	27163																																																	12514	7972	19183	12497	11619	13159	10283	19882	11496	28658	19335	13945	17905	24622	38321	15404
3-HYDROXYBUTYRIC ACID																																																																																																																																							2342	1988	830	1843	8600	4442	3716	1011	14008	16282	20202	8533	6324	11537
3-HYDROXYPHENYLACETIC ACID																																				8401	8877	8815	5536	5083	4886	2978	5029	5106	10094	6883	3815	6031	4515	9858	5135																					16694	11203	21836	17777	14529	15972	12614	15010	11957	13019	13031	11062	15437	29122	15353	14526	10308	14819	16499	11407	15131	16217	14466	13020	11460	14121														1793	2732	3237	3209	2595	1962	2515	2066	1862	1207	11051	7901	13720	12999	12182	5954	10801																																																																																																																																188401	203482	222606	197090	195336	158617	201574	189403	166428	186969	177553	229026	212820	190080
3-METHYLADENINE																																				21700	22750	26525	23950	26115	23112	19767	23334	31320	12184	24369	18574	34039	32222	25447	28711																																																																																																																																		56279	73080	94533	85078	155183	156901	190383	135988	115020	111998	140269	130387	151582	143617	147024	110552																																													16012	12379	27860	25533	22839	25997	22876	22523	26962	14556	27341	21457	23318	27352
3-METHYLSALICYLIC ACID																																																																																																																																																																																					15165	20110	13225	21138	36686	27307	35050	18190	19591	19307	30988	31037	26224	35229	27801	21824
3,5-DIMETHOXYPHENOL	2335	1021	1787	5391	6539	8735	4659	3554	4514	1779	3152	13252	2328	6849	2214	8571	2769	13854	3139	8484	5843	8295	2969	2139	2054	13548	8021	2880	2800	7846	7745	1680	10444	1700	960	7447	7281	9290	5223	6239	4975	8362	6107	6833	6325	6791	7167	7849	7485	4961	7648																																																												5163	3459	4817	3286	2482	3119	3632	2373	976	1657								18315	22686	17308	9138	16817	27135	19242	5069	6430	5768	7109	3421	5758	4434	6497	22590	6541	6295	4620	2616	3008	19297	15447	9152	13027	8844	11262	7824	4257	16704	10930	6587	25355	9270	15451	25533	14928	21806	21933	11097	7279	28316	16955	14629	4218	14824	16140	16033	21689	22679	17109	15171	17546																	9448	15312	9282	8309	10697	6011	13768	7923	26460	13781	9397	13155	14212	20048	14783	23258	6764	12156	6627	7388	7351	4752	1816	7693	6713	1639	5825	809	10134	13084																													10207	9281	9354	11048	10140	9985	9943	9599	8251	9312	11960	8314	11450	9975
4-ACETAMIDOPHENOL																																																																																																																									12050	12427	9758	9716	38863	17018	16023
4-GUANIDINOBUTANOIC ACID																																																																																																		199945	147954	129587	152009	92496	213371	107775	229496	96943	94495	117894	73954	69102	1684480	1557706	1192641	1883748	1563736	2035743	1834720	1272970	1684089	1143789	4760430	4729872	5040331	3314780	3703659	3178242	3029966	632602	552519	477048	334051	203592	439235	206394	1039078	1303554	1224184	1141630	743786	1043371	1142728	932879	59203	129572	90553	93465	148410	51470	1004856	1380302	1347469	959147	1323107	1493787	1502984	2003728	1647426	1568110	1944110	585658	421050	480899	454249	385400	1819974	1946804	1315762	1413061	1763510	1786869	1789277	1648428	2057171	2093743	1587759	1219685	927581	1015468	1045638	1139957	3896093	5677874	9136190	7437626	8512114	9098099	13627481	8015346	10401347	7835144	9846711	28114688	23592320	19367800	19212940	19801990	1115161	1048063	814442	622352	733260	667339	800312	1173759	788556	1733603	1188982	1148546	883525	1089672	778524	1235677	549589	639374	649123	681977	536012	513858	647910	959029	1005284	71470	269847	130768	212176	212992	733952	614049	655049	648241	589474	653303	620298	837171	720290	247543	315349	316078	305928	311186	1347391	991246	2180410	2120192	2325326	2655214	1348452	1501554	2083234	4968038	4603631	4720005	3621984	7352277
4-HYDROXYBENZALDEHYDE																																																																																																																																																																																					8037	14338	11209	16824	16370	16408	23117	18974	15646	14212	27030	16603	19158	11004	8780	13845
4-HYDROXYPROLINE																																																																																																																																							525425	284379	259367	387197	203136	370316	302009	361744	67424	112110	118142	125739	140551	151252
4-IMIDAZOLEACETIC ACID																																																																								6895	10070	8303	7225	7075	13251	21484	10624	21982	20545	24325	18723	26368	17117	16896	17395	13949	16455	18885	25119	17070	17727	35027	42183	30116	27232														361153	356509	318411	221533	227322	251806	267439	238349	354083	186395	768315	806519	749529	619561	432369	599732	394012								7407	8667	7408	12087	7944	10249	8991	11002	4374	2098	2655	23935	8030	9878																																	327062	483556	844346	686469	676581	725038	1209545	529258	746907	448047	678481	787147	1002341	1129210	1086688	1054304																																													126469	66196	242458	231615	259922	348926	93660	192222	223433	184095	142378	250970	209099	193168
4-VINYL PHENOL																																																																																																																																43220	39528	38070	23799	32862	52052	29467
5-HYDROXYINDOLE																																				9763	7951	9057	1535198	1357304	1556705	1658762	1252842	1164494	607955	1310438	1394251	1478818	1433683	1650597	1505294	23013	27957	58658	410	30421	0	29643	23347	24469	0	114	59741	24670	16819	0	0	0	0	0	40706																																								1476	1498	995	196830	120353	154525	144838	1262	1824	1155	3366	3045	3826	4796	1118489	906223	649488								3186	1772	1917	2710	1380	1949	2812	1763	13823	14256	13755	6510	16837	15110
5-HYDROXYLYSINE																																																																								21062	23012	13945	11746	25801	28107	29889	25451	24914	20568	15984	3742	19949	16336	27104	22347	23161	31422	33742	28803	24471	33681	19720	15789	15917	15522																																																				11456	14580	9110	14250	11716	11287	12585	17583	15512	14100	12251	15612	15272	14219	14345	11346	14864	18417	15156	17651	14024	14299	13656	19694	15493	19277	11913	26637	21237	16219	20618	17254																	14897	18262	16030	17115	18402	15079	16972	15609	16593	23267	20369	13618	15264	14105	12328	13201
5-METHOXY-3-INDOLEACETIC ACID	36226	13172	9360	10914	13665	5024	5083	5998	30868	20237	15700	18120	21234	28206	16526	11074	18797	17762	22827	19994	12409	20909	27898	16587	19895	11273	12142	13251	10486	10299	8264	7489	13663	13499	6521	16384	14476	15795	16365	14425	10798	16898	15776	17457	5814	24672	23546	25059	14735	22829	24749																					14353	16295	17050	15267	10552	19523	18289	16638	18391	37077	50719	20458	22828	97972	107146	168658	97964	178050	154437	140612	197016	130500	125650	125375	153112	187168														15361	14013	12052	8163	9762	12357	11361	9747	16873	6663	30561	32961	24818	21177	11908	12531	12248	5044	6480	6756	2726	6325	39153	7059	40113	35329	33313	49869	24381	25279	17982	27754	14285	14841	12998	10174	16861	10416	21338	31903	47578	17121	38909	51161	48394	62894	62140	37628	86050	25750	17656	32688	20011	23685	157307	95580	103196	52634	127282	91700	101049	89605	52070	64289	80155	172623	129820	142428	131932	137845	17997	34247	82235	75797	58147	68009	163772	56834	135110	50016	92016	127304	116624	70217	129062	91021																	9011	9131	15431	11352	9370	5919	18069	23260	23491	4168	17331	6870	9752	10718	19778	14906	15254	12766	21549	19039	21817	13078	17722	13852	22718	16992	16797	20515
5-METHYLCYTOSINE	24693	16187	7793	331	546	732	5371	2593	25552	22712	21574	19265	8201	15123	12686	18416	19780	821	3357	2767	611	2238	1165	2191	802	509	858	5535	3060	3535	820	1739	4320	1316	970	50604	62038	82835	92975	98328	87327	76553	87685	103605	46829	104189	84885	116981	97132	88197	90368																					68313	46265	91585	79652	7075	2572	5708	5190	1669	21171	16621	9028	8183	101533	66694	83980	61944	16820	14628	4717	3728	15905	21120	18204	25373	21768														54439	35032	26870	37850	37107	41724	40130	33025	48193	29794															131772	91654	116064	123326	154763	111285	146454	132753	19670	13793	14194	79022	18138	21218	248460	251461	201710	282506	175022	187951	198161	219908	250260	231405	173585	5918	7882	42415	36682	2691	214455	246607	167855	235544	174314	189173	185989	215001	251013	264433	176642	11952	61351	54236	61651	61718	116921	166711	228539	202168	257108	295258	346802	186244	198386	217564	250502	293535	282289	238709	254325	252311																	84511	91606	76853	78181	81105	87254	65316	60306	76691	23149	7266	17715	3802	12504	65017	69999	75579	78340	67388	73092	63221	73307	73650	6916	13508	5985	7174	19886	42900	41189	75597	77857	68584	89831	31775	57172	93610	39697	60702	58346	55006	56824
5-VALEROLACTONE	8117	13870	10442	14923	17268	19324	14273	13504	14821	6588	15462	25820	12455	13915	9136	10395	6290	22883	8937	16101	16517	22381	8531	11881	7555	22454	14551	10869	8559	16533	19304	12532	15424	12778	10491																	6550	66340	67480	17053	6547	4697	73743	13901	9964	26326	33400	25910	28422	7917	4969	29096	26323	2236	4807	24765	6448	21462	41632	10072	4382	23519	16012	10082	13112	26995	22316	23103	52387	2859	7859	11011	3572	15873	7963	9085	6198	4502	9442	9999	15549	26253																																						7287	12329	9794	9743	8231	9299	10901	8280	73676	16806	40954	19550	12176	57700	103470	119234	33859	60002	42399	39266	16932	22439	71409	22589	18958	77316	33257	51151	119343	67129	60329	58657	24964	19152	92064	61759	63905	22362	77795	69100	60932	47033	62300	60052	61837	25078																																	47148	51403	24486	48675	38553	41255	33358	35211	44546	44774	38546	46141	38985	34451	30538	46868	48503	34875	27320	43154	45393	42933	38339	42169	38792	42501	34394	34048	33413	28656	29411	27866	34655	39770	33147	25969	24005	21760	16234	22912	34478	31183
5,6-DIHYDRO THYMINE	13051	6058	4110	6637	11378	5664	6519	7203	27471	9282	6397	15181	12012	35230	26806	6794	11332	16141	30186	27596	4788	36828	50716	21763	32318	22742	14586	17949	12353	35906	15077	11917	29393	25284	11523																																					15641	14103	15521	10291	12577	22302	25500	21196	11697	40047	24390	23779	37590	70062	125677	137816	69859	107644	151212	98802	137638	95655	92934	97458	111604	137864																																						42729	29183	71991	20973	17877	9347	28703	13404	13770	18904	4866	18297	22437	6434																	166371	60056	50886	39063	76709	120615	110384	60034	49376	50926	58400	287201	163195	196138	118658	165986
8-AMINOOCTANOIC ACID																																																				296298	204439	177583	385465	229872	105	129424	159771	159720	248079	65758	304670	169212	215763	0	149432	374837	123	148	143919
ACETYL-CARNITINE	101800	49879	26104	128	490	1555	16329	2609	26292	27577	20834	18861	21541	29275	10124	22731	12841	113	579	364	223	109	259	563	887	888	5155	1230	228	1228	522	144	1279	1692	1399																	83600	28903	81355	208623	60166	0	15709	26199	48182	27513	281915	73503	8616	69798	101	93040	156100	1478	938	24770																																																		530049	526423	918604	2374782	828551	574621	617954	12431314	10355937	9668624	10891364	10458943	8257621	8452952	541441	67274	72929	71627	145253	80265	136348	93725	353379	65381	143518	22195	12670	17997	412655	328676	291349	459133	685026	539879	645880	651158	504172	669690	456910	103296	96027	69721	58327	240682	486152	650294	1909652	1062762	715770	1154652	877638	877243	843124	838040	802260	149063	138609	115065	170962	69524	802077	1201026	2637918	1061526	1797785	2857360	2165138	1327878	1760164	2080010	2445458	1707489	1819021	2166176	3261123	2390660	30795524	35988072	39290416	30574892	43541552	31980058	43570472	34727588	30428314	38485892	42968044	25563488	27705284	40880060	36853548	36686072	104338	158501	88259	104363	143324	160272	92194	129859	125720	33884	27448	23780	19579	23444	189510	243679	276426	203911	295898	142015	292559	355195	239400	158791	175709	287367	472345	108847	300793	173761	411220	851122	802114	1346285	528489	320049	452944	500904	387090	350751	319144	305893	5431134	6768562	6531162	8086096	5947429	7245398	6936128	7850950	8269414	6679869	6905308	5409756	5878080	4422503
ACETYLCHOLINE	99330	31194	11043	120167	104824	27530	80036	88271	34258	8947	8486	13107	13581	48996	19649	11385	23943	29374	51783	67725	22982	61984	54426	29512	41970	20238	41791	67696	19169	46674	40351	14494	60986	59533	60387																																																																																																																		138047	159145	122238	165535	130023	261816	292754	274341	360172	352727	287848	926422	559454	540743	550860	345011	373475	309834	603552	358689	413610	493511	521472	661150	388941	442663	263631	728789	661469	407050	676475	696973
ADENINE	2720	1525	1250	16916	19476	7310	18960	14080	6822	1202	1072	4289	2367	4690	5005	1863	927	16775	28594	28801	11445	23797	29859	13506	17375	16259	16572	27295	11443	20538	13937	10799	21924	26658	26684																																																																																						23306	26969	22212	8661	30687	25883	25145	2186	1149	3080	1870	60944	13801	94763															38649	29089	56619	33503	47944	75230	92831	148007	150797	27676	104020	186926	156061	52376	184708	60553	43542	25647	17217	22204	58219	203487	165230	226532	203906	189722	189820	230097	95621	176834	171558	186988
ADENOSINE																																				32473	23992	35537	30655	30057	29874	34037	20708	37487	13478	29749	34638	30829	41874	25754	28374																																																																																																																		4926	0	1675	0	1148	6373	820	4183	1101	2830	16841	93009	49625	47739	41487	6415	68068	73110	227092	167708	133756	139733	190088	139716	205515	67186	135110	190627	204451	213109	262985	225987																																													32684	10664	51639	36065	64271	74984	43837	41427	39633	36119	38456	30730	29837	44244
ADIPIC ACID	12891	33306	22698	33563	38662	40891	33787	33081	34591	12728	32915	56643	31452	29645	22565	28373	9906	55441	17616	33291	42966	54074	18622	30013	15059	42198	27706	24174	16852	42588	50578	37390	29655	25768	26964	67956	79771	65753	75164	90335	80968	66013	91741	50356	90568	75210	81526	60107	71576	78616	59832	62534	70057	91860	105423	66134	10772	73128	71169	65530	89172	114736	80501	77099	55874	11769	115468	102925	11735	11119	100959	7629	23566	57789	10004	8174	32614	20141	8325	12029	49284	25919	30941	74290	14522	15503	17506	13112	22236	19777	18594	15847	15408	22062	17548	21642	24313	14252	12527	12295	9869	10664	9655	11995	9956	11774	12423	11673	11538	12116	8407	11172	10525	9168	9060	8725	7047	7470	6051	7787	31069	35312	36604	37504	35395	43514	37357	19902	19609	22315	25090	28101	24777	27797	31595	33375	31547	32004	35907	40106	32289	33605	25828	29604	30707	31119	30773	11213	119330	152413	132481	137230	103426	88658	89467	104881	86099	126640	163061	67630	79878	93515	105455	135121	209952	164899	175661	128161	153181	180297	178786	188870	129582	128041	139323	140948	139823	129353	148359	172162	186999	188518	178563	141451	130684	138542	136871	129064	112603	142282	147444	141542	119188	114964	109836	120313	186260	152693	173263	145377	177428	196828	156142	150424	104140	125651	131115	106659	101537	87246	98706	89528															25334	34983	45811	25378	30399	38195	21736	27772	38332	48063	36297	23421	35501	28277	25269	26923	26969	24619	23059	23972	25668	28852	28983	24711	25217	26208	24397	28006	24211	26806	26606	24504	26634	23278	25454	23028	25452	32045	32423	30088	28116	26988
AGMATINE	1606	1646	978	2878	3955	958	1433	2071	2259	1241	734	1804	1458	2815	3499	1047	3054	22960	20039	14257	3963	5715	10194	6686	21013	17680	12774	37430	6705	30213	27691	7393	4091	20235	40176																																					3340	2806	4544	3673	18732	13935	16143	13952	15171	20506	21011	17337	17624	5581	7481	7977	7873	40602	46522	64772	37086	40350	25955	20917	27290	23146														7964	10278	9954	6835	7556	8992	8806	13521	23768	19827	24516	23498	30628	24839	10943	11313	13544																						18938	21066	20303	27374	49301	39199	49154	44807	35967	59699	34405	181088	282844	135486	180302	142018	20437	32331	11861	25587	43348	41203	47086	42330	67769	66953	35923	320221	276071	169829	216127	200604	49153	80001	65753	64135	98661	100207	158218	127138	137979	134097	109841	325125	254055	139316	132134	119482	27900	36487	36303	34322	31594	26060	24237	25074	18041	20676	20946	26180	30655	29740	21934	20570	8008	6083	4704	5545	10553	10972	6108	6922	7316	33899	24155	25263	21300	19733	7913	5558	4794	3553	7627	8586	6516	7774	8406	22707	26309	30879	27543	25593	14426	13529	10897	9772	22389	18487	11368	11725	12498	84284	40001	56095	44968	72934
ALANINE	48735	30741	23901	64599	64468	57695	78820	55510	58352	42742	38183	44857	32051	54264	43444	48359	64255	56396	66691	82824	64493	65695	70940	54458	61201	51109	55853	121479	49142	65823	82581	42064	67833	91859	167461	44273	50178	53638	58366	53429	55698	42582	46837	77534	46111	65404	72571	93014	79178	62113	78573																					14259	36876	29289	28574	16183	28060	32675	22603	17312	18594	21136	17225	26166	96981	41281	37496	69202	42481	70996	47149	44474	44254	35056	57774	46301	47090	125343	120332	120254	198225	160531	126793	140649	156201	142200	152176	128542	103954	131511											705333	708400	648642	801941	471520	823510	474582	1275503	1045696	1092485	1012289	1009861	872055	893628	1406527	601355	604218	944808	402509	583789	552576	533708	1444522	1586568	1358518	968335	1779956	1069840	1106519	2157683	1663855	1408004	2009403	2702732	2357507	3128640	4163600	4311589	3703275	2480152	2651378	2171287	2121502	1726699	2453406	4908708	4069326	4598598	2627552	5292998	4650714	7193748	6549166	6706790	4204158	4870880	4106060	2775108	4305554	3521971	774874	831316	877505	833272	1456003	1638546	1865110	1030217	1163813	883094	1427161	1125003	1661032	1462663	1539878	1159438	3737347	3498386	3002572	2981956	3325006	2876710	2780372	2716350	2893048	2768124	2817155	2228921	1969416	1954452	2031718	1994521	154650	180252	205098	244860	448475	304530	380427	359355	493532	136417	301245	232505	273152	279115	458955	353137	439128	462179	537923	624047	565056	641791	595412	427467	661991	566888	701097	702451	168116	94543	246685	213180	159367	213502	225205	226419	356637	114342	320174	194924	194367	273144	348193	319525	300961	274948	343055	442811	365871	399337	353772	406442	503043	325041	368454	332177
ALLO-ISOLEUCINE, ISOLEUCINE	317826	191982	91573	353806	331956	180490	207736	132718	545806	252945	251866	289800	217963	357276	275250	306431	426973	285719	379155	497711	340657	320649	307857	247390	296520	200057	231308	585446	191067	317434	332943	172936	285636	348254	938408																	632188	449596	625255	1093613	417216	1805	574845	483666	529591	905442	1448332	765475	361716	546076	5013	1229736	1071238	4407	1115	822394	915839	1189375	962412	811564	246243	512599	707951	295568	232361	703954	642531	307378	492359	4388398	1584407	1772384	2492662	1703813	3316678	1479597	1680057	1992424	1293651	2051307	1691080	1652068	468709	507320	360234	612744	434716	504424	376581	561252	414921	347167	389489	471168	495143	423873	447912	469224	273737	218490	432230	320138	401733	282247	432957	141910	157341	165700	155483	452401	245109	470716	2877670	2512819	2493438	2025691	2712433	2675204	3239212	6756914	2262562	2813526	3782829	2142400	2360154	2565958	2143571	3529061	4209196	3820423	12623721	2394083	1213703	3302846	4640047	3834435	3273392	5151364	5669727	4795328	6367135	7729524	8866690	7689218	6579937	9519395	6777720	7514178	4925240	6662546	11708227	8815453	9547627	5820559	11445659	10615316	16007520	14223302	15123090	9268648	11173552	9668885	5446352	9277239	9346783																	4467034	4792530	4418160	4708621	3165274	3570069	4039400	4112984	4109108	5202630	4257257	3192665	3747666	3246350	3664492	4195702	1219239	955266	1037036	1237516	2015341	1652010	1834016	1704973	2493904	1167643	1844967	1364005	1433091	1593566	2778909	1765214	2225419	2206809	2512498	3055940	2687260	2862978	2679709	1995520	3449196	2558028	3068260	3588845															1305441	1191448	1292679	1175193	1244577	1255403	1154008	1155025	1260227	1046340	1120161	1183085	1125268	1123610
ALLOTHREONINE, HOMOSERINE																																																																																																																																																																																																																					1916686	1601654	1488269	1729931	1828480	1685746	1445145	1479719	2001197	61214	154174	78445	64751	95718	1774075	1562577	2026724	2079662	1755287	1755804	1484278	2032386	1762737	96879	214889	117055	172599	268998															174990	170857	135784	133793	169524	175091	163253	157149	142600	127082	175592	142682	130423	133310
ALPHA-AMINOADIPIC ACID																																																																																																																																																					83340	107153	77189	82511	85469	79653	84380	85221	88713	94836	89945	158213	136384	138386	128401	112109	82487	98323	92208	95791	135651	89747	112427	113580	149512	114899	131273	157498	124798	133769	134789	127766																	51145	57810	48461	58654	85763	39538	99846	92483	112140	109715	102936	39010	59206	53662	76074	73956
ALPHA-N-ACETYL-GLUTAMINE																																				52245	46375	72651	65056	109483	57769	58950	37505	93214	56691	98161	46045	58820	75733	68606	78612																																																																						116308	76147	91005	51107	54971	32567	49360
ANDROSTERONE																																																																																																																																33397	36922	39592	21506	26147	75117	22393	9774	15163	13764	12428	14140	11772	15875	7448	6252	10455	7239	9118	9747	12568
ARABITOL																																																				24619	29537	40440	52008	20527	0	28893	30433	28483	43882	51601	41457	26032	20779	0	55149	50217	0	0	40077	150161	143893	124056	138531	187960	132164	144633	173303	190647	163501	148502	149721	141604	95094	122988	138933	123942	126690	113634	122061	121561	125576	157831	145203	139316	142736																																																																				70620	78588	78096	67223	34076	28646	30275	28895	32813	25758	38531	101207	77075	87659	63692	80066	65782	61402	61299	66608	48073	50612	42978	59069	54852	54124	45175	57254	59862	62296	60580	68044	80911	78049	81338	78347	73036	74312	75790	81980	82037	97737	81474	84628	83623	84944	88617	83847															15665	14384	17095	18016	114	0	149	0	146	20424	21104	19490	22211	17040															21312	17460	19926	20440	22534	20668	21579	18950	18440	19641	19402	21404	20087	20901
ARGININE	877313	646795	562495	443747	403806	373892	731188	442498	1153488	910448	900334	1032414	815797	1029605	846197	1068866	1105816	417536	547979	704464	526153	480280	512814	413597	546669	397809	570598	1405796	611682	633216	813699	561437	629011	928480	1418142	102697	92038	233011	17093	111783	93473	19112	22892	35810	8430	64878	35846	54128	55382	77404	25956	1386523	1594092	1782190	3038789	1485302	2140	1542663	1840302	1807250	2238711	2590286	2039980	1474222	1348948	2190	2451400	2246386	4439	1150	1720605	918162	1302516	971603	1024254	1121942	1317642	1679277	1151596	841926	575941	614009	379305	451909	4417600	2022784	2318327	2586289	2939949	3966697	3027874	2859976	3079843	1206538	2063856	1687304	1540824	1806776	969996	1565491	1874779	496281	1644677	1113757	1526342	1367645	1395063	208647	1369041	1535582	19432	107082	38474	44372	73462	40609	63527	56653	195593	26962	58996	58540	343992	89287	164366	99362	88229	3628527	3321597	2429436	3093209	2827203	3264066	2755238	6875058	2828825	3288960	3666671	2432102	2858802	2690878	2626722	3383214	4286017	4101526	1959341	2454346	735689	4734036	9309290	7040430	6450784	6706052	8222308	7308904	10072574	11025701	12629425	9114298	12258083	15297744	12170323	13416004	8712160	8673242	14470621	13284470	13069203	9292612	14315842	12825573	17328518	16394771	17155022	12406327	19536830	16819828	12681876	16654857	15250230	85965	155480	734979	265723	313686	425055	1147201	500154	701206	336105	498023	1291015	1297792	1976265	1370769	1525194	8755532	2672060	8984426	9483971	10277409	7381984	10131957	10434647	8806562	11220233	10360048	6992046	7325181	7002958	6870562	7780926	1859886	1808033	1994459	2224656	3235665	2795307	2778503	2980974	3618642	3435380	3263525	3044770	3579522	3322456	3375230	2299960	2855792	2948300	3361738	3546509	3148388	4218276	3517654	3422029	4944979	4066485	4684916	4865576	47831	33582	49459	61620	562480	489847	95983	22568	73137	122378	158491	105442	103972	141036	1046976	2068716	1934415	1803965	1283070	2097149	2621022	2132984	1555493	2188445	2338762	2396564	2190085	2385831
ASP-PHE	170943	78784	46577	2677	1749	3070	3413	4076	176130	119637	118319	114598	86583	100019	74909	122223	111237	1979	4329	4325	3607	2927	3890	1151	1978	1532	2334	4324	3297	3802	2763	1508	11379	3138	3735																																					481318	490777	512640	516358	530178	641948	528745	626270	473825	567452	502909	561550	607363	463161	457791	476077	541184	482882	529670	563766	581694	408117	558566	548650	552034	621409														59621	76505	44075	82917	53421	58146	48337	32647	58833	31274																																													906997	1018481	731915	939960	851052	817316	951022	844736	920541	946744	700247	90743	52485	5962	10904	24169
ASPARAGINE	117053	61041	43445	13390	9858	11746	9889	6798	187343	116080	115981	126627	92778	102465	99434	154369	155029	1550	2599	2849	6796	5229	3055	4426	2128	1901	4289	4286	3131	2679	3934	4048	9393	6028	7295	9496	9817	14082	10275	10637	9060	8109	7030	15843	3347	9329	13043	12421	14777	8934	11300	22890	21670	23517	45186	21839	0	18368	24703	26418	29221	37129	32834	41355	22394	0	39730	36026	0	0	28432	201400	356173	173729	322846	18646	21147	24950	18004	11344	161872	146308	104861	162407	708674	508132	468726	689911	38998	88574	36579	42450	35103	192987	261339	234135	213945	23746	23011	26770	29019	20514	18403	17921	27355	19940	19708	23775	22365	16063											25975	26062	26561	18557	20920	28731	16860	50015	42328	44311	43966	28561	30036	22262	458338	294511	310815	434761	179855	299462	195389	263061	104022	165148	126110	42270	23984	5971	892689	1683271	1391152	1290651	1564612	1699454	1649256	2009499	2575472	2702780	2090692	185509	141202	169756	134293	142721	1446396	2725459	1706321	2312666	1539578	2639238	2391599	3376258	3396744	3575641	2210861	335750	244593	83053	70454	267707	24308	34907	54847	46534	69076	71486	115729	64303	80591	62482	99918	75281	88798	93054	110892	94931	207552	221081	202869	202693	189608	168342	223171	195763	197043	214405	207889	115505	126917	114514	129199	153174	358047	268103	251132	320400	526073	446952	435544	399983	540827	24118	42921	28866	27023	31878	352399	280831	379848	394370	489092	544140	474192	535194	488779	33208	46398	38230	49934	74723															22703	22293	19238	17855	21968	23804	22998	23348	19540	20657	25997	20308	21396	21758
ASPARTIC ACID	31494	17774	8811	38681	36303	26856	43984	34449	38754	18917	19107	26542	21059	37866	25336	29885	36489	34477	43560	58672	38948	39463	46724	31766	34604	22031	30651	80642	24422	42069	41300	25493	44083	59682	98763																	9185	7453	8595	21243	6513	0	4022	13031	9800	15587	21627	14046	10865	7294	0	23662	20286	0	0	13032	73599	54127	73217	67607	40563	58763	60278	39111	40562	129665	122062	76319	79236	279061	100334	124458	146654	176786	280736	192383	234444	232116	170192	238929	171768	198793																															21811	17216	17735	16948	12985	12297	8425	273630	76309	105328	112967	85614	96517	94187	84386	313419	438532	362365	119158	226146	153532	279159	349836	254765	280346	220203	208139	225740	285180	250114	410599	266642	166094	79645	107552	113762	102105	365704	572093	451206	509962	239311	443305	365320	371816	490217	516417	346543	356278	355059	255058	408318	484096																	64200	77382	60079	53770	65137	45072	44329	39290	48697	39610	49975	24028	31393	14580	21161	24981	42102	39536	29556	39600	42160	17244	34239	45243	48528	13766	21003	15499	13257	15464	73288	51647	77056	51709	43944	53255	60870	84414	66822	15050	44942	23932	30791	47114
BETA-ALANINE, SARCOSINE																																																				175629	151380	173540	216927	167560	0	134908	174833	194382	185744	222847	258789	194737	133805	0	223217	219812	374	117	184503																																								77507	70887	94510	76002	70058	86078	87041	47079	76993	26959
BETA-LACTOSE																																																																								245511	238842	227875	232293	394	390	344	830	843	227846	247847	225028	234636	265999	225751	255530	253704	843	260	1899	3538	1448	201338	244230	223036	259128
BETAINE	370730	269543	314641	428375	543916	310883	669440	378897	384046	141872	341563	322924	260258	275507	247088	301308	325863	425961	439949	447332	405952	372140	427683	332878	375221	408721	299885	424937	278634	317316	233563	173736	300207	376811	436863	3830568	2944420	1655387	1852066	2479176	2150442	2669815	2363015	2537388	15311036	1540276	5142774	2475354	1917769	3100704	1403775	11462669	14671065	12615062	19898926	9386249	138050	14810573	14876956	12118227	13636164	17549870	17792184	24487316	9365551	178419	15338831	15934487	221280	139602	13555798	2012003	1657248	2035321	2024010	1068571	1658485	1781062	1232371	1031358	1197653	1296570	8627659	2466358	2024654	1228310	1596737	1490632	1504840	1716787	1706927	1633948	1603010	1421678	2298776	1558940	1670308	13863256	11922617	11538245	15840374	13059441	13719205	11470821	13644391	11679746	12429682	11397824	10015507	12010018	2634356	2666680	3723560	3657106	3750724	5795082	6679258	2319210	4129168	2241192	10518995	10630389	9919818	11658199	18219098	21833238	13986222	23828892	21742334	21294146	19492962	26955888	25615244	22613934	1555576	1043614	1094073	1035613	1064808	977266	1443011	1214432	413064	512253	517280	1043671	483578	834443	2414330	4051686	2938736	3081596	3002045	3420628	4245040	3556674	4384506	4002547	3466920	5948460	3112659	3019349	3363142	3550518	3178976	3634563	4192970	3494112	2803348	3864658	3624388	3638559	3462347	3273331	3402683	5627020	4149538	3858983	4270992	3275692	11196219	22186912	24230942	21967122	34155172	38854048	55648616	23506770	31126228	23699068	31002862	30285996	36718844	32871182	46367812	44734724	63003492	63017120	65274388	59634724	75689656	68191816	77295688	64762444	68385400	55798484	66296040	61176184	65207552	62116616	56856468	61087628	499858	752624	749608	785546	803584	778351	713582	749754	822318	582302	936618	883748	875159	903522	716704	639074	739325	700393	862526	727560	721045	1033220	746158	717318	979909	1083853	1059630	981584	3537865	2418853	7906446	7917540	11377738	14975180	4593792	4520720	8150329	3663973	5774140	4663926	6213002	5766787	18427934	15462561	14158998	14695158	17717990	20894108	16641173	17170262	17485874	19051832	21434318	17522976	20041168	19039768
BILIVERDIN	1666	3850	10531	2655	2171	3279	32638	30459	464	2196	4440	2596	1242	261	237	9604	172	2010	653	866	3327	1474	3487	5233	3455	3271	9136	6712	8626	23987	31713	8276	34227	33437	35327																																					7330	5706	13354	9439	9990	15445	14487	14172	13048	25818	38723	49413	57267	13385	8227	10958	8647	31862	26162	36322	32992	43405	42715	45706	71817	68105																																						6939	3218	3807	3635	1739	13857	17533	11192	3463	7890	7181	4152	3923	5123	4962	23807	18517	11149	6389	9848	12382	10398	17875	53565	17108	36095	50354	47204	62173	53631
CADAVERINE	1875	1321	1123	506093	423513	637841	579286	467492	3375	1222	1168	1883	1971	2928	3145	2269	3950	321126	280661	311489	654712	529383	467564	477700	460347	470022	488249	537564	515133	381569	477355	447315	430918	427179	608705	1674	1461	1513	1146	1851	1592	3169	2550	2750	1252	1778	1209	5844	7907	4887	7108																					40782	44168	22665	40557	63964	48895	32837	41486	52527	205280	202433	150506	222348	19534	21791	14990	51935	45904	41307	52804	43615	49748	234167	204169	257159	183836														77872	83559	116297	26052	52109	84481	73055	94177	181127	224400	268772	267932	305539	381058	24517	31455	62229								2346	4976	5409	5042	3333	3277	4567	3890	13785	11782	13288	31658	9252	12837	43423	48720	39231	79470	138646	93717	123647	96502	77722	140419	72691	596375	550838	577663	648010	226018	48372	60302	38915	59988	127422	109399	123326	86331	155503	168118	85619	2173654	1905102	1699525	2084881	1984621	61291	84740	303052	109025	260137	367051	968172	497666	1002995	484067	623591	322506	394721	400015	579668	312350																	8058	5231	4068	2928	9739	12563	6790	7088	9192	43285	30865	27029	29073	21446	4664	4169	5370	3847	10615	9484	7207	10576	8222	37591	55550	49409	65251	52924	11366	10524	11774	12097	251787	153546	18801	23386	30836	36193	17207	16374	18836	4858
CANRENONE																																																																																																		11544	23957	11435	14765	14009	9779	13646	7844	4444	4614	8023	3546	8508																																																							21627	12663	15945	18452	16108	5719	17573	19413	6436	15448	17042	9952	14749	15167	12076	11763																	40706	37287	29686	33827	18209	35827	33734	42822	55824	25269	19438	22397	20801	24181	17030	30922																																											8758	10764	10285	6338	5922	4112	4979	5597	5149	6531	6218	5618	6914	6195
CAPRYLOYL GLYCINE																																																				30904	29311	62846	57691	26460	216	38117	29411	30521	83893	52004	68426	61614	28408	0	51951	90868	111	192	76772																																								20163	16921	21154	19139	15776	18766	21708	16929	20071	15405	22710	25167	9723	10171	31580	34250	22822	19183	20446	20493	14933	32461	19771	32053																																															41633	45350	67994	69772	97688	119112	89892	91139	93198	89139	111144	113334	128316	127273	70134	103535	160473	171403	180180	176848	144736	150936	164363	161111	160548	200889	183090	202551	243290	239028	228082	182557																																											40182	29517	36571	37458	34116	33461	37813	29223	31971	37044	40997	31378	43177	30345
CARNITINE	152820	144188	130539	69416	159988	90081	353296	66984	150010	100641	170263	153508	144884	200668	100843	162189	71788	58972	175564	211222	96872	101897	202495	88542	173985	78750	102472	307985	57115	110477	122779	50910	176160	256006	189861																																					540535	663669	452870	532602	393240	435761	466971	325334	410350	273301	251322	272076	274255	592893	648605	593098	764436	519129	226529	721272	478023	390624	370226	195786	306266	508217																								4668796	4691748	7131262	6649134	5649226	5849386	4780752	1214182	1248878	1401747	1511216	1946709	1527521	1411782	145822	172012	88825	164603	136232	179917	121527	124183	130878	62127	76665	103660	49054	65247	1749369	2062285	811623	2286662	2420720	2147909	2475271	2405269	2277366	1098908	1913951	862476	386037	826018	683354	1096925	1862057	1462829	2728550	1090301	2224527	2525783	2488035	2309225	2342302	2315866	951759	2297407	2801220	2752422	2611220	2224991	14835891	24668546	40390432	21562774	46512668	49296336	42999488	29140290	33457178	34366464	43113480	48827328	38876340	49415432	54287392	44571836																	492211	536324	371087	371583	426616	443275	432955	486528	504439	167704	201225	159149	83409	178524	382770	439220	450358	428037	441708	384925	503964	346793	584495	187432	160442	281148	385667	110091	4011034	2206721	6284235	7890316	7051352	9066102	4542750	3219595	5491329	5275473	5600916	3940766	3679844	3698335	3277740	3434720	3432431	3632070	4309330	3887077	3338170	3111036	3139764	3882182	3746969	3239162	3308856	3175980
CARNOSINE	3075	1995	2472	2719	2933	3908	4779	1607	4135	1557	1685	1716	1788	2749	2339	1842	2081	2162	4273	4959	3663	4124	6959	2979	3252	2185	3910	8396	2439	4606	4792	2833	4779	5077	5248																																					12883	9653	12737	10107	9543	14018	11796	11340	12662	12934	14455	15017	12808	21849	14801	16735	16688	25176	25339	24144	24019	21772	20719	31070	20811	21452																																																																				30949	47439	47880	46636	37022	68887	51560	69262	62145	62770	52482	52083	50155	45305	53789	50000																	16972	14064	18233	17397	12004	17562	17136	14148	17638	19730	16394	11636	10606	14612	13966	18919															13250	5926	13723	8261	16540	11090	14962	14389	15805	17602	21434	18265	14383	16210
CARVONE																																																																																																																																42814	40882	34882	24015	27770	67268	25262																																																															20871	15648	16784	14041	16674	12057	15902	15858	7178	18360	18264	18400	16433	19324	15050	10396
CATECHOL	6661	13877	9278	13715	16496	18062	12978	13107	14338	2946	11547	24076	11969	10224	9949	9417	6995	22031	8253	14800	16808	20540	9382	11778	7926	12076	13521	9621	8026	18500	19904	13753	14718	9436	8363	14932	19068	18280	15402	18491	16797	17067	18604	14768	13336	18395	18322	16688	14997	17811	15986																					5532	19640	37102	8877	6845	20695	16240	6898	13104	29167	17184	20190	48117	2680	9038	13537	10062	22256	8806	8339	10294	1163	8626	10965	8222	11728																								22577	20705	21858	23014	17860	20862	19257	34660	32545	32643	18523	30478	42655	20458	14125	13935	18037	15941	17197	14621	16065	16730	21844	16513	13895	16476	15399	14560																																	38545	35597	41741	31562	49037	44990	56245	45054	44807	30204	47385	41075	35515	32402	34816	31695	38919	45109	37197	37581	39378	41098	39964	32882	55191	37151	30970	30667	28725	22043	17091	37210	14821	23851	15425	22975	18540	22389	19598	18411	18624	16471	16702	19222	15893	25416	8842	12166	17408	10958	13252	12317	16945	15382	16734	20144	12969	17716	14414	12835															9412	9910	8929	11010	9909	9325	8954	10850	9190	12128	11795	13041	11885	10113
CHOLINE	32559792	28202210	16946226	76277288	77217704	4677449	29483422	4023126	30109232	22280440	22854470	34800188	27166230	32969966	22429212	33771060	32079354	46339388	51416148	50562584	81005064	72376368	75620992	78071872	76843208	77317848	6285677	26023718	4338564	3855216	13118613	2805532	4068215	13725644	33749580																	18189898	19391946	12435270	26197382	12902476	20617	14905910	15863625	14994220	17744602	27715946	16707839	18054070	20798932	19367	25968990	21538542	84019	27072	22795248	95660944	62551524	98193992	75633848	144613920	185968704	217324192	138782912	121797792	9104065	7927896	22672956	8995800	108681728	54535240	96753888	70163560	127810456	170457808	212336112	125267520	122280136	15015564	31829398	26910484	26853814	12850115	21685502	16510395	16525824	16343818	21841938	16498378	19336818	13236534	7701704	9418788	7893016	12837616	9424037	10750243	8826695	12583550	9484038	12324622	12433853	6748123	15199746	9995710	16746415	17031216	18672514	15478069	21303344	16784580	10787252	22912554	22230106	23818772	23102826	23802972	12160697	20430754																																															29742314	47561160	79242600	62046636	105293224	107622096	78057672	74366744	92056944	41506824	68101368	107900992	100228728	110488416	123321352	120409936																	65853336	70146752	60776316	74870600	147610080	150278560	129387904	135557856	147598512	118216416	102594576	124612968	147528992	132644816	67194512	61918028	73667312	77578872	145989904	137300368	130884592	153141440	140665824	88760400	117089608	131063144	150286352	149047024	11472868	7019404	15659890	16895314	19790206	15950770	5627680	7895448	17269968	10928707	11444231	14318949	19736334	11142523	46284332	46719332	43244632	41478828	43607228	43884004	37504552	42345116	44548420	48808484	46982936	39647332	41166908	41596308
CINNAMIC ACID	28279	4866	21341	20091	17035	17997	31873	20462	31884	38503	8994	21768	4936	14005	4607	25700	18387	15153	9604	21584	43790	11964	21130	5789	20425	10618	11106	26344	21504	13694	13806	7197	14783	5970	6012																																					5441	14439	13319	10246	10436	14219	10116	6981	7540	3948	5791	9862	4687	2449	2313	5991	6100	6818	2455	2521	1812	6462	2044	4110	4634	2823																																																				26066	27546	21878	23478	39362	31390	30119	33771	29313	42079	23183	32621	44615	31189	45892	31423																																																	11258	15879	16664	11460	19737	17297	17048	18084	15517	20766	21555	24202	15128	16940
CITRULLINE	14045	7923	9241	53635	53810	100390	166996	61730	16389	14275	13647	12126	11902	12554	15234	20890	18840	73135	95720	131464	157617	107928	118807	156514	79066	57689	95275	175702	89909	133441	178651	65871	114998	143436	232955																	176961	132684	185156	431187	137813	0	123878	154506	164120	366721	457418	217458	128382	173894	0	375762	382804	139	0	189288	59500	65865	35170	60070	24706	37993	23991	31660	32263	17194	22888	16656	8665	92509	78713	94088	92962	29168	44866	48560	30562	42027	23747	56752	25705	31028	178152	216577	192099	294658	204990	184165	163428	232818	175417	157852	158853	171199	139125																		507662	399170	415466	355055	337762	339161	277627	65088	55835	60776	66563	40895	52343	26891	51136	618694	629360	705713	366706	745683	575247	135314	209863	177684	184679	212494	230840	264767	224527	254020	345652	225582	407459	420840	485182	466068	285857	162559	225660	197213	237885	194174	272304	316833	250797	357723	361276	244685	499129	512822	527577	502732	412849																	1827568	1861298	1582603	1879161	1333917	1404364	1532045	1394511	1447395	2328994	1448416	681987	916751	803554	861740	1130703																																											379078	430001	394487	294230	296441	330500	447662	372390	343524	411448	461683	401084	386463	375246
CORTICOSTERONE, REICHSTEIN'S SUBSTANCE S	436712	632944	886832	80282	131809	22425	9747	16572	72409	20470	17859	32470	31907	132126	33032	11093	61682	95899	115118	138916	9570	198321	240682	126908	222347	137830	598983	112599	56813	123913	108145	78409	91644	119040	74860
CORTISOL																																																																								23316	23961	19919	20045	6399	5829	8372	10318	10557	18479	21088	4490	13409	10612	17437	100458	20743	62248	9578	17294	81003	9886	25765	37114	276	162871																																						120515	68275	71685	81284	20044	12024	36757	17969	52959	43776	16363	13443	18434	8430																																																																	6308	4595	10921	11432	8535	3485	12584	29438	19293	10506	21620	5239	11953	19343	42475	27482	21413	15420	21034	12838	16180	54188	71731	16477	21422	17363	15965	21055
CORTISONE	12314	12502	13819	13137	15514	14456	10678	11733	22504	18101	12407	17446	10575	16214	16827	13468	11072	18174	14035	16795	16480	11632	14896	12757	13515	11099	13861	13576	11200	13948	12481	7997	13834	12417	11628	498	648	0	10228	7928	1559	1908	2821	790	3633	427	1719	738	725	303	415	9153	13419	19197	25645	6646	120	11882	9930	9193	22193	20548	13287	12497	6901	146	21377	14289	252	185	17433	88181	67887	80691	78652	76481	77265	90713	76817	80244	77319	98709	89657	76724	55741	80404	97027	83132	72477	56843	84782	97413	48806	58490	94499	55340	115220														3646	49577	12861	33081	29523	7570	6940	915	1571	3105
CREATINE	702421	451662	383985	563308	558686	716666	1383974	458441	431713	433716	394067	348574	310843	421759	199073	317550	272518	552288	568047	701148	547968	462734	517435	415545	417323	436782	403765	1103497	311413	315448	699767	200824	274651	643208	1286352																	3695163	2732673	2919862	3465374	3190367	1110	2845217	3291316	3300246	3152043	4036180	4170902	3107817	3334338	1665	3712059	4403274	6251	1790	3612804	1284142	2239978	1952263	1529928	1185586	1842885	1636279	1139820	1142513	956114	975830	952830	1160015	3611354	2171910	1720864	1587960	1817573	3060133	1972527	1536908	1913415	929714	1560448	1500967	1734105	2696276	2936283	3093709	3123320	3306220	3162937	3273099	3636444	2954227	2997817	2888326	2476247	2887184	6094072	5415521	7265830	5765891	5240665	6431142	6513975	3458960	5842067	1917463	10781017	10877708	9761913	12220926	6947488	12389231	7225070	6201100	5575154	5733093	5694670	6587266	5443871	5337103	2851238	1882990	1257160	1231198	1304104	2111917	1932452	1350934	1234408	348495	500273	94644	27923	58640	3332592	4001270	3567623	3415422	4165732	3632487	3447523	4841192	3213748	3877882	3949625	8601709	5162193	5397224	7199192	7019030	4444412	5491852	10310923	6956258	4767460	6017602	5295116	4794580	4676896	4310468	5099316	7690284	7376644	6958902	9265458	6201516	17082544	18869944	18557088	17719364	35533240	38241056	41437720	24226208	27279404	19308418	32619938	25006038	36459512	34131792	35446220	26246732	21643034	22787192	21169474	22752310	22083372	22905194	21417922	21194150	23101258	21595740	22639620	17041910	16562376	16427297	15865630	17648846	606427	965085	866608	773940	790483	727124	919736	875088	884891	715837	1340888	1065325	1134338	1195376	1266702	1341635	1361697	1263755	1171255	807088	1220953	1761381	1456228	1186418	2193765	1959224	2680822	1880126	3539461	1841047	5353953	4671466	3190164	4334096	4820272	4990129	8135596	2238206	7188185	4075779	4110295	5914777	4313298	4304292	3906507	3391408	4077224	5372082	4476262	4995000	4486136	5165160	6518376	3854714	4300386	4282234
CREATININE	7380556	4185286	2883481	8529937	8262824	8686039	17072620	11041765	7869190	5787320	5869936	5553864	4396416	4922092	4217376	6498776	5646694	5876892	7100336	6805937	10810895	8530338	9719984	9135183	8811531	8317983	7655115	10406222	8382353	10738438	10126982	8796128	11995901	12782629	10634488	47034472	41518300	50278200	43175752	43307632	41797004	42639036	35873832	46711180	21954414	42126724	44813928	46671536	47474644	44627200	51179576	4210482	2485748	2405293	108974	3521036	5160	2801884	2434149	2616721	3103240	145333	2600805	2718468	2985923	5460	202249	2453074	9652	6244	808188	36300448	41191084	36994660	40199772	46008288	37109456	44915172	46499548	44385508	55584820	55951768	53684556	56519320	35591556	38245944	36548324	39400628	39734616	44310352	44990624	44851732	46659372	52989084	58625320	54721648	53345380	2259458	3033650	1940949	4183076	1703361	3422788	1733378	3555932	1106082	614496	1314338	1032092	1811628	46771756	45485676	41888732	52242552	44292280	47271460	47395268	40695912	48409908	38583276																													85355344	83484248	88940456	87864848	104714392	102987488	101107984	105682016	94400248	40841660	95996520	99006968	87234408	99201472	89487800	66545912																																	24133246	22913988	20259898	22010296	24149434	21406332	26235798	26751312	24538276	34030160	23819936	14187696	15154696	15476750	20167502	18292206	26179470	23811030	19899978	24109564	30841284	30102256	26065898	23934054	27720018	32242378	23975998	24820966	27486084	21315206	22212284	18865534	21993734	22807946	28798288	28742412	26789446	27705458	24278254	22935692	25276492	25025742	27502256	24436612	39511016	32420932	58536804	58191592	63285428	67859976	48248784	46875096	57637176	50940300	45598764	51412456	47603832	53966520	5331154	5994435	6056333	3411361	2370595	3042926	4764580	4199150	3348723	3765391	5800918	4975791	5705944	5829552
CYSTATHIONINE																																				10102	8856	11375	5352	8828	9766	3844	6657	7784	791	4863	9013	7885	7266	6367	5337																																																												3413	5056	3567	4837	4425	6888	5852	4946	10374	4342	11026	11986	18281	11638	14114	24975	9926																																																						15798	29404	57274	36402	34453	38778	79332	34517	42021	29025	45999	47817	35096	41101	45782	50410	8869	11785	10210	11702	8309	12079	12985	9711	13489	14300	8898	10650	8747	8038	8172	7398																													6539	4842	10659	12859	20487	27581	9013	4926	12001	5410	8230	5105	4908	5967
CYTIDINE																																																				24908	20923	22407	7601	18095	0	24013	16304	20979	10976	10269	15520	11336	18541	0	11573	13218	0	0	19629																											27154	29565	24483	28700	26182	24774	19332	25912	27413	26350	16343	23185	29456																									18461	33646	40361	40863	59073	53521	39475	45048	6553	8597	7130	5010	4634	3438																	61307	64562	47018	50746	43138	44409	35224	61980	60161	71883	47324	13487	10107	2417	7235	15786																	120591	138282	122142	130363	93256	127291	117495	113083	128013	131346	112655	178030	160294	139416	149451	129899
CYTOSINE	75899	39205	22246	6990	4669	15539	35219	7674	73254	44794	51422	46077	35366	37662	24909	34100	34607	18755	21936	24598	26514	23640	23897	21274	14649	10081	25778	34760	16484	29229	41781	18226	23996	26742	14636	50415	52909	75664	45726	67842	41355	34660	39464	75878	35984	63791	70723	83152	83135	67045	69247	54412	53371	64293	56446	35492	0	68175	24614	26217	27817	13911	40747	20996	48630	0	19624	51878	0	110	19370																																								117783	89852	72774	109692	105624	122016	107457	92356	122666	79036	262708	266544	217002	151008	273647	373083	318672	60644	62990	59289	82427	98977	100156	62590	586032	253671	338104	335519	478924	337799	448865	418890	106872	103244	107494	79674	56819	89999	1038566	848585	719999	863423	680627	637123	783329	709795	741779	792690	599610	123506	29433	27548	22709	61270	864660	772399	618492	679956	492276	575857	642555	784679	588691	630209	459836	149688	159284	50255	124594	283181	268162	378988	469792	492006	767474	770709	1042356	635093	621218	585760	806843	670646	720914	726573	800641	742069	332510	166168	374604	412235	358186	390703	428837	422718	68512	606576	438855	341684	344396	321714	374971	75556	232447	250750	183062	228855	202261	191047	156354	131629	183807	19068	25290	13127	8323	14021	225295	175610	186952	201613	144418	126833	135666	168417	147212	15569	111636	10526	22580	125173	107799	89816	219441	176040	143431	202054	166705	180243	246422	99858	149626	135067	147850	157570	79861	133135	156196	110589	102582	98534	112524	114181	24975	120264	103832	108559	118447	87047
DEOXYCARNITINE																																																																																																																									123428	124186	129457	151183	67296	51955	79781	130914	122667	120876	107290	97678	97705	86945	10956	17334	13421	17700	11656	17746	11084	19178	156032	217335	368430	175667	208102	700968	183956	91572	57291	102942	167778	148560	351967	168379	89856	120310	123428	3082306	2919487	2823403	3601906	2136840																																	702878	687882	753838	477625	703945	561356	758043	714037	444346	873834	729035	470553	510571	366323	449406	583503	67238	33121	22747	31147	37192	71198	23035	57685	27137	676996	394328	472627	425327	399513	43744	24227	28226	23977	49612	52925	38056	45045	40792	229416	231330	248238	193437	181669
DEOXYCORTICOSTERONE ACETATE																																																																																																																																522879	427960	501012	257241	217791	231504	171457																															5747	5870	14599	8530	6235	5549	9630	12165	5498	3677	7994	7639	19780	21104	23374	12310
DEOXYCYTIDINE	23322	16885	10007	1986	1394	4394	10282	1911	24057	20669	26599	17599	14354	19261	12511	20609	15433	6307	7835	10495	8517	7984	6121	4514	5158	2695	6392	11419	6535	9839	13121	7662	7682	6121	4744																	26991	29162	23255	25596	23225	0	28549	10286	11230	9985	2025	21201	6189	17354	0	3675	23940	0	0	5275	196208	93285	170248	102246	9113	22990	33790	22228	29419	6119	6209	5138	4352	196425	94593	86021	96709	71874	115452	78160	70141	56710	5712	41811	27985	8561																															12375	14674	14739	20279	29957	26400	19721	152041	73186	93263	89927	61630	88307	114202	103890	31646	28499	30270	21161	15151	22601	324284	271823	240466	282421	224509	203069	266917	244354	242561	264921	230049	12559	6165	3896	5406	4161	275945	268712	208169	230980	164669	193294	219360	261446	221876	217255	171898	103539	18335	7750	80054	132188																	146511	14065	159191	182156	151206	153290	177302	165807	4549	236883	181844	139015	146811	133944	157417	7136	66467	80342	56208	61791	56581	56085	48211	32870	57780	18066	14994	1431	16234	1522																													33855	53081	61718	49887	42789	21703	43281	44409	17903	38699	44017	26048	44915	41956
DETHIOBIOTIN																																				19686	15072	16306	22820	29501	16165	12257	16349	18091	22303	24964	22318	26126	22080	39519	19744																																																																						29527	33889	23597	34492	31882	12552	37318
DIETHANOLAMINE																																																																																																																																																					10122	75460	282938	76961	97169	166216	241115	19006	15490	49385	52824	41985	94658	29741	45522	68469
DIETHYL MALONIC ACID																																																																								2475	3585	12149	2965	1332	16974	3959	1653	7094	4601	3208	9305	13280	2329	5325	5480	2126	18875	3038	1355	10430	9074	5483	5497	5473	17016
DIETHYL SUCCINATE																																																																																																																																																																																																					5287	8552	5736	8791	8258	3440	7130	7681	8774	7744	6271	5378	7893	3863	2209	9730
ETHYL 3-INDOLEACETIC ACID																																																																																																																									11618	7814	17663	21640	12980	23119	10832
ETHYL 4-AMINOBENZOIC ACID																																																																																																		13329	7470	2770	4679	9372	2573	3310	3739	2786	6071	10344	5951	3210																																																																																							27499	17783	19083	19010	15648	14284	17479	19558	10650	21164	20285	23425	16636	15421	22409	13937
FERULIC ACID	28598	12686	7657	1446	1990	2773	3719	5012	37140	20902	19819	16841	15380	19200	14621	19709	18473	2898	4868	4555	6654	5348	5282	3696	3774	3041	6059	4689	4296	5289	3631	4459	6810	5597	2780																	2897	3099	29466	5719	2944	0	4708	5219	3560	18839	3404	36306	7767	5357	0	3299	15171	135	0	29296	126944	116298	118993	121846	142188	177558	147851	153745	134214	109145	118646	123180	102497	131916	101002	117314	115587	132949	157806	171311	150478	170070	104606	118537	123852	123144														21101	22944	25974	37925	29255	29876	33341	19472	25298	20070
GLUCOSAMINE	26920	17618	10880	2838	3218	820	2304	2087	29231	20817	21762	19797	16404	22657	17018	22608	18803	2175	2556	3738	934	4292	2737	3857	2198	3090	1286	2831	912	3146	2350	1747	285	2887	1887																																					130070	124509	122061	126697	10048	16006	13423	14799	9730	32306	36099	43132	27458	145245	118795	124566	134157	14068	16121	12567	13446	12074	32180	36499	22055	34876																								10980	11332	12815	10285	6048	7334	6364								131921	98107	112740	118716	139473	136347	129353	128232	12023	14831	15493	14519	32217	43864	549768	563719	510287	568175	22819	34138	20554	40806	39008	41582	38811	87142	73853	62225	54183	52804	525731	566533	481951	494216	14115	23526	24901	39125	41121	50789	47102	74215	68568	51465	65692	57405																																	127415	145031	99701	150069	5562	2248	1931	2758	9051	18010	11515	17006	14580	15974	137131	140184	139018	149208	6102	6036	4476	6887	7664	10232	16090	15800	16315	14986
GLUTAMIC ACID	211366	124256	67932	340942	327232	399868	644664	482237	272936	180437	178705	212986	152740	210951	154577	223487	253113	329563	399049	394416	382353	320790	376846	357087	378954	335601	306280	570965	322908	369266	430246	288243	396828	530353	720329																	45891	61107	58670	147055	71596	150	37487	78334	54071	70187	101846	88481	55498	49408	155	125083	92193	117	0	77896	717729	601841	600042	625213	717514	1021210	1285669	905168	490797	1467778	1348143	949339	1397744	1434641	662601	811516	960434	1349719	1523864	1766075	1521941	1346855	1610864	2124679	1856165	1724016	49072	47349	38747	59832	42393	50231	42966	53174	38834	58438	54465	30762	44985																		104398	88311	93330	70638	73719	60297	49682	1053549	430372	542876	656824	622710	579941	610005	562320	1435257	1749342	1825539	940257	2214051	1940655	2565120	3319204	2369503	3751187	2433572	2392978	2236782	2679324	2773670	4264095	2183872	511808	368177	350850	369879	334948	2677376	4526411	3231678	4054105	2247530	3885285	3043899	3708934	4478142	4664293	2808713	1183575	1073079	681633	1097425	1067118	11630	16294	18605	19280	18517	24144	30337	20133	23907	27938	37243	29500	28108	34967	38670	26617	456839	544373	468828	343504	439821	412513	477454	483932	349820	285425	416324	214157	250018	231919	188709	340182
GLUTAMINE	324652	184171	140497	148985	166882	118303	153178	106934	472367	338624	329121	348476	248609	310153	281610	437442	430226	113539	151900	189217	157295	141791	143944	120083	130106	92605	120423	247806	95193	124033	136201	91822	143344	191898	348059	26128	24478	41159	58646	63437	54181	44130	44923	40942	82385	58687	75042	73439	80560	93465	62163	508195	517986	722833	890354	497654	220	492626	482461	499824	689966	1050596	672034	507866	552057	114	996229	870583	1671	0	724196	673230	1162135	601952	1019607	249118	471566	581508	430562	196275	651825	375579	376189	740163	2037900	1252505	1167008	1905042	512603	852234	575121	511293	541118	482336	801584	667307	639044	329539	321447	329790	446252	410656	372905	383876	376309	355194	455480	355458	366409	398809	19247	27234	17222	63234	40612	26051	38986	23683	44659	22992	52532	52885	67218	50459	69462	119993	49832	1102207	909509	889730	766227	1002757	963352	893337	1265854	754865	757693	1093826	537699	775993	617073	847016	437763	527148	491709	332819	281186	231389	2568585	4948292	3673244	4850842	3799627	3818737	4021512	4760040	5518100	6007389	5365246	623739	502291	545311	577916	534775	3941261	7053376	4996934	6381272	3373985	5546636	5252303	6949144	7002356	7352518	4864634	937364	879294	475867	791849	1093270	55110	119528	159775	168764	163795	193557	308687	190199	195527	201882	330633	198966	191255	193225	271343	168950	3400641	3476311	3332351	3228030	3741044	3262239	3304685	3056533	3172277	3002013	3429518	2709431	2304883	2466436	2519340	2962212	1161884	877988	793669	974720	1286358	1090786	1074427	963685	1339096	85096	166464	103123	92568	123291	1146455	941314	1184688	1231849	1233762	1342334	1206976	1349423	1256727	129995	250737	163963	213741	313936	22051	20952	40240	50604	67573	94304	48646	25906	64969	28475	48696	46573	43088	46233	536622	481965	455660	446256	569403	590287	622816	568724	580040	584322	599924	515365	551064	516179
GLYCINE																																																																								6958	11632	7657	11661	2588	7149	7985	4722	3617	7197	5061	4121	5280	35097	20417	18176	32377	10565	15198	13345	10002	14100	8829	9900	5780	8626																								40159	34702	34504	31395	20107	17201	15431	154790	115854	117622	118620	76233	72255	66709	433045	247904	280873	463930	112061	200114	164303	181481	203635	218496	162099	86603	210443	108516	682550	1762887	1461594	835982	1491308	1806088	1806663	2359429	2950428	2889486	2368107	1046795	1074509	991137	779428	707449	1917917	3499952	2406431	2923689	2011949	3633646	3379178	4265599	4604224	4425117	3340704	1874086	1530349	1077468	1585415	1348403	22351	43255	69227	53873	58961	69892	103492	75548	80442	63869	105003	64722	82772	83224	105606	86852	624600	631112	590277	530716	676149	510169	583786	558458	586870	529054	451805	365405	312342	288200	286477	437799
GUANIDINEACETIC ACID																																				379020	328152	414892	360761	328048	295988	331619	281947	351105	269997	263831	383659	357803	402455	254676	293273																																																												263700	264054	197831	388424	276705	308103	340478	251398	415461	260029	793442	801873	787545	591182	560847	697616	444152																																																						486258	799233	1302978	1087112	978833	1114225	1955536	1032187	1182679	718184	1172672	986097	1424307	1205816	1680950	1306233																																													240951	165969	366626	371469	460135	501337	224263	220064	336317	326253	314934	342476	289536	295044
GUANOSINE																																																																								131944	58797	103018	114415	10448	10015	13449	9987	9213	3003	6974	4520	4771	108528	59018	74490	90700	19757	27932	16550	17512	19176	8738	16062	10742	10455																															3882	3806	3488	1948	15883	10917	7776	126745	63530	84724	95328	132652	100114	119694	118750	12784	36306	18370	8951	19041	17789	196161	153166	118213	174878	144486	117406	145103	159750	131614	136452	110394	11777	8831	9124	13358	11910	120307	139519	91588	128873	81127	90591	100964	86979	96491	100022	77490	26027	25381	19779	25025	27527																																	48891	49470	32350	38302	42345	41043	38801	36261	52736	2255	2289	2688	3392	2313	33971	36063	40948	43718	38942	36802	36711	46890	41526	2585	4198	3477	4121	4492
HEPTANOIC ACID	6300	3936	3639	2443	5016	4368	6415	3477	15502	10100	6371	6949	5867	3387	4768	4507	4308	4007	4404	5134	10018	2847	1341	2197	1232	1360	431	2055	1901	1539	1788	2348	2398	2495	1469	1225	1395	1620	2444	2015	1658	1189	1748	1574	1813	1547	1975	868	1536	1474	1593
HISTAMINE	7128	7186	11001	32751	28770	25132	46122	65741	7398	5393	4351	6118	4984	5859	7962	8472	10642	15248	18392	18657	26033	25817	20662	26835	25369	24892	21259	14639	18639	38263	24952	21638	45133	34214	16149																	21165	16526	29340	30400	36898	3626	38776	22858	19273	26879	78675	20873	18479	23106	4010	27611	56613	2722	2549	27459	31341	28130	68744	32959	48276	45597	87511	61740	37732	339513	328052	286060	314788	38350	41228	68281	58259	49407	64649	84096	59315	60170	329740	345510	295965	281182	13690	12263	21725	34363	15982	17360	14855	20075	30303	43080	61742	26413	27099	56165	61301	113778	58252	48109	54775	53603	53625	93463	59560	122638	121109	118840	229411	161027	155289	127610	89032	66381	66054	56323	189079	92008	110612	14398	21315	30739	26639	18040	16117	36318	23075	465503	406103	374940	639929	506885	496264	392276	558384	428795	593437	1254825	1092484	1162396	1098949	991432	1402466	942592	1325698	1276677	1181510	1147176	713462	361188	598565	346020	495195	1107112	946543	1176497	863932	1545709	1535145	898600	1502559	1215484	1106377	1250598	777353	109396	236931	319294	374604	437576	462912	873664	394099	524359	272563	392462	463486	660606	665793	583297	562937	145149	216624	138211	178778	272113	264778	217832	162749	296441	130855	143923	119471	115563	111295	103963	181204	104028	62720	83494	58763	198770	187606	154576	154597	142231	144464	132508	132575	156800	133268	82395	68787	81921	64352	206169	195657	163509	183517	158329	145377	153055	144146	169072	137481	36211	43068	45646	45115	103751	107978	43941	50247	76342	52126	59151	43970	55946	46679	51892	36367	29743	21769	98550	111189	46834	61325	59426	93678	72508	32542	37022	32550
HISTIDINE	316696	201084	193923	294146	239900	294925	256909	275748	481366	324033	292010	350672	264821	341379	322574	401213	494896	133440	212112	278536	298540	257194	292926	249988	242467	189270	221817	424367	190893	247968	251155	179541	268274	333796	518207																																					549234	871937	551656	734578	361001	598838	668446	489798	303810	656369	586057	424495	586070	1833243	1102588	1145090	1882397	827301	1269681	896067	770607	822279	778261	1145276	800065	817020	625414	516574	609697	626648	1102996	506569	507040	547342	584716	701785	972214	587731	654100	10875	11488	11479	16781	12099	12299	12154	10838	16051	8018	45258	37153	56089	54644	100738	75087	79360	1871177	1666886	1521564	1288804	1605572	1282359	1208034															1809753	4191704	2803325	2449880	3667329	4462142	4107955	4695716	6603678	7018741	5616906	3427176	4366314	3303024	3754801	2556211	3518054	7369932	5190054	6159934	3771024	7211128	6745842	9516758	9261950	9595221	6267650	4974456	4178468	2877102	4026497	3670492	39993	46384	52790	52319	49976	61136	124810	64000	82984	59343	107977	76781	80972	70673	82959	71956	3004252	3459502	2663580	2715542	3728155	3080493	3357082	2290621	2246950	1824652	2374984	2893659	2524330	1657802	1700207	2358025	1004311	693028	774028	967022	1895015	1440197	1611717	1387445	1880908	758312	639043	770302	672709	725945	1463376	1180386	1569124	1730815	2075869	1843426	2104970	1596615	2154629	918456	1391774	1201763	1487125	1581034															636875	535488	608676	496632	636830	662840	418662	567860	567488	657269	631459	447577	665133	430869
HOMOARGININE																																																																																																																									26765	24873	84641	40298	7725	15925	4880
HOMOCITRULLINE																																				79991	89351	109060	77942	62156	81240	62899	86231	86179	27776	71083	84440	80125	76398	60746	71722	11672	11149	12914	13227	10840	0	10037	11160	9161	13700	21437	13788	12665	10174	0	17503	16422	0	0	13630	12276	17220	11859	18947	14297	19175	23467	22606	19480	19168	9178	10103	11701	22274	21011	19981	20036	15025	16602	22724	23536	25686	10346	15163	18178	7720														34619	26931	17310	37274	28965	24862	38630	32664	42543	28075	58384	64345	83542	36038	84796	146690	55020	11451	11469	10453	9932	28224	23937	28241	8137	9959	8893	13348	7421	9734	6388	11322	12372	13631	12061	12695	15223	14465																	76104	110150	64773	84660	74971	104867	90100	104658	121844	126387	91217	132809	178658	162229	177913	107300	131147	278808	602982	462364	352083	503051	640276	364090	448719	413676	432750	609999	638754	693352	735517	729371	83817	113656	79896	78538	80583	51876	90793	75580	82012	123065	105079	48487	62401	87650	87233	101949	16718	17616	17727	23646	25585	23368	21187	19565	23652	34928	45090	36301	33743	29951	18185	18233	19692	24691	21295	27636	22447	27805	29303	40921	50014	49774	51301	44315
HYPOTAURINE																																				7040	4500	10256	4986	3727	5287	2170	4145	11074	11161	6426	7583	6767	9396	7427	6939	4464	4565	4974	6625	4736	0	3808	5467	4027	6898	8209	6346	12561	3495	0	7945	6156	0	0	6371																																								3932	5475	11612	3986	2882	5635	5309	2822	3282	2349								11297	9899	9931	9786	30281	11791	11664																															7087	10262	30967	14113	7777	19365	18590	14007	9771	9094	20530	7256	10827	6159	5874	5490																	44543	50376	32554	40655	44840	50149	39895	45101	48930	31824	34509	27325	21577	26655	27556	34827
HYPOXANTHINE	59875	25774	20178	34135	36257	57091	210406	39548	61502	50720	56328	41732	41590	51048	28660	37651	43727	59254	77875	72037	52330	38451	56803	55714	32793	46087	47696	227371	48062	72341	155577	50383	55888	112475	288710																	341	64766	20552	9926	11067	0	16124	0	174	144	130	17411	507	12251	0	23433	11231	0	0	0	263231	128245	229062	215628	61927	72300	27939	44700	51205	151056	246576	333705	174902	578980	111078	177959	172327	107855	232574	127093	110820	123577	247877	294084	308445	286910	0	0	4795	226	51351	0	39251	52072	0	32019	121792	21254	12804											45342	39323	45688	40861	24117	50604	32532	140388	147037	146667	36721	716926	378931	323403	661070	101830	139635	145173	299191	130906	162628	163470	5886620	8139422	8689358	1495259	8605254	9779656	333886	167323	223990	316499	137035	83481	163189	77113	107480	116384	175348	2818916	1261911	1222097	948053	651497	420961	229063	1107086	600249	138668	491829	520132	756450	404400	388057	585516	962103	1093064	867452	1809206	1094661																	18996	10001	9082	9560	13261	4940	5463	3650	8673	5251	13948	386675	6505	170845	9400	10083	51636	43829	78707	88775	46409	39849	47967	29791	40552	245802	117598	162864	106450	146755	159198	66844	66501	63837	43020	51902	39317	124840	26503	158405	578424	284945	496091	396384
INDOLE																																																																																																																																7916	7628	7549	4780	8344	18418	8411
INDOLE-3-ACETALDEHYDE																																				27346	17252	21805	12903	12106	14011	15122	6997	12484	2557	10862	5941	5411	12920	10941	12390																																																												16713	28921	22267	33226	27567	14130	26661	29963	37236	38713	14361	20085	25990	17761	11850	23915	16054	1638	1609	1880	1252	1310	24341	1375																																															28296	67752	190340	132444	92566	149279	163955	156518	123411	53245	83992	54766	132722	139424	111276	147440																																													16491	13156	17036	18479	47717	35434	14990	13387	18185	18705	16310	14099	15549	16309
INDOLEACETIC ACID																																				2989	3755	5670	9571	7337	7948	3704	5813	17007	2133	5409	8397	4472	9226	8651	4471																																																												10425	12297	10229	5633	7465	5749	7365	7388	8434	3892	20824	20538	20970	17418	20426	26958	31982								4010	2308	3069	3207	3232	2050	2041	2591	49097	52804	68223	14373	18074	24618																																	6214	15420	38956	26994	23406	27845	85409	38332	82961	29197	42228	18390	31915	28331	17753	14659																																													3212	1569	4653	7419	22520	19755	6981	7010	11363	381	3890	1213	2260	1452
INDOLEPROPIONIC ACID																																				20350	19116	21698	27663	27112	24262	19298	18320	28530	6605	24388	24392	22976	24576	17520	18359	231	18788	27864	0	322	0	16148	143	0	498	104	0	285	107	0	240	912	0	0	695	1690	2003	1310	1784	8585	10828	2309	9245	2258	48397	87648	44797	48033	3139	1433	2648	1998	9787	7876	7803	2918	2407	27546	33973	15334	103533	0	257	123	258	0	0	0	0	0	16483	17355	12282	30350	13975	20859	13383	18248	15697	15267	16362	10030	12973	7167	16045	15106	13636	12692	5642	3995	3904
INDOXYL SULFATE																																																																																																																																																																																					235	243	319	233	948	616	336	712	876	1096	473	31558	33602	34114	24361	23836
INOSINE																																																																																																		0	0	26576	0	12683	136	46992	49396	120	64243	57508	47916	72460																		29009	24077	23189	11721	194117	114476	144789	194163	62193	77929	76504	127658	90154	110816	109854	54276	142648	87569	8289	143962	112204	230738	217406	166065	238562	222703	217965	246116	262451	233414	246481	196509	74073	24880	40512	48360	57054	221873	278176	326426	286466	248841	359267	297870	282568	309169	317822	271137	154117	131599	100819	119908	109483	2701	4830	16467	8650	3767	6236	6764	7728	2476	7572	15766	2827	8996	5511	5030	4086	2914	2320	1290	1774	4645	1169	450	1572	2138	2311	2866	80564	1191	224189	2431	8785	48303	60407	43954	54793	66601	66849	44452	55345	72183	34411	22852	30346	28225	26480	51464	44624	58248	50616	54107	55433	60092	86645	58292	21691	30848	24450	26231	30403
IRBESARTAN																																																																																																																																																																																					9328	9990	8620	9995	8976	9349	6634	6837	10738	6839	9300	7782	10149	9500	6181	8257
2-FLUROPHENYLGLYCINE																																				83332	86526	78639	96108	87093	101839	91182	98552	87051	103776	93598	90562	89794	85593	90959	87022																					1342985	1339493	1242097	1343645	1361026	1201328	1291098	1271366	1336112	1115311	1003707	1218549	1074586	1264536	1105501	1153054	1311173	1049755	1162726	1040123	1048574	1056588	1168080	1182711	1207033	1111914																								84507	88367	139716	117363	149584	75965	126542	167869	169993	157931	142110	139875	132435	150285	93153	95917	108617	109400	99799	122527	105489	117831	130751	124609	146738	377626	82815	87654	242270	270578	255547	238767	260527	279439	258111	256441	270814	283330	294874	234799	286502	244679	249519	233632	251010	329946	283354	299235	224690	335759	313483	461582	377699	365271	332598	288721	284744	231981	283906	286130	132687	117607	125494	130713	132813	125629	133745	130575	145436	121889	112728	136316	140583	160814	169045	262040																	49607	44094	45573	42617	41977	43009	43625	51223	58922	34315	43251	41163	41103	37699	54883	50303	52250	27250	57208	69687	65153	59379	68081	53172	62655	53599	67493	58658	42690	52309	43393	45857	44952	62103	73835	77775	48564	51111	41626	42854	45236	44349	100148	110544	113355	91544	109298	98374	96146	82957	70403	96038	80512	91496	75870	87196
4-BROMO-PHENYLALANINE	155666	165147	167138	159479	164115	166937	156352	166084	172703	183118	188253	174358	173960	174867	170165	182782	171954	168090	167210	172818	181690	147083	137863	144670	152559	146747	161566	161161	162158	158572	154742	157548	151679	149568	144748	166375	182033	152492	169995	172952	176417	171197	182023	161459	208200	180807	165409	170355	167766	173910	174121	237622	254505	312043	427951	218505	0	257648	240922	235890	344717	455979	299305	249493	212313	0	462656	357402	0	0	320448	836674	859182	873396	874382	913989	867482	868224	886255	918645	889236	867657	890694	893909	830873	850362	859766	865903	881619	870102	909667	893671	885077	878030	870406	896050	878174	193243	197740	188295	198657	196478	202293	192483	184081	211946	181326	184501	182969	184575	157951	158661	158803	157150	156008	157446	156764	160917	150590	154537	587336	582301	578744	571679	536277	482758	553858	645871	611550	590297	545288	479689	624223	482526	505106	540177	518280	407689	521129	488846	514340	540308	405871	521408	544041	539623	517395	503883	1283734	1260446	1229191	1259034	1296242	1327255	1291342	1269141	1210866	1099755	1332274	1252414	1225062	1218323	1160644	1231182	1245636	1267410	1249403	1267256	1109313	1256673	1173176	1300452	1304824	1311191	1343043	1267238	1294993	1249146	1157966	1276532	1241700	1217223	1216349	1254325	1248319	1234220	1231955	1241749	1176992	1268826	1223027	1264427	1269072	1257858	1251466	1250712	1419352	1418115	1347732	1333385	1318415	1297384	1307718	1293194	1274888	1278340	1290761	1260980	1257028	1211198	1255676	1257886	340912	338427	342415	345983	329806	338426	309378	324479	349657	321660	322266	329462	329570	280547	334729	341067	315518	340449	341002	342297	355525	348431	331108	342193	352177	342162	355313	338712	301638	295595	306104	306821	312511	315963	334050	337139	331216	320004	332114	327444	319377	327208	353516	335094	316224	313828	323958	304681	313032	308810	312733	327551	326575	321362	332093	324464
4-CHLORO-PHENYLALANINE	162276	184466	187409	159374	164913	171934	170662	180364	194125	206410	201731	191347	193441	193584	191224	200557	194368	173755	177597	187606	205026	159539	147746	152530	163769	155678	179995	173272	174465	167351	166480	171707	169982	160535	169404	271528	318553	252435	295053	294803	306600	303256	329124	273308	376435	323394	268607	296155	292926	304032	301686	386359	425544	518576	724206	349252	0	432542	404231	383336	599748	799193	497867	411999	349122	0	792739	602961	110	0	523028	5259540	5256928	5157400	5343485	5599437	5148772	5570844	5261937	5539658	5335476	5066114	5278340	5144137	4922550	5017676	5088116	5165654	5048354	5030736	5129750	5159810	4885240	5031428	5217352	5338862	5155137	323220	335249	311252	337308	333786	346106	327193	297373	337729	297537	302480	290651	283021	258316	266343	266679	263009	268011	257795	270597	279112	258704	267226	861918	858757	843767	805242	783794	694471	766375	883499	847982	809577	771467	690649	770028	682658	366564	330333	356418	329444	360911	364552	355763	374176	269692	341981	338389	337465	315692	306355	939630	911622	882649	869572	949906	956396	908046	894282	858479	794344	928710	844871	873883	845772	820263	862947	952470	938510	874372	883237	742997	946974	870916	952614	1029406	966175	999856	893913	925352	961082	969938	961666	1498124	1423016	1446127	1502010	1513556	1471036	1502735	1537408	1404103	1516702	1469687	1536342	1540749	1512491	1560358	1569138	1844902	1831368	1779794	1785509	1784086	1722977	1673747	1680055	1707061	1635050	1628516	1528850	1547332	1446898	1447304	1367574	219599	207510	200380	208295	205620	208872	188040	217482	268341	176286	203851	200371	204456	170715	172071	199527	186293	205636	206890	217401	206903	207744	205089	210969	208049	206654	202269	184919	346474	344274	365421	360929	354369	341460	356862	381816	358581	356452	369813	371404	350699	354399	395418	379624	376032	376688	364380	352335	357084	325348	338873	364912	366003	368131	374829	358818
4-HYDROXYPHENYL-D4-ALANINE																																																																																																																									23820	25842	29159	23102	24726	23485	20246	11958	10609	10751	10765	10482	11349	10495	31471	29355	31517	34528	30643	37022	34799	35730	32188	35834	38802	53662	61502	63535
CARNITINE-TRIMETHYL-D9	848096	1528270	2004245	1111170	1160359	1261251	746113	1240565	704149	1262246	1254038	602498	1357970	1143429	1357405	1169130	1149122	1123669	1026826	1072266	1023880	933201	729616	919113	931264	972270	581538	745299	1210145	1022851	1013604	1154865	938044	752510	307253																																					5311292	5586116	5656896	4398636	6104012	5273906	5329412	5206006	6434013	4772046	4373224	5103470	4895332	2430684	4447059	4351228	4466570	4242660	2583186	4009805	3876395	4010283	4509604	3962742	2952806	4036999														1588245	1333944	1928881	1223376	1457537	1832639	1419744	1500943	1244018	2093513	3477980	3438388	2873243	3288814	2611684	1918739	2983472	112983	117622	129924	173043	146406	172737	135034	448516	1025005	826792	669134	1407991	981790	938715	986542	924370	388205	362893	780924	489835	1045388	29224604	24960016	25178086	26143720	29284446	29073510	26934258	23645762	21466314	21044626	25274082	21521914	25562120	24505230	24301162	27860110	19859878	9551932	20126900	19082346	22167064	20075976	19767286	9682747	19221306	18063640	25800810	16149607	19467946	20221826	16788274	19770902	50183804	47016732	41507388	44341388	44771136	42616584	37814648	43535948	43126596	47600644	40354532	42962048	43993108	43695948	37223872	40305256																	5967190	5185342	5342614	4672323	4201324	4992323	4653872	4753138	3708243	4152869	4250962	4768462	4478070	4009523	4610086	5077578	4252734	4267886	4104926	4059462	4379073	3834701	4168577	4600824	3496419	3459828	3451548	3244934	10264726	11418299	9083170	8676709	8372994	8583938	11169794	12387707	9574997	10251304	11169570	10219432	10388279	9228582	1523509	1402661	1442025	1528495	1365092	1319093	1389031	1435340	1320269	1501696	1381591	1192376	1276285	1149479
INDOLE-2,4,5,6,7-D5-3-ACETIC ACID																																																				12675	62164	63905	87281	10496	221	43071	27517	14005	69182	84609	55586	30531	11172	0	88405	71423	364	0	65226	356697	309191	298268	341060	417109	307957	227721	296455	371937	152989	344693	205642	199964	1257	10294	302300	72643	228568	63744	5904	348778	84942	58138	80580	25992	387259	10008	9839	4673	10850	12653	13854	11377	12245	11553	7121	5535	3186	9169	60933	36996	45649	25475	24525	39674	35067	51974	42226	57040	16053	19010	12487	16356	13505	11782	16411								9555	12797	11987	11585	19250	11370	12946	11035	7521	11147	6775	7324	7058	8477	163442	154306	131803	157724	153069	162422	159652	155737	147175	143770	159282	136477	135743	142474	143911	147349	169104	168900	173624	165707	156537	157794	150763	174331	158120	169628	179958	147823	175564	154993	151584	165831	353459	348111	321083	322510	321862	312318	304612	323125	300927	271128	259114	218525	216294	210279	203257	219467	91965	89852	84069	78405	73055	81402	76173	85879	75697	76240	77575	90946	125654	109191	115292	97211	39919	40825	41403	42295	40568	43281	53215	36878	38504	39958	39632	36837	42928	40782	42483	45164	42915	48279	45225	44862	42750	39351	41149	44990	44710	41709	38337	40486	38379	52479	42443	50714	47307	29297	53613	46992	39670	45348	37760	53383	48818	52108	30451	28624	28704	26924	26626	22892	24960	25997	24956	26652	25127	27503	27234	30514
LEUCINE-5,5,5-D3	196398	300353	298776	148444	224488	172164	84812	227289	149028	162941	265621	199484	284065	259945	267813	148230	183102	179179	231772	229871	126849	149594	129825	197476	212539	149076	156660	108621	153095	211436	125417	228166	211207	114155	163552	291257	303574	275485	340425	324464	340635	318147	343000	289664	357909	331248	316673	316724	306914	327383	304180	163997	154916	192180	85034	139177	107	180426	154801	154137	195895	214917	186615	150027	149576	0	229152	217243	133	118	178984	1167340	1134257	1157578	1201264	1162244	1104133	1126037	1111185	1206101	1131578	1102126	1167369	1126354	1074629	1122208	1114457	1118796	1086295	1009695	1108677	1090709	1093270	1157173	1094805	1136629	1101983	83736	96354	93049	97715	91609	97751	123388	93452	94514	112613	82068	89190	96285	117324	96374	150718	92762	98380	144613	96288	99637	82490	149282	312199	243762	291184	337264	330225	197097	340154	253671	265204	287364	318572	298445	280335	313505	304924	398762	385624	335848	340369	408715	378469	421539	256794	280476	293279	386711	244243	289136	1710384	1484991	1491481	1485503	1549401	1546184	1540549	1387391	1217996	1152642	1404290	1346974	1321321	1304782	1263976	1406982	1319474	1287101	1259447	1303884	1241834	1300138	1271362	1313351	1261612	1251878	1476204	1238002	1289459	1246730	1246222	1371577	1374322	1247930	1196364	1283711	1155710	1203178	1097242	1230922	1217870	1208896	1072095	1189148	1177521	1212728	1153349	1301081	1328069	1275759	1300721	1333444	1263453	1313395	1266463	1249358	1217248	1268566	1225583	1301005	1311310	1287346	1333835	1217050	354187	300816	283024	300058	280578	310314	270191	274752	263918	287881	265924	301101	297356	248500	298450	302024	283765	302186	284842	289199	275072	269288	274136	301451	273061	263298	265264	257001	202358	250579	166071	183306	211951	214357	257556	280517	234679	229662	187249	206772	220517	198048	267356	264384	265953	273087	267204	256845	268618	257015	239563	273395	270808	277720	263882	267246
METHIONINE-METHYL-D3	168671	199306	167743	179930	172363	177877	144018	166843	189426	201270	211381	198440	198396	178609	189342	196578	194655	180527	185898	188278	198170	158956	142495	152063	165735	157841	168798	144483	166495	167667	157588	159259	146116	132105	131135	40382	41294	34560	38668	35705	42364	49974	47169	36314	63169	37830	32087	35735	36538	43386	37465	139660	154121	211886	287128	127228	0	158059	151684	142636	235839	332632	216364	142388	126005	0	343717	253439	0	124	211913	858732	913826	888442	925429	950735	900931	900310	964301	964621	898582	889466	924611	940744	817330	865316	838062	912532	896718	844809	895703	888408	875440	910164	919701	903163	879008	138990	160970	154289	154425	150977	154686	141125	157842	144493	136620	130843	140760	159620	89305	93243	100987	91914	97169	103310	94665	107119	94592	107675	508066	516210	549234	562472	547115	423514	550658	619968	587039	617466	622059	589185	603060	597798	501800	607196	597906	591501	584920	610970	601037	621147	386402	463819	456470	456572	471523	488417	988494	937288	934978	959952	807832	825068	801133	813752	753886	682106	829693	936743	918397	988160	946806	887899	906457	917992	865803	889005	682963	765452	712192	765142	781148	752972	816924	885244	940812	910048	895736	947570	691092	679571	760126	795145	714643	754970	798264	789115	843623	820653	776450	905825	938882	957874	907483	882262	938595	906522	892182	904771	857642	856194	826172	857720	847663	845774	797776	745636	731275	729420	728963	716658	189364	193369	209878	206853	193656	214021	199187	177099	183962	190439	203086	209504	208529	182772	206288	214395	207896	218452	209846	210841	202473	179023	198354	228798	219092	219595	221776	216716	166391	182404	164709	183999	179266	197099	208409	215365	187895	189287	182820	182934	189090	184270	240700	227921	230346	232225	217873	204304	219383	202628	195007	222824	225010	225076	218154	212546
PHENYLALANINE-2,3,4,5,6-D5	312325	396179	417206	321079	336856	333783	289284	349195	339920	382891	390422	392528	394580	356982	386474	384572	375456	347550	345369	344922	341044	288325	262163	292192	308543	302016	340056	269899	338649	318287	304984	321074	299562	272220	247030	384879	391178	375470	420375	408734	421774	402104	421378	385211	408461	405542	419897	390794	397817	425786	407671	201448	130043	131498	88593	167072	1016	120185	142937	161557	113301	105832	137257	124554	155879	1000	105953	138179	936	2813	119785	1250601	1278616	1294988	1272864	1311427	1199840	1279557	1261637	1310234	1319188	1244800	1328199	1274401	1156792	1278026	1292918	1291966	1238866	1192080	1247404	1241174	1237045	1271716	1262563	1317455	1243830	199117	237671	190128	224653	193473	196734	177079	171768	179443	186664	163703	186660	221357	284129	312042	337632	302053	328584	301805	311710	364789	291868	363809	1495731	1477617	1456492	1537965	1440800	1225232	1471730	1261084	1268116	1259889	1395965	1328719	1184466	1380402	903350	1219802	1159686	1066878	1103910	1106897	1109646	1136844	914052	1070917	1082932	940318	1097696	1136623	1978793	1861775	1832237	1812425	1990375	1934890	1892890	1906570	1729249	1561117	1947421	1689736	1675790	1668244	1577236	1781380	1813888	1813076	1749620	1803529	1620344	1798800	1734392	1819227	1854898	1803215	2000520	1733752	1791628	1807940	1615496	1856124	2698730	2975458	2900304	3020977	2197747	2688072	2583802	2819960	2675651	2467162	2542762	2701276	2427466	2370256	2734447	2792878	1776082	1749109	1673236	1744710	1472904	1526702	1236209	1144116	1294938	1378662	1239464	1739368	1538980	1522027	1822395	1465055	404111	337477	307147	323969	290609	320259	299417	291185	281285	314699	282924	335338	313484	261727	321764	324154	316289	322334	303301	309139	310306	300648	299208	329128	290099	299655	294392	289540	176422	211825	152210	172987	175892	163860	228783	234189	195558	201207	166364	173935	189546	188875	266553	229340	240697	215799	203624	198717	198814	174039	169900	220549	207932	211832	199345	185643
PROGESTERONE-D9	686505	282527	380367	440799	602542	301081	441418	319565	795071	497942	1071666	705333	538901	1611800	460160	531884	703899	746412	586421	823646	656498	720168	777095	821278	907569	816552	1404825	917766	698195	780016	736701	678557	847450	910200	701346	351254	341994	346718	215627	277199	253986	323032	323492	278819	336298	267461	274186	252468	289338	257893	295456	792647	678519	1020612	830299	886885	0	917650	908159	810968	1129652	594636	813934	789206	738381	0	789671	905111	0	0	1020311	1772167	1508341	1732938	1752125	1770110	2660876	1755757	1846282	1727831	2173834	2793036	2178408	3005242	2320709	1353774	2005607	1528641	2717152	2697605	2282564	2158725	2182748	2168985	2862154	1774524	2120575	912151	1155151	870157	979799	1012725	820235	1076656	899807	651076	523610	667930	565541	1047895	444404	402958	399306	370103	379686	386129	374728	426731	400183	427784	1067804	1050117	810159	837311	1055775	422931	914241	312368	399305	451318	462621	413569	239103	327670																															1630326	1474904	1549146	986889	1205871	1545974	1428304	1755623	1234260	1523815	1360316	2048786	1928189	1796198	2264288	1802016	1097812	1088456	1053687	1037551	1142180	1062175	1027271	1071416	1055753	1059834	989309	1137051	1062592	1059359	1119834	1059828	2060111	1912272	2051628	2262064	2196353	2332988	2265120	2499361	2340646	1770426	2068463	1677915	1548740	1368975	1629432	1134868	355217	346999	628236	548614	348259	446512	516908	671569	706080	286818	646225	657258	401607	306828	485746	343073	360308	345511	552219	505737	443258	404475	376857	634094	717700	575149	581964	640224	313999	324523	316026	333485	344881	323489	350803	332691	332973	337267	305846	333153	343897	348904	566919	657911	692946	551386	545303	441944	505470	504270	465494	555943	488557	654241	597988	565251
TRYPTOPHAN-2,4,5,6,7-D5	172403	225619	264280	190065	198115	204567	162245	200734	184350	236661	231086	212135	227507	208175	230589	225256	222215	221070	215860	224719	218046	183184	164235	184439	193393	191354	207565	173513	210947	195946	191034	206650	184836	165086	162456	207255	209311	193340	215655	210132	209984	205804	217362	199238	222918	212920	208572	200252	201432	218142	204578	44120	31126	24303	20996	38020	132	23852	26754	33751	24324	20106	21109	25376	33605	138	18255	22325	0	0	21953	869009	874652	877109	887397	927379	859500	888281	872217	930522	896236	838629	881141	862641	823371	876296	895536	873941	882436	867337	877004	872484	880235	892058	881605	886864	884852	53082	62287	53927	66197	58416	56753	59159	52115	52651	55661	52562	57246	61867	204559	233409	252756	215294	255228	199474	224898	277739	226210	256317	559864	700049	709934	856702	654279	638972	859485	141418	142310	166199	170827	180369	140238	181912	537205	640555	607827	485135	542984	479649	564723	607038	552015	674147	676069	623364	705198	737363	969694	917746	910937	908474	957104	1000218	910963	961296	889566	845377	974744	808980	868188	836679	838849	876815	890906	939723	938790	956439	849540	946362	893800	994037	996643	974868	1081068	914531	938980	901015	883102	981713	2731557	2458471	1687754	2137097	1897469	1932268	1253402	2019566	1818738	2113051	1780198	1707423	1706067	1715908	1148700	1544617	297827	249023	283870	246726	223915	282889	214230	228941	224499	240735	249164	314588	313750	303933	341313	303154	228956	197531	190919	190175	180890	196920	185813	176700	180612	185065	171144	199466	190183	164802	195706	194895	189832	193352	188313	192196	194365	181758	183278	201797	190643	186097	188376	185596	132191	153859	110445	120953	116470	110318	143322	156375	124757	134047	125557	119108	123278	125566	102047	101247	114094	106549	103313	100812	101127	95448	90346	101232	105224	102314	97834	98910
KYNURENIC ACID																																				146242	106204	92702	122972	81136	101982	116652	91253	101755	58822	108610	121355	80819	115965	102640	92458																																																												50520	54077	63705	45646	35126	40678	46386	29796	46312	36594	170682	174831	196021	217350	174001	177274	171907	23454	17316	17594	17947	6438	8045	7230																																															172973	213541	496973	286483	334979	355130	456882	328805	531855	300876	438462	370709	488031	554358	571925	495889	24652	37667	35424	25873	10466	12829	18443	27085	36817	67893	29954	9977	15207	44748	51066	87122																													44477	44165	65786	85694	177301	161208	54930	64258	107896	81250	103643	60858	55807	88688
KYNURENINE																																																																																																																																23887	20918	24824	18493	26185	39025	24130																																															48373	59640	64825	53030	57380	68552	76941	56642	57553	52990	80316	91214	59913	73079	79882	124681	48548	61963	51771	58258	28261	34650	27530	31970	34131	60504	37046	48474	34146	40230	64769	72531																													9711	7931	13278	15941	16400	16030	10431	12763	14863	9025	12164	11675	11762	13059
LEUCINE, NORLEUCINE	647612	524066	348981	796858	876585	364204	229415	475155	732196	362698	337457	452900	470868	899649	592009	372272	749871	662808	907060	1208385	475850	746168	548935	675345	671503	452960	410220	1332237	367133	764057	926977	490564	793352	1090721	2857385	579032	271158	427319	623140	740101	446503	331590	305484	523031	182568	670727	593942	762894	578844	638262	694600	1327358	996887	1039055	1399418	889593	4500	924926	950105	1020947	1259836	1712530	1350614	821778	1010821	1736	1645122	1583466	7441	4399	1113028	1893648	2566427	1816627	1746202	496186	588788	1658307	618445	588665	1411795	1309054	837063	1362304	8466816	2430407	3025454	4138379	3640287	7134946	3269513	3711591	4030352	2823798	5349595	3897398	3869527	685778	632683	535047	854604	629822	1003729	795929	774450	637180	581489	547677	804712	635757											107696	77468	107831	119548	48941	63738	39670	1905825	1733734	1794436	1557401	1699670	1845638	1858159	5570208	1483510	1903316	2233758	2338692	2075236	1975116	1932609	2391111	2821122	2294744	3113756	1695219	862408	5491774	7089952	6399250	7197384	7999334	8657299	7910913	10378722	10913446	12702448	12649055	10139868	13549500	10127387	12379637	8519542	8923886	14138376	13737070	12884349	7841030	15823351	13920691	21454306	17284386	18627418	12969028	16671492	13947568	7853058	13490039	13716172																	8348264	8939600	8040101	7973246	6527374	6530566	7477712	7048276	6785349	8707180	7795689	5751421	6118346	5635920	6378243	7219208
LINOLENIC ACID	91772	43709	25815	82975	105282	65316	102847	58785	47819	35560	65161	45961	53171	132443	22654	52932	65827	47876	53288	70364	66746	81463	103229	80998	95038	59894	192437	111008	75873	22284	59283	91079	107365	117565	68567																	51786	36992	28887	47600	41787	114	19520	44810	36322	47593	40632	47506	66183	47603	121	45589	45706	444	145	37487	384468	310710	378191	276214	159271	657242	196578	383107	193307	381374	533750	620100	687284	383780	152514	279352	192767	338110	282642	464842	529378	415223	448917	482785	257732	278251	106094	38641	40502	55726	28994	40606	39985	26526	29196	53139	57584	28616	37902	1513	1300	2454	1680	1807	2314	2602	2062	2447	2247								40009	29210	29188	30862	20638	21786	18245	79816	74400	35418	14976	48536	34994	50154	67313	29849	43204	24750	74276	44367	48231	90143	237465	324950	164850	341922	524283	285476	384012	508390	352011	460785	261437	232372	275985	196209	427104	170982	189850	171359	176045	243313	255871	332818	218199	246962	384595	214119	388471	314302	192926	324067	265269																																	62110	68339	113546	88384	91930	104792	130081	114288	176081	78225	127377	103934	80941	106013	43634	38705	36934	28647	68629	50079	51843	43665	30942	82969	51566	62890	70566	70187															48889	49444	58332	37212	42654	36287	49405	45577	56040	47010	46404	42100	68477	57083
LITHOCHOLIC ACID	4535	2549	1969	20176	13117	7988	9617	8306	3529	2487	2027	3347	2172	3062	2178	3268	3088	5694	5636	5712	7821	7110	8924	9813	8340	7409	7817	12414	10084	8987	6484	9004	6157	10112	19639
LUMICHROME																																				18930	13360	20249	51668	46715	32845	27724	22621	18852	10937	10013	44294	23657	28953	9563	22949																																																												14188	35270	25674	48097	47852	33974	41546	19777	28219	13829	10573	12715	11331	8734	15222	11485	10306	12410	10050	9877	5206	3571	2344	3493	5479	821	1262	574	656	1246	334	1692	37249	41966	56279	83122	43234	52358
LYSINE	347052	282422	283588	370400	319413	346021	510153	351465	482976	411696	387521	462758	377687	473081	458800	549012	571631	245728	360965	451093	308642	337968	370817	350267	331798	226651	400207	1046537	386047	512781	563755	414366	476617	629572	681899	18951	14538	24855	11866	24183	20077	12172	13159	17853	8523	26386	32499	39973	26397	18016	13877	1265701	1331835	1320139	1820236	961154	2427	1189598	1388862	1552920	1475974	1634316	1548821	945460	979304	1601	1541928	1634433	3930	756	1348931	458842	655374	439845	530508	633269	749165	840600	646758	455003	550270	522148	381876	487650	2331360	1016863	1089650	1407663	1662436	2728215	1903808	1692994	1887153	914762	1373952	1149021	1057334	1393472	1551202	1497455	2038328	1702714	1703778	1432396	1793048	1479959	1110252	955912	1134024	1221449	11379	19877	14654	17094	19115	14946	19842	16146	23731	9718	33261	35090	49799	34441	29448	41580	25776	3746402	3233116	3262890	3079623	2344841	2606848	2275867	3360111	1428971	1513192	1880681	977628	1211778	1021944	1075416	3737497	4519622	3821326	2190761	3911476	2298398	1891685	4149334	2978405	2870213	3109420	3800966	3555003	4545684	5773448	6371668	4364916	6292084	7926999	6227442	7018500	3982964	3472329	6955314	6632071	6515418	4267440	7551084	6669428	9906456	8451077	8822969	6502808	11804111	9539710	6378201	10058072	7957389	53056	71366	150850	79316	110946	125503	234234	108150	134936	86055	135114	275846	294654	420175	366820	341924	6012803	5932063	5682042	5828788	5143438	5872677	6674106	4997594	6561327	6853690	5354355	5384680	5387191	5026489	4496020	4966178	783063	674166	767669	882182	1438514	1115110	1178854	1300060	1618987	1489223	1516201	1280672	1645695	1544926	1839744	1099947	1446029	1499424	1743145	1752031	1632692	2131658	1764495	2289557	3602166	2802280	3088700	3361955	14170	10435	18091	20250	58072	54085	14729	9792	18198	20960	22086	14839	17667	19624	1403422	1252699	1255443	1119703	1339412	1454460	1340804	1245346	1081469	1452124	1566130	1444371	1193058	1426875
MANNITOL																																																																																																																																																					373481	475372	471504	854864	10022	4923	57371	16541	7297	10453	49363	118644	67946	96598	36564	24067
MANNOSAMINE																																																																																																																																49424	45709	40991	32650	33404	26848	39510																																															54087	39191	121511	103221	85544	103198	151729	92961	105487	91229	132156	134279	158873	136066	185395	179062
MELATONIN	226	0	0	8458	6361	3014	8888	19227	465	147	0	232	113	120	0	114	0	1490	316	371	1699	874	1735	96	1181	109	575	747	404	467	427	195	198	1306	133																																					1406	2800	2416	3021	55563	30325	43881	47772	28389	1128	1636	5386	4274	2475	3347	547	3181	3300	3606	5067	4156	3911	4929	3205	4331	4825																																						470	1199	1136	725	108	0	1664	1507	7877	27961	26002	16527	31644	18418
METHIONINE	135742	74657	40091	182759	150553	126993	209223	131294	140014	79365	85069	83612	63624	116667	78114	97249	102346	150925	192113	240660	214627	171480	183199	158059	149207	122503	146775	375644	130838	181538	226915	115124	174713	244455	576032	7198	14304	18058	20115	25883	20269	12453	27038	18889	38929	24118	36536	46919	47400	45143	22367	410515	450006	380788	645888	364407	108	261780	458734	419666	450651	723282	971366	398951	313188	136	611004	631732	256	128	450491	349327	426073	326794	305952	275259	331077	488488	327256	209318	260032	247675	275211	213086	1350787	430498	489995	709313	696540	1153905	637794	688349	811202	447535	796590	603761	605303	367601	392182	367818	505748	334564	485380	264237	686520	378127	485933	353999	299882	323292	20472	24886	18115	32847	26603	34676	30091	22704	24691	12495								1261380	1026426	1054880	893710	500310	656886	471482	1595000	364190	471229	680643	429341	475228	496214	464392	1095807	1567153	1349218	679564	1071386	589385	787996	1054966	895590	859032	1241240	1283358	1200539	1458299	1645144	1845842	1591532	837709	540412	641578	588923	648868	1244668	2255570	2275390	2081184	1186457	2544946	2179177	3366489	2854314	2990364	1990915	1595233	1488025	857155	1485918	1679589																	2466527	2486480	2548836	2404318	3018729	2940026	3461992	2941753	2882913	3675782	3299171	1504101	1680617	1445632	1541006	1571725	214208	201402	220617	263750	444438	328695	388386	334045	497216	121898	218728	136266	122285	156164	605150	399414	522422	531508	599921	719251	638208	663993	623786	175935	484560	239297	311696	462130															579654	529496	428663	347774	411863	452659	633863	475267	394893	358179	516106	427098	444948	441608
METHYL NICOTINIC ACID	285002	67454	40693	56638	66130	14134	11435	29921	481970	110370	80561	179543	149733	274334	192500	87888	186317	99742	169300	165475	62012	141018	190311	82011	105435	77646	48524	64913	37128	78266	35501	37480	114870	82228	20501																																					11462	18595	20345	11178	8284	13694	17242	10457	10683	67646	106250	28106	31473	298865	400749	527479	301003	380709	496697	384692	511887	328877	334374	372623	437589	515063
N-ACETYL-5-HYDROXYTRYPTAMINE																																				17542	13623	16468	11541	14890	14217	10476	10329	20865	8844	12572	15178	17808	15366	11118	12353																																																																																				2001	1277	1268	744	228	406	1035	625	12427	13559	14705	3552	18351	15861
N-ACETYLPUTRESCINE	14603	13735	10012	799745	2006748	75801	77876	41279	12970	8273	13687	14430	12908	11489	12229	14385	13898	2174956	1785766	1480248	896498	1817702	2184500	2189551	2306974	2501574	58556	71169	124820	53966	73866	67564	89781	111118	150356	142186	176173	175152	176246	149572	143217	182340	146125	263547	129442	268897	331376	317753	318475	357087	275472																																																												42177	40028	96165	117355	95328	56312	96177	46607	84560	89803	136448	85916	81997	179108	132410	112988	149935								10472	14945	14441	19558	14387	19885	15886	18602	44841	39852	36943	1274212	56330	49637	167181	151168	164991	177354	1326293	1101734	1257005	1307160	1202196	1167091	970571	7310582	4162790	4939526	5076738	4844614	112674	134499	106480	126699	1040269	874784	974461	852420	1082533	1092774	867110	1044772	995087	1411210	1198392	980994																	20466	23761	23708	12840	16980	15738	36184	20111	16690	22598	18284	33523	30686	35712	19504	26734	53032	39316	26668	30819	279397	278717	212222	186924	226902	1909759	868354	1267444	1177144	901406	28917	24251	30910	28859	229155	212952	180561	227178	203961	904554	1031309	1202381	1263172	988960	21804	22348	30082	33340	46610	58475	20868	32552	48146	49992	27351	27356	29112	28673
N-ALPHA-ACETYL-LYSINE	97519	65002	40036	87942	123373	67836	94881	81181	116707	84542	78009	90576	73992	120528	82941	76454	100469	73206	86415	77975	82781	101784	118767	77727	93384	80574	60202	62248	59247	73477	68857	53869	72502	95650	94537	47657	33321	83557	39590	36451	30662	26475	44725	38528	14132	25382	44869	46180	43130	43679	36081	20334	17076	19583	32902	18761	116	15108	16506	16303	26567	45474	27147	13310	17097	0	35237	34875	161	0	25822	149806	130422	158206	133340	138160	175303	153977	157471	139836	159183	180355	149270	188096	62607	220546	234850	229185	165479	178043	219481	254228	105047	194186	125330	194669	253712														149544	212478	154085	256359	169449	172752	181171	114499	192060	125443	608725	600762	724430	511901	715655	698035	530831	45148	39516	37612	27249	35963	36850	30536	414097	304383	325419	324011	242148	235673	305277	235867	389622	434864	457713	417294	468510	478196	369416	424506	404473	332659	342538	380441	437902	468392	461295	379831	473748	355546	326790	415152	368366	315447	511302	531341	434456	464258	431654	451466	463200	457693	469520	482684	380123	586949	476718	566342	595450	588419	277185	417100	928664	628635	648553	753110	1215726	637458	931737	550395	897538	898484	1045915	1204113	1363583	1274093	106743	107708	90871	98860	83176	82536	86563	85239	94964	130175	88096	66141	54056	77004	70302	93553	217390	223818	203755	200831	145984	129880	156337	273454	273443	191069	205361	184772	169972	153566	238039	205214	197450	197398	146269	154393	160880	281340	206897	169651	191391	201304	181839	184957	112516	86550	205239	210949	297046	288768	101206	97758	178777	213749	134379	159622	131320	156106	25006	31424	31162	28685	24233	25011	23637	24871	27473	26412	25829	23996	26064	25713
N-AMIDINO-ASPARTIC ACID																																																																																																																									3552	3788	7743	6219	11034	14011	9253
N-METHYL-ASPARTIC ACID	3262	1626	807	50429	51695	39635	104551	37366	4022	2276	2679	2629	1982	2856	2152	3021	3601	75645	78346	66814	67978	53996	74855	61616	72427	72040	38973	107217	48054	64945	89845	40786	42965	74009	123744																																					15314	10862	12614	13344	364333	300704	276131	289241	264645	30086	26017	20653	30350	26992	13944	14867	18999	529455	556868	526991	602074	540187	27478	34762	27129	30545																																						11862	4881	5701	7992	6719	7076	7403	7493	69157	66971	72232	13323	147823	111776																																																																	643777	581806	394119	484257	801255	622103	555399	616690	708073	58642	69438	50146	52746	58591	631149	519302	631955	626724	667423	832261	795058	1024373	883022	58098	148553	91436	138630	245717															65960	44602	42673	35966	51943	57704	41172	45076	49050	46650	55360	34150	39365	38440
N,N-DIMETHYLGLYCINE																																																																								8321	10264	8961	13873	20988	28596	50813	33332	13485	191232	255312	186653	225942	13964	9357	17498	7893	31412	39171	25563	31394	15396	284035	220853	276443	216198																								137515	137130	87229	102337	226628	159590	100833
N6-(DELTA2-ISOPENTENYL)-ADENINE																																																																																																		35492	23054	12063	34156	39886	44170	29530	35947	23335	25459	14668	13436	38231																									228	7	1142	630	199	226	1049	537	7367	20125	17730	6919	15511	24839
NATEGLINIDE																																																																																																																																																																																																					8699	4016	4272	5380	5436	10949	14243	20658	7597	10850	9468	4035	11322	13235	9223	14764
NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE	459630	328232	255820	306979	265807	313162	407904	325124	523484	421217	422474	428149	330761	357184	355212	492378	481676	310349	306069	302218	382581	332857	383117	322068	335283	342446	263203	428376	300235	364743	430890	313525	334516	419202	528842	2196504	1667396	1885147	2105780	1862664	1908511	2114459	1471595	2601564	596122	1602865	2240011	1762546	2268108	1399682	1918341	277777	328303	382922	571974	240499	0	345795	284204	230253	421178	647711	337602	214770	259612	0	594674	616079	108	0	393245	966107	1135105	853491	1201756	1023679	1143748	1296281	930964	708315	879186	755757	620907	901738	1347992	1146348	1122969	1341568	1234350	1418176	1722691	1315516	1178396	978031	1109681	1122049	918559	263483	216894	243200	235980	328519	304785	277606	366376	263230	274266	251949	229773	196876	1821801	1920796	1870841	3063677	2079038	2156494	2365568	1835666	2420936	2006684	4135082	4259498	4108159	3993469	3593178	4516784	3077657	557126	515575	466892	384714	484157	562696	395628	869746	780892	714703	861835	691827	823312	664836	862084	454420	462574	308711	422565	461978	374399	4063526	5658927	4296317	5937415	5049081	4566993	5142130	5489822	6061132	5295624	4763116	5631012	5413746	4899266	5716138	3759934	4096132	6232329	4362117	5792582	4427378	4941146	5025745	6056308	5836420	5977972	4747895	6214200	5143677	4556098	6074834	5142608	2591473	4515776	9242665	6516232	5088982	5490346	7135432	5326553	8279240	4615848	5924428	7695234	7063056	8028276	10221482	8372336	1446309	1492104	1498613	1723793	1279820	1238798	1439828	1271726	1473860	1968987	1457587	1052995	884699	1068387	1228035	1440902	1473540	1421609	1271172	1309517	1566222	1486235	1304857	1437396	1674404	1697754	1289982	1384269	1497988	1357602	1387395	1284063	1530449	1499894	1571564	1506108	1348060	1669576	1510739	1404912	1740269	1682351	1722457	1719455	1329585	990003	2113533	2101463	2547931	3015751	1273993	1157444	1758545	1870318	1446230	1768328	1494923	1502122	452201	645250	646417	467005	462929	506000	488759	468669	431139	526466	545108	552077	530999	480020
NICOTINAMIDE	97642	42688	49401	62700	42495	49367	114306	79594	67081	56091	61075	42834	42061	111286	56868	85334	65042	11585	25507	16280	6602	10911	14111	3025	33156	10791	16733	12576	10338	2773	1846	8353	3120	7594	4123	997070	1256886	1377836	587620	775805	596930	656399	450148	575373	244062	697898	911959	915589	1010231	806193	943854	43399	1722	410146	155448	38842	0	3252	1895	19865	234484	197531	387012	357	43726	0	176047	527012	0	0	470310	218797	176073	267432	221829	835032	775466	584595	751468	729494	80032	92397	89004	80482	953448	248307	323910	275038	1557357	1994472	1461663	1673500	1605778	300269	628672	579830	444611														439461	549320	512604	736125	706707	704025	579384	287070	654702	412598	3428222	3420467	4208769	3604587	4114083	4288176	3171300	2039196	1992653	2284944	1683599	2566490	1721535	2483696	1874386	387849	335246	541177	152294	340886	291855	438344	321976	244855	415477	259013	116378	383918																																																																															551784	442995	327316	506843	210732	247935	220538	328778	413517	92760	218073	168459	192163	249933	1548864	1110067	2434512	2255312	2662115	3193642	840401	746282	1684686	2021540	1309109	1657201	1419427	1355391	469765	1011629	1030987	437912	1116690	1614455	1100581	946537	1409748	1278648	995113	1005922	1085702	1328123
OCTYL GALLATE																																																				2469	10645	18462	54677	2536	0	20961	5757	5465	44363	122500	15086	28839	424	0	64235	45659	160	0	16858																																																																																																																														10095	14285	16938	14311	11289	14473	14223	6423	13646	4965	2472	9914	15645	24868	8583	8327
OPHTHALMIC ACID																																				17690	13511	23956	10427	9091	9818	9448	5676	8695	2818	8443	11919	11092	11896	8480	12053																																																																						50669	54431	71075	44991	15560	15717	13939	1730	1308	1183	726	26604	37373	10737	24590	17493	26002	26005	15254	17106	15451	14691	14022	18491	18623	22268	23707	26749																																																	7119	10702	6965	6681	5129	8670	7506	6938	22147	7243	6748	3825	4278	8403	6560	12302	90260	90765	73910	79293	84689	85586	74493	74298	96277	28648	16900	14577	29384	13619	76583	76279	83436	79016	81881	78967	73977	83951	75545	22192	23994	19534	28059	33318	11315	9265	21320	21338	25533	30304	15861	14077	20040	15523	10293	13057	9646	14349
ORNITHINE	5556	4087	3866	3166	5016	2682	2734	3652	6973	7790	7689	6626	5626	7325	6634	6782	7151	2650	3177	3067	3187	3284	2179	2681	2603	1868	2903	3175	1761	1905	2042	1902	3062	2077	8807																	202667	125374	81158	240247	89889	266	100915	133724	134156	98918	172429	180468	125481	146085	798	115064	203634	1224	664	116792	20480	28392	16282	23876	29263	35963	28499	25236	23703	16242	9814	17448	14869	43831	35748	32311	37622	47124	96851	92546	73572	66539	20577	17360	10934	26283	103477	375402	103770	219895	494642	192943	334403	271904	192505	103394	269408	93182	71051	2224	8060	2875	3629	3947	3233	3935	4747	10363	3667	7861	7053	18086	8982	14391	14134	11799	792161	639607	935871	540726	385487	481014	318081	32524	25608	23305	27093	12063	17485	11483	15055	108323	96408	131847	132646	118592	162111	46864	88496	68879	60569	80252	91048	96235	102637	126743	111131	106489	121960	111584	109814	140158	66792	63492	108090	104847	95811	95741	113304	105189	157859	111710	116303	112058	168970	117763	118006	154531	113655	24574	31701	84680	36978	38354	46377	78250	68950	68070	48285	61943	158512	183794	302685	153203	152844	979834	4849493	1461292	994805	1357610	2142497	1318791	1085303	856313	1356350	1141026	600169	898050	743371	578473	708418	15256	11339	11253	13779	17825	17911	21696	19689	27485	22040	20404	21250	19074	19542	18397	12509	18926	15412	45888	18374	57753	26207	32444	51176	35803	61991	29861	27633	5107	4652	5123	6578	17809	16821	10203	5462	6778	13131	18843	7892	8439	15121	509976	174321	206463	144724	211356	151586	197231	234869	199540	176228	180339	169651	201803	166410
P-CRESOL GLUCURONIDE																																																																																																																									3479	3400	1767	1827	49172	76333	32345
PHENYLALANINE	769135	375994	261831	707476	647574	372156	586678	330229	808690	432220	431141	474758	341111	599493	443303	543875	632770	480754	662312	864335	675079	554494	619544	534213	541935	361107	425184	1167433	359691	556990	656845	333830	554535	757695	1880631	39527	35755	51298	44272	44223	40435	36219	32373	53789	27753	37243	50499	48511	54863	35697	42853	507919	131294	248818	110531	368574	563	232590	306843	384839	259393	239921	288996	417644	339242	564	219706	314166	2260	879	253333	1320973	1748406	1253565	1260388	682645	1250581	1603970	1001006	624760	981798	969640	559545	801048	5868073	2055160	2482198	3300274	3020570	5306469	2689638	2931435	3142994	1981805	3568856	2697328	2687042	500355	593895	399213	689306	542795	536882	452198	476176	440953	492990	392389	445139	516391	21121	22700	26694	27615	24965	23443	24785	22417	24979	17447	103142	100285	102737	115759	75612	105119	70817	3399956	2968832	2929820	2552744	2888815	2946597	2738241	6727988	2099638	2735323	3504628	2177324	2455358	2663644	2342031	4338160	5415312	4364314	3905530	3542754	1681902	4242006	6462472	5180734	5417929	6777310	7490656	6510415	9135191	10590944	12935090	10482305	8939356	12812917	9285133	11046635	7374487	6935462	13097747	10856923	11341402	6754744	14284440	12091545	19040454	17205900	18586154	10936032	14083092	11620405	6671208	11108537	11059289	105492	145314	210665	190509	174681	212183	263758	180886	217201	168340	240170	205375	207652	209291	262466	198724	4794317	5003728	4262178	4434964	3524969	3944611	3245143	3180050	3455756	3813270	3418766	3487380	3047168	2986196	4037666	3379418	1122306	822539	756612	975380	1853720	1510967	1565352	1401543	2181889	1077180	1403450	1108374	1229470	1280850	2064031	1337426	1768762	1787070	2053444	2613882	2262954	2355949	2298875	1608945	2714248	2219787	2615433	2979970															675175	605954	654430	535639	582300	555699	486102	467754	525399	557915	556367	522238	523928	484509
PHENYLETHANOLAMINE	27120	40823	86526	53223	56399	45039	33229	79154	74290	44816	77815	65736	67996	60303	68997	49390	37089	67722	52122	25725	44594	43454	41198	61158	53842	55398	54268	33979	45847	61771	38846	64484	42630	30677	25736																																																																																																				2210	4622	4897	2424	3645	2806	1317	3333	21539	26736	38259	33986	26927	43358																																	31322	46517	79612	64991	51425	60936	79346	44562	70292	42493	65977	67316	76913	72617	75125	68411
PIMELIC ACID																																																				0	107	60685	17765	209	0	1680	0	384	18766	9414	30552	2391	107	0	11923	29077	140	0	27648
PIPECOLIC ACID																																																																																																																									641622	649850	446365	336644	499030	616510	434072								554	550	565	581	627	1060	1040	634	81633	91377	112453	119977	148755	183111
PIPERONYL ACETONE																																																																																																																																																																																																					6548	12106	14678	12765	12334	9010	12453	4782	17173	12817	14547	15158	17493	17305	15095	15356
PROLINE																																																																								2058546	5133665	4505747	7446754	1930754	3255734	8204050	1872067	768835	550797	265317	237898	216800	8369773	6142690	6159346	8397573	7109954	4046426	9993282	7316345	7799462	362320	436956	557875	712760																																																																																																																				667277	2165585	4981871	4464851	7043937	5146700	6191626	6623591	7961247	525012	5950433	4267152	6224117	6297799	5878302	5507042	7151461	7219262	8221792	8247394	7244245	9666278	8351770	7682376	8785361	9490092	9413881	9419363
PROPYL GALLIC ACID																																																																								1159	9806	10367	10499	613	823	12351	549	3696	3555	252	2703	1377	20151	35759	8294	26516	15235	25232	44195	0	30269	3055	3092	6251	299
PUTRESCINE	434	417	1270	163863	132971	24991	16521	18848	319	113	0	0	153	798	1407	262	690	100650	85971	86312	173397	144194	124179	134681	124217	128636	16207	13059	18460	9399	11188	14869	11527	8840	9194																	22104	20678	21329	38242	28890	2891	25245	24292	17201	22338	23546	23070	23640	14674	1523	29002	23875	1404	1501	23101	332	334	663	853	2858	2879	3072	3147	2981	33490	26367	22289	33327	340	1003	976	2016	2868	3908	3692	1501	2732	27938	24846	27168	19203	25283	16559	25035	33356	25573	32491	24359	32082	25162	31857	21000	19913	21231	13598	19368	17861	30895	89456	32393	17819	87413	18954	137287	1064878	1093817	1032540	1015994	752119	676715	776058	77270	53083	53549	60489	64651	31352	75528	626	1831	2401	2063	1270	1333	1927	1255	13751	11771	10611	389234	12001	20962	17245	22871	19693	35149	47866	23009	23661	33907	21673	48693	29277	1564414	1264281	577791	1396126	1030930	19585	27831	19881	20357	46766	39274	34870	17553	55286	33004	31007	1291749	596410	1061249	1156400	1027769	797543	957952	649833	983504	243225	335719	39672	720437	795087	750415	461571	281199	430443	262323	596157	235811	99950	160525	171134	186461	423384	337931	376716	356489	289681	288041	309599	305390	302104	304353	326931	189443	3082	2374	1584	1900	3321	2960	2496	2521	3445	150021	82777	105671	111584	89931	1822	1706	1931	1154	3241	2234	2025	3604	2780	100327	99931	113379	111370	78603	106873	136117	51139	40684	54941	74654	132621	149081	43325	154461	53509	116378	125999	21374	44403	32951	37036	36696	39391	47346	31234	36923	37624	45689	38250	33227	37015	39414
PYROGLUTAMIC ACID																																				43787	39246	62097	55290	89335	51454	52850	38346	67046	39765	67458	54095	58223	63363	48564	69788																																																																																				97473	59001	58641	89192	83228	94996	83646	87542	37523	54016	37085	31329	22110	23804
RAFFINOSE	620025	326266	194095	1511	1238	2209	2442	2352	604964	461405	469359	436294	359600	429677	301786	452860	367228	1686	2532	4877	6816	2261	3294	1978	715	383	791	1270	296	1125	1063	975	1123	1699	1195	16160	10445	21146	3826	6082	3662	4446	3828	6381	2043	5988	8881	9298	10024	3354	6669																					2628138	2451803	2437846	2447562	9398	18702	9248	13140	8013	2415668	2630317	2393030	2388840	2448427	2306870	2480979	2417565	9121	14235	7204	6155	5014	2127808	2363160	2288484	2545198														8464	10356	6649	5089	4392	3282	4401	5164	8697	6144	40094	34444	55569	32850	10689	19013	10936								139070	90618	113294	120693	134388	135489	128428	128916	2625	9747	7514	5749	5576	8546	5096978	4706674	4751874	5418074	5054326	4424495	4702036	4930092	4540692	4216202	4215778	123886	73450	82971	83382	65755	5106611	5052518	4272292	4673391	4136455	4405933	4229506	4182158	4370666	4445549	3596893	142753	101758	108218	56910	104880	35708	62042	129970	80781	60460	77251	135291	70003	85357	90687	157458	45152	51722	50231	69321	86253	12814	15231	20255	18169	9065	12424	12916	10651	11914	17343	13188	5498	7379	6444	8227	10342	47882	67113	41730	57924	51874	57613	44013	43965	56648	8167	5875	7102	11183	6351	37901	41659	48462	49224	47872	44174	42083	49772	43681	4209	11727	11922	2823	11538	12242	12467	24189	23182	32529	32900	19218	14450	23663	11357	11111	13330	25303	17049
RESVERATROL																																																																								8029	14160	8847	9797	10095	17647	18746	18085	11971	1744	4836	3340	1150	3563	7922	7719	5194	14356	10577	10192	17883	6079	379	1578	1322	2988
RIBOFLAVIN																																				14713	12721	20752	3966	3561	4531	7820	1480	14075	10834	5040	3612	17469	9531	10686	10508																					2465	3286	2963	3099	13678	180019	30356	24703	57066	18857	19658	15883	10830	12603	1642	4135	1651	20129	82980	40589	25554	59029	18419	20748	4000	7060														1896	0	0	579	706	914	2832	517	4106	1750	23360	29667	36006	30630	104293	92140	65487								9554	578	1397	1032	2328	1971	4254	2943	64534	144366	174227	53485	255898	91059	3658	1272	2619	1038	26604	27803	51653	47584	40598	188136	23882	172368	113487	64943	46592	38475	766	1480	31492	10635	33771	68711	69891	86039	197366	200969	53852	120975	113929	65089	72657	75949	94164	169810	319586	208868	254321	264898	436468	209174	300101	142892	235021	374993	508438	553300	463606	355523	14075	33901	14087	10218	12648	13496	23629	14077	142120	17287	15875	10079	10660	13039	13467	66956															3206	2314	1613	1287	14189	14644	15881	5937	7245	8664	15906	14670	16246	18795	10267	9151	29186	39550	64177	80728	48267	10089	24120	56611	55915	48576	40837	63470
S-(5'-ADENOSYL)-L-HOMOCYSTEINE																																																																																																																																																																																																					17347	448	10050	7729	11630	480	8060	16969	26521	62817	21552	10198	8646	42706	59365	76831
SALICYLAMIDE																																																																																																																																							389968	416718	543244	442382	83337	115995	205343	104340	11051	9052	10552	6884	7217	8896	106885	189208	270894	83039	251805	339446	282551	387822	418959	236307	531122	162895	114890	165684	130395	182749	1389279	678941	616573	306791	1253668	899056	934983	664388	501661	523364	527992	2341410	1263850	1458443	1010108	1317900																																	22819	33383	80036	62342	45066	33114	140069	200834	173425	26578	148932	45107	40018	78181	115305	80160	77807	73542	142754	139159	162643	73540	126420	105037	165379	123056	134144	151981
SERINE	67754	34278	25358	42222	36020	32832	41236	35021	107587	67960	65257	73882	54787	76118	65451	87181	106136	27088	43415	56969	37842	37820	41656	28798	30043	20690	33601	89823	26105	40052	48874	22448	41858	57205	136854																	45146	49042	50839	77605	42526	0	36611	54338	53521	55709	60994	69377	65109	39473	0	66323	59089	104	0	55828	176966	304304	159302	263887	62478	100875	106071	83962	72895	99511	96774	62376	92422	754613	398014	381959	681692	201751	361253	208562	204997	236252	143173	228601	182070	180899	47590	38626	51339	63273	45226	37201	33713	55786	40877	38961	42483	39664	33699																		135159	112033	105617	105456	82234	85747	69202	687265	349573	340799	559696	209634	478792	264274	352484	277869	326115	288619	152244	210016	130756	1415062	3205132	2488159	2150927	2680600	3189493	3080748	3760819	5416562	5601780	4284326	662485	504720	592030	555225	550387	2816957	6245184	4309228	5589499	2838345	5515661	5376562	7656907	7387242	7837888	3331311	991948	929306	408611	862076	913828	15556	24915	30583	29580	35391	50559	77655	43364	63047	54331	87799	78280	66275	78150	78203	77731	476893	361226	323336	330612	385291	322543	387573	343226	332513	372786	353203	280126	250952	230754	250026	280825	498699	350270	319464	478269	757941	594264	605998	557343	853332	47478	95353	60181	51792	66874	644888	467328	616441	691705	720169	850330	740459	786907	772265	54120	144617	80376	99665	173003															39180	35152	32427	33731	38715	41841	38060	36605	32257	37068	43617	35559	38806	33592
SEROTONIN																																																																																																		16910	15578	88138	26383	49804	38673	46106	33274	2332	43292	16752	27078	24340																		16371	5768	12200	68230	125873	908	164630																																																															258452	138654	395250	664944	975753	351448	235651	364195	2860	198904	544251	534535	309883	303357	449820	64110																																											65595	180371	107777	72052	192721	125218	128859	160435	73486	217286	185331	162803	210845	125618
SN-GLYCERO-3-PHOSPHOCHOLINE	977327	606839	406207	1189610	887291	1053099	1248364	983677	499485	358335	180413	378400	353380	568970	580945	363119	630235	362712	578562	869495	592263	475122	521015	350149	705497	271014	423687	2130511	405482	722409	849027	419800	439474	828388	1481502	712142	559101	899390	716184	1098973	711603	438265	317188	956190	118616	686480	851273	583503	779767	555698	615864	15984931	12620351	11145368	12965071	16061730	25729	13070000	14431547	14393863	9909000	9402307	16205071	14777272	14330183	24514	10311277	10870729	28124	7006	14190863	586589	574682	749179	491191	690504	1839288	1471310	1739679	1579400	728253	775305	876924	1057652	1526646	785217	844235	601970	1285224	2280755	1231120	992176	1284944	969204	1597173	1103607	1097479	21727074	23913254	21761228	19359600	21726828	22182958	20459752	21081348	18246846	20737068	19263538	19897062	22366018	932962	1016093	4508672	996833	790642	935517	1256291	659137	1366749	755918	2835827	2942974	3014640	11730935	1256251	1550743	1087552	21390688	21675058	23792406	20825650	23068488	22814158	21359020	7478040	1676575	2089000	1175006	2458768	1844652	4012916	2327449	575826	260290	262656	1797565	106103	239851	3741967	5401131	5151776	2538840	3999695	4745297	3682540	4384596	5017878	4472268	5789682	4249482	5318871	3798523	4115068	4286300	2801857	4038151	8336397	4294646	2268209	7092122	6896244	9527998	4389169	6678842	6452849	3912619	4733824	2322228	2669247	2968510	750760	1319970	4049778	1854951	2562493	5408614	5971826	3448664	4975384	4125461	8267412	3313323	3758366	4427099	6230344	4146663	50341608	40895564	49540792	52543808	50220904	50490080	49165736	51454728	33854424	51762516	45905252	39082464	40889236	27015026	33794400	29985260	895026	1225442	1810492	2020267	1660582	1185405	1972862	2476011	2992858	1121517	1334761	1324020	1201285	1165272	2074634	700375	772967	681890	1210536	669455	1052874	1505472	936541	824192	1674096	761197	542010	1061840	441639	256375	616436	659693	1697169	1512169	533289	461547	998083	686193	624239	588090	531157	527044	15720855	18857096	18918744	15248711	19786712	16487045	15227278	14952918	11850992	17277378	17279544	18768620	18125420	18869876
SORBIC ACID																																																																																																																																																																																					9351	12286	12654	17791	8987	19417	10418	7360	26412	13364	9582	15499	8491	10642	15417	20013	16720	9580	9237	13509	9833	10311	16365	10873	11923	9714	15931	14860	10026	15361	17054	18718
SPERMINE	25445	26022	61351	12077	30062	9583	21521	15327	10447	15008	16002	20663	21985	4836	16014	12682	18369	11828	7898	6590	14605	9504	17155	11280	14381	11673	5149	8063	22802	11308	11813	23239	10960	15580	11330																																					142038	149321	154977	213353	133173	201989	173358	157222	115649	150936	78118	79416	72640	42873	45283	47786	37199	33719	32669	37749	35743	36456	35769	43021	22154	29763														21966	31259	31160	22531	24466	20769	21990	27280	21194	24566								72754	70055	75423	69537	61351	50081	52918	13672	24556	21574	22163	20627	15507	18533	15316	48837	37359	42587	25050	47940	46689	56167	99856	120849	103943	114860	102475	121213	109476	102857	99989	98790	84054	46243	93774	87052	99025	102597	61998	80688	80767	103588	84637	88092	69285	88595	69059	102566	88854	89745	110495	89975	85522	449053	431034	348158	327587	312352	294242	236085	269073	191042	257780	237247	170995	203032	142574	171715	199916	951199	1002662	1065612	995913	989973	593721	663827	616035	524617	472349	468529	329269	303888	324660	294075	259525	18922	30839	36435	31186	18703	18758	19432	18045	12419	12781	23767	19911	12598	19450	20750	30701	32220	41278	50357	42489	41987	38118	37609	50957	36882	46865	44059	39402	26442	33695	90288	84299	226068	229369	237035	244250	202621	231188	229577	294654	309533	267444
SUBERIC ACID																																																																																																																																																																																																					33916	33521	43926	27660	28543	23756	26182	37048	19504	41370	32841	51946	40919	53680	48262	37194
SUBERYL GLYCINE																																																																																																																																																																																					95308	88731	96190	84977	108579	116205	115450	100216	112852	91789	104515	106728	108584	112363	125742	122234
TAURINE	8503	3226	2657	2086	7383	17277	42592	11447	1068	4225	1979	744	507	6550	136	1302	471	2018	5725	7322	10169	1626	6720	2831	4337	5090	13922	22307	8994	6178	6959	1254	5558	9227	37051																																																																												312891	191923	786546	436132	220414	401968	418225	234410	382941	160066	848048	866828	936941	1429899	749111	630712	938678	58996	65038	67826	53902	67398	41345	37842																																																															429280	444372	271835	382223	191810	462251	303662	144106	126516	181466	251720	268003	117774	382057	255990	156004
TAUROCHOLIC ACID																																																				2477	2017	34688	34503	4036	0	2308	579700	464891	990332	3691991	28117	1214736	52665	0	2763770	179339	0	101	1425004	253582	328827	238611	288214	334128	1533621	394451	500927	509712	924490	622780	622524	1023394	182527	166805	156613	157009	369741	477528	360547	365025	329316	231301	283407	263060	416809	1625	1438	1176	423248	7647	1371	210958	4113	5406947	13356	3013000	650024	440																		1309706	1023766	1113637	629604	1473	654	10914	173298	150115	143882	158343	177087	397332	301480	381198	749	3742	1167	858	2207	1498																	520687	543228	398959	422984	500528	800683	489768	421294	508309	567838	428550	384108	805424	579025	469981	501678																																	781095	639392	521102	679264	665866	1149826	2615696	3457784	5066540	1204800	913149	1153630	919305	865164	390734	344803	410775	408033	504012	342941	1220276	1026776	1016935	475058	549606	3003612	1977318	900528															3587801	18622	9210	8825	17443	7233	10983	10686	7106640	10738	16070	7572	16291	983546
TAUROURSODEOXYCHOLIC ACID	23669	13295	13109	18002	30088	46831	34081	42003	13384	8865	11347	11591	15714	18554	12691	16625	7048	9851	18775	22107	26929	14797	11287	12167	24392	5925	17809	9624	9048	17989	7458	17487	25332	25561	6480																	0	104	2027	1381	114	0	0	36149	27972	57730	285616	3187	47963	5961	0	175574	11381	0	124	95511	86466	76735	75556	69920	44389	318935	95005	162631	127507	198537	160527	169096	172514	78281	40446	49588	31265	92478	112869	76912	101094	99344	74190	78494	62742	92277	144	286	306	124725	116	156	44163	405	1408024	739	352520	42718	127																		233932	182319	198362	95862	203	171	6671															123403	128103	112659	136939	430090	323636	254960	223732	132414	226026	360143	372226	581217	451572	297859	703247	67913	71266	79357	55180	174346	153069	186555	104703	120511	138031	120660	128165	173601	122545	128831	81051																	59962	1665607	2001	836	3086	36465	161738	1037	11359774	2189	41869	844	775	212725	8235	5919966
THIAMINE	3789	9394	6994	1677	113	2245	4252	9943	709	8499	16786	1191	927	309	668	13093	215	361	115	682	555	224	104	268	378	461	640	1070	677	484	1073	923	969	159	903	777567	683140	909026	163768	450711	216395	360061	262013	748193	228481	110443	295728	437456	272381	147398	302126																					128307	110169	130962	140926	3640	7609	3753	6241	1924	3066	3392	6524	4517	47598	7751	17341	50401	3616	1027	6639	2085	5341	3397	2848	4123	2503														544086	454554	214831	25403	32492	82098	15736	441215	435051	172691	1560837	1519377	1176932	580613	459743	658001	406863								98311	21051	28538	79191	70322	121122	133215	167204	356084	632759	295972	68949	375109	272126	402586	337090	322239	388657	309376	271766	348049	408025	343281	489138	257310	387040	222566	273948	287985	157847	166217	235013	253574	309161	160345	264246	241715	323036	439266	447922	302779	138198	218851	129319	287450	203999	719426	1291248	1355191	1674029	3410453	3501986	3305677	2555005	2409447	2946944	3326612	2358071	2118854	2762785	2720574	2802579	140265	167701	178496	133005	262250	191454	151057	152262	214859	220362	186309	142265	96494	201390	285979	215614	104841	140424	73476	108444	75292	83011	73582	57405	72386	30471	26746	37029	35017	21160	59618	75992	77625	82728	68964	57713	64651	100736	65208	31050	40935	41489	44171	36107	141514	112855	211510	205514	268007	296450	90592	160562	116056	57111	54890	73253	71797	119490
THIOPURINE S-METHYLETHER																																				8988	13520	16695	88876	74883	84963	72142	55823	126813	664	4437	6512	6667	7906	6748	2563
THREONINE	468790	243068	171432	69053	61774	57715	78269	55773	690351	433516	426886	465499	329238	405849	369416	574837	623985	64169	88683	120050	78275	72407	71321	57579	55909	43189	56441	118123	51133	77682	95870	46879	80457	111033	286070	11375	9173	16398	13285	13424	11204	9428	10552	12648	5122	10678	30475	19954	19575	13508	12511	237038	203394	213924	429730	180385	0	130619	221147	232524	289484	327125	368160	136068	214424	0	310381	309867	126	0	198462	1117915	1684814	815069	1784776	69039	101060	91857	68217	50292	130018	132972	87635	128949	868220	1641148	1533576	2263073	279619	136228	271913	330488	336609	262800	336777	279864	311702	163378	167994	188875	258813	133827	129286	122349	237182	136537	138974	136693	146011	110451											31468	34607	30696	28956	19195	26025	16539	501290	424806	409822	403563	257855	300013	230314	1844477	1240799	1188003	1784181	1002954	1592916	937240	1525435	585577	692538	633134	452909	524786	421846	4489038	9750801	6446067	7773053	6287548	6231840	7345648	8298142	8938987	8614902	7211374	493990	356069	412941	409311	394399	5275160	11175801	7983662	10345534	5505835	8367356	9359375	8129263	10839300	10317358	7309444	1223223	1166865	635902	1142228	1039588	30852	40118	83190	59455	69521	79655	197176	75836	94142	82168	159627	91058	90662	87643	112445	96661	1156103	1070238	960049	1030269	1031429	930861	1058479	1064141	1170606	1213406	1031362	513643	590295	558685	622443	841102
TRANEXAMIC ACID	47616	27768	20761	42972	36145	38953	61642	43034	52196	42244	39562	33351	28751	33190	28476	37971	32600	33607	39138	38345	45580	38705	49196	33316	35037	32654	35415	43503	35089	37377	38558	37763	49991	53336	55188	6016535	5570726	8944275	5692334	7037184	4926022	5534048	4672738	7808435	2067792	6083109	8853661	8527195	7883768	6301623	8212495	1605958	1688683	1415283	1687049	1213470	397	1425570	1775082	1503504	1918918	1960639	1652891	2634908	1233614	457	1397619	2027315	2537	906	1546255	265603	245784	237052	265990	290898	222697	354269	288199	287124	208066	202745	383618	244145	241909	241278	227601	250606	204206	189028	343454	248043	240969	195697	216112	224284	209126	1938040	1944134	1670232	1604830	1557741	1494332	1724380	1922464	1079972	1437610	1437959	1234874	1177282	2946356	3747825	3180433	3979038	3202589	3139000	3093392	3279156	3672317	2029501	13298885	13002139	14743743	11840148	12865696	14894623	10410579	6558216	6476154	6274416	5737560	5829254	6566740	5254430	197952	189426	177704	219826	170972	197552	197570	222489	35770	47070	28621	112742	20978	19274	246969	259077	217974	319645	329267	286333	320657	272824	324274	282248	200466	332969	281205	290697	291882	266966	240486	249206	207784	266404	304456	284923	287448	272667	285109	284289	182758	240383	270616	283219	308303	268235	4695194	6904324	11576930	8555599	15477666	16408400	19651506	9774592	14382605	12570586	16888272	11496917	10981766	12435377	11830783	11803556	5477028	5809290	5240296	6460091	8942097	6763626	9067037	6808584	6238272	7711454	6883708	4477772	5622472	5600330	5218680	6348372	80025	79661	60468	66608	52229	51183	47487	46884	51956	112930	57861	70002	77440	56674	54648	59469	64360	58751	43314	41844	45410	54643	46732	64291	58920	67985	64602	55981	1013526	599583	1471054	1585289	1590687	1668332	1134372	969334	1399790	1572667	1101458	1030765	971004	1115541	1079363	1190181	1241495	876350	527175	736009	896783	1046317	817161	1330823	1049826	1211658	1193358	1146888
TRICARBALLYLIC ACID																																				240821	168343	217994	116413	101669	123559	118502	64042	83878	47462	101884	94616	123168	126227	94054	105486																																																												49237	60700	66339	104252	56140	51790	67783	47174	69709	62167	211989	244325	240547	231515	80283	80175	94502																																																																																																																		72713	67704	122906	130495	187483	166561	80722	69022	145490	133292	96261	93147	86268	90660	6755	8699	8345	11308	8518	10010	12172	7868	13890	11436	11576	8350	9396	9132
TRIGONELLINE	18004	5953	8221	23263	22943	11466	23332	14937	19276	11637	12475	12100	5642	11270	9873	12530	15759	6264	13261	13031	16886	17306	20650	11134	14025	13294	13198	18312	7199	7328	15336	4665	15787	17601	8853	3958027	3656944	4277772	3303158	3645714	3415186	3595031	3412226	3934139	2039216	3688116	4268164	4651008	4670270	3744148	4224098	1391878	1332443	1117933	1682022	1566831	266	913774	1479781	1326778	1584723	2332230	2036704	859632	1194980	483	1901024	2164006	1490	466	2243479	59394	47720	75704	53921	32455	58988	50915	38738	45390	63654	67990	227017	97695	74251	53084	57636	46605	52795	61648	90667	57484	57676	61093	76297	71246	79026	1526954	1500932	1094625	1547930	1141488	2009426	1250748	1770804	1150823	1204410	1125164	901469	1077267	5830968	5676882	4382400	6799083	5818627	6813980	6072156	5598008	6733520	4499900	13226918	13338911	12791285	10351933	14515188	17893730	13566977	5641408	5037186	4888304	3479694	2467280	3875854	2952558	69970	44550	53691	67007	47246	47534	65449	47590	29308	17109	21201	21095	18873	28986	109032	190130	153011	155031	167642	188248	219240	225415	320846	265910	202416	279910	184703	187202	185557	154267	145982	189671	153793	175126	171121	212400	223165	217098	262211	276989	171033	241911	223924	210026	247785	180519	13401485	19950418	29851516	24991714	39483108	40946004	52771948	32017790	35829372	33795616	43915948	42266752	40724612	46105864	49361736	47269932	8661658	7778926	7596668	7515560	13525069	8960672	11594811	13380903	11508699	15032725	14356010	7362922	9438561	9115491	8058827	8611232	31885	48648	46774	51809	58277	59295	47361	56308	68472	31840	60794	48927	68947	48955	41017	41488	51466	43787	64400	55412	52427	68739	52501	47701	60087	58886	77257	58263	4813706	3018709	8675511	8749104	9219686	11393431	6197610	5881658	9005287	6727854	5767478	6730328	6134276	7550752	1861362	2241865	1711818	1442065	1395625	1451550	2247004	2372769	2107712	1650893	1764094	1735700	2188962	2334566
TRIMETHYLAMINE N-OXIDE																																																				1219	30473	59061	1266	1085	0	34584	993	1680	2042	2869	1558	1176	822	0	3630	1776	0	0	2306																																								11858	12182	9905	20446	12353	13678	15352	369739	545791	439166	869443	882897	1004145	714024	19320520	16829242	17201466	26517	27125	28076	24104	1128594	610254	1130240	31058	28948	21732	42237	27544	28626	17605	28582	8339	988	1625	2301	848	120	135154	203150	199694	169074	83965	89529	77373	163508	64769	141151	135548	4740	11448	16549	22189	22879	246564	259071	220850	165598	129698	153172	114371	59755	161153	168997	122686	11912	7659	9184	9379	10209	1605679	2628406	3929398	3328957	4715696	4889792	6405591	4239206	4955367	5163726	6710560	5966211	6347568	5861564	6451178	5972767	265086	417072	198501	341739	325254	260046	257199	316957	220209	626463	338859	178634	270693	188996	199973	208161																													16712	14979	42078	35117	29350	38179	27664	25604	24284	18474	29533	31931	24905	25428
TRYPTOPHAN	127696	67397	51459	65312	59914	45545	59754	56730	151177	86976	86596	94750	72727	98388	88680	115156	123228	50791	72206	95184	76634	63770	63942	61424	58564	37934	61411	137333	51240	70233	72423	48283	77765	96391	233551																	156995	74166	52090	50910	116557	951	49808	80821	115499	81883	59190	60975	83213	113942	384	68669	46256	2494	910	59549	239878	295582	224027	222731	133414	244647	271220	199492	109367	180449	168178	101325	105991	1011175	467135	515836	741231	523565	853452	526864	556083	585950	339901	513498	436475	421344	199213	240797	175177	234259	184619	193042	217534	226666	146133	148770	137737	194463	172907											11867	12804	13023	16027	11515	17290	10934	230384	207899	252538	220198	225710	109543	221619	971184	354162	427591	666002	319312	305081	385542	337613	369898	439429	357577	502661	251636	167875	602066	1021646	803034	555650	1050608	1300241	1049052	1306926	1769206	2196675	1541566	1276712	1653057	1263545	1360091	1015139	1008297	1955560	1328723	1533714	1059458	2219084	1993259	2838844	2948455	3045542	1805486	1854760	1551321	997347	1558786	1454222	27982	40644	46322	50236	51848	56224	56943	51856	52413	54554	72782	49606	55727	53264	53047	43357	921431	772941	900142	914351	639401	665725	681052	798534	447880	930533	776610	551965	674323	592949	1030086	730513	197355	143622	176112	199448	400835	311172	355633	313067	468299	207177	278142	217097	256067	285680	356801	254415	355192	350792	438076	538953	475019	461100	466929	336654	529351	456930	544337	608141															339293	353164	415123	316592	290726	279295	308696	305630	303252	275794	299314	326548	271610	285662
TYRAMINE																																				34935	23403	34720	27572	25012	26142	29823	25257	26883	16891	19135	31940	26438	20389	16640	23929
TYROSINE	40654	16502	7289	46613	36695	75307	30693	25040	55769	18430	21589	63668	21813	42073	26987	27726	41853	37902	44509	55853	33461	33395	33122	24817	65899	22953	19445	67291	15206	72656	32675	10134	33034	45765	68769																	22818	31814	34432	34913	28367	0	29599	42947	33608	49812	55249	62428	36666	19902	0	43345	62534	0	0	56039																																																		176486	179343	176010	135493	113662	123808	108837	177082	160860	143056	126399	121713	179190	136562	543984	177280	203012	300474	102109	243062	204065	216961	409110	479384	358355	628631	186937	122992																																																	86596	73174	71578	85813	63557	71884	88305	90419	84991	101860	81700	52824	80875	76584	82730	92263															70551	126350	158048	161355	161399	189694	183532	210747	188960	42258	112527	68656	97474	112348
URSOCHOLIC ACID	2002	768	634	7881	7506	43464	29296	19218	2107	788	1211	1444	266	2209	1256	810	1616	6432	8870	12220	61943	8215	6950	6225	7380	3395	8014	8747	19041	9921	11311	21566	11807	14307	27047																	339	210	0	310	738	296	0	9224	6180	1199	4518	125	13276	1955	0	3573	226	0	319	1953	3041	5212	4088	4538	42081	105521	19878	50187	33907	7888	10005	6639	7969	3735	2419	4866	4224	33297	38573	24301	26165	17938	9631	6591	5772	12459	0	0	0	2195	431	0	1465	0	15099	0	4578	103	0																									663	0	332	439	1342	370	946	318	9178	22974	33325	12092	17300	9630																																																	3218	124179	543	1126	670	1538	22583	1227	171768	511	688	1322	0	16076	551	199073
VITAMIN D3																																																				5111	11370	10595	17353	5039	0	8502	10907	9282	11486	14106	8935	8067	8125	118	15154	13304	0	140	12094	269393	205645	214360	282320	273464	257373	214227	201613	216855	319651	304438	303353	336818	161193	170367	207268	180043	157323	147625	166399	149833	143337	213172	198927	180212	194904	18061	10791	14016	10236	15343	9034	8727	9325	12045	21701	21959	14659	10478																																																							18714	6725	11611	8196	15594	6278	15990	4546	2872	5108	3631	15218	4875	13561	13297	9558																	37719	40395	27090	16814	45115	32741	47702	43943	57762	37193	40372	25726	9766	18307	14859	31783																																											16719	18739	13931	15274	14804	19031	14328	22689	13696	16259	18969	13331	13867	13206
XANTHURENIC ACID																																				244507	235243	259029	536998	218634	229558	199250	186607	377247	88071	214372	167676	176367	272913	177479	216035																																																																						124962	132404	220779	190867	145099	183891	178806																																																						163266	284075	596754	356411	392427	423612	653539	459336	649626	353722	556258	695583	754714	752691	894347	1099879	5602	3982	5364	3253	2958	1987	3942	5193	13003	9965	4044	1158	2077	5844	7610	17875																													43505	41781	49507	68877	188251	194554	65257	73185	106132	84959	110904	71579	68065	104336
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	quantitated m/z	retention times	adduct	PubChem_CID
BETA-ALANINE, SARCOSINE	90.05495447	7.643	[M+H]+	239, 1088
PROLINE	116.0706045	7.486	[M+H]+	8988, 145742
5-HYDROXYINDOLE	134.0600398	1.214166667	[M+H]+	16054
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE, 2-PHENYLACETAMIDE, N-BENZYLFORMAMIDE	136.0756899	1.209	[M+H]+	7680, 80654, 280229
LEUCINE, NORLEUCINE	132.1019047	6.7565	[M+H]+	857, 6106, 21236
ORNITHINE	133.0971536	9.333	[M+H]+	6262, 71082
3-(4-HYDROXYPHENYL)PROPIONIC ACID, METHYL 4-HYDROXYPHENYLACETATE	167.0702702	1.12	[M+H]+	10394, 518900
PYROGLUTAMIC ACID	130.0498691	7.439	[M+H]+	499, 7405, 439685
4-HYDROXYPROLINE	132.0655192	7.799	[M+H]+	825, 5810, 69248, 440014
SN-GLYCERO-3-PHOSPHOCHOLINE	258.1101	8.269	[M+H]+	71920, 657272
ALLO-ISOLEUCINE, ISOLEUCINE	132.1019047	6.868	[M+H]+	6306, 99288
CORTICOSTERONE, REICHSTEIN'S SUBSTANCE S	347.2216854	1.213	[M+H]+	5753, 440707
ALLOTHREONINE, HOMOSERINE	120.0655192	8.023	[M+H]+	12647, 99289
3-HYDROXYANTHRANILIC ACID, SALICYLHYDROXAMIC ACID	154.0498691	1.452	[M+H]+	86, 66644
2-DEOXY-GLUCOSE, 6-DEOXY-GALACTOSE	165.0757495	1.576	[M+H]+	17106, 439268
ASPARTIC ACID	134.0447837	8.798	[M+H]+	5960, 83887
1-METHYLGUANIDINE	74.07127324	5.644	[M+H]+	10111
1,3-DIAMINOPROPANE	75.09167433	9.058	[M+H]+	428
GLYCINE	76.0393044	8.032	[M+H]+	750
TRIMETHYLAMINE N-OXIDE	76.07568991	5.4855	[M+H]+	1145
PUTRESCINE	89.10732439	8.855	[M+H]+	1045
ALANINE	90.05495447	7.816	[M+H]+	5950
5-VALEROLACTONE	101.0597055	1.207	[M+H]+	10953
1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID	102.0549545	7.749	[M+H]+	535
CADAVERINE	103.1229745	8.604	[M+H]+	273
N,N-DIMETHYLGLYCINE	104.0706045	7.442	[M+H]+	673
3-AMINOISOBUTANOIC ACID	104.0706045	7.613	[M+H]+	64956
2-AMINO-2-METHYLPROPANOIC ACID	104.0706045	7.641	[M+H]+	6119
3-HYDROXYBUTYRIC ACID	105.0546201	1.222	[M+H]+	92135
CHOLINE	104.1075391	5.313	[M]+	305
SERINE	106.0498691	8.321	[M+H]+	5951
DIETHANOLAMINE	106.0862546	6.992	[M+H]+	8113
HYPOTAURINE	110.0270255	7.795	[M+H]+	107812
2-AMINOPHENOL	110.0600398	1.224	[M+H]+	5801
CATECHOL	111.0440554	1.146	[M+H]+	289
CYTOSINE	112.0505378	5.922	[M+H]+	597
HISTAMINE	112.0869233	8.111	[M+H]+	774
SORBIC ACID	113.0597055	1.224	[M+H]+	643460
CREATININE	114.0661879	5.079	[M+H]+	588
GUANIDINEACETIC ACID	118.0611025	7.835	[M+H]+	763
INDOLE	118.0651252	1.22	[M+H]+	798
BETAINE	118.0862546	7.021	[M+H]+	247
THREONINE	120.0655192	7.965	[M+H]+	6288
4-VINYL PHENOL	121.0647909	1.181	[M+H]+	62453
4-HYDROXYBENZALDEHYDE	123.0440554	1.162	[M+H]+	126
NICOTINAMIDE	123.0552888	1.584	[M+H]+	936
TAURINE	126.0219401	7.526	[M+H]+	1123
5-METHYLCYTOSINE	126.0661879	5.731	[M+H]+	65040
4-IMIDAZOLEACETIC ACID	127.0502034	7.623	[M+H]+	96215
5,6-DIHYDRO THYMINE	129.0658535	1.495	[M+H]+	93556
PIPECOLIC ACID	130.0862546	7.517	[M+H]+	439227
HEPTANOIC ACID	131.1066557	1.138	[M+H]+	8094
N-ACETYLPUTRESCINE	131.1178891	6.758	[M+H]+	122356
AGMATINE	131.1291225	8.507	[M+H]+	199
CREATINE	132.0767525	7.756	[M+H]+	586
ASPARAGINE	133.0607681	8.347	[M+H]+	6267
ADENINE	136.0617712	4.956	[M+H]+	190
HYPOXANTHINE	137.0457868	4.950833333	[M+H]+	790
SALICYLAMIDE	138.0549545	1.091	[M+H]+	5147
TRIGONELLINE	138.0549545	7.196	[M+H]+	5570
METHYL NICOTINIC ACID	138.0549545	1.145	[M+H]+	7151
1-METHYLNICOTINAMIDE	137.0714879	6.193	[M]+	457
TYRAMINE	138.09134	5.543	[M+H]+	5610
PHENYLETHANOLAMINE	138.09134	5.488	[M+H]+	1000
4-GUANIDINOBUTANOIC ACID	146.0924026	7.158	[M+H]+	500
DEOXYCARNITINE	146.1175547	7.434	[M+H]+	725
ADIPIC ACID	147.0651848	1.142	[M+H]+	196
GLUTAMINE	147.0764182	8.23	[M+H]+	5961
LYSINE	147.1128037	9.284	[M+H]+	5962
ACETYLCHOLINE	146.1181038	3.329	[M]+	187
GLUTAMIC ACID	148.0604338	8.353	[M+H]+	33032
N-METHYL-ASPARTIC ACID	148.0604338	8.428	[M+H]+	22880
CINNAMIC ACID	149.0597055	1.199	[M+H]+	444539
METHIONINE	150.0583256	7.14	[M+H]+	6137
3-METHYLADENINE	150.0774212	5.447	[M+H]+	135398661
CARVONE	151.1117411	1.057	[M+H]+	16724
4-ACETAMIDOPHENOL	152.0706045	1.264	[M+H]+	1983
3-METHYLSALICYLIC ACID	153.0546201	1.3335	[M+H]+	6738
3-HYDROXYPHENYLACETIC ACID	153.0546201	1.101	[M+H]+	12122
ARABITOL	175.0576835	7.084	[M+Na]+	827
3,5-DIMETHOXYPHENOL	155.0702702	1.125	[M+H]+	10383
HISTIDINE	156.0767525	9.134	[M+H]+	6274
TRANEXAMIC ACID	158.1175547	6.746	[M+H]+	5526
INDOLE-3-ACETALDEHYDE	160.0756899	1.151	[M+H]+	800
8-AMINOOCTANOIC ACID	160.1332048	5.759	[M+H]+	66085
PIMELIC ACID	183.0627769	1.7435	[M+Na]+	385
DIETHYL MALONIC ACID	161.0808349	1.047	[M+H]+	7761
ALPHA-AMINOADIPIC ACID	162.0760838	8.044	[M+H]+	92136
CARNITINE	162.1124693	7.438	[M+H]+	10917
2-METHOXYCINNAMALDEHYDE	163.0753556	1.066	[M+H]+	641298
5-HYDROXYLYSINE	163.1077183	9.542	[M+H]+	1029
PHENYLALANINE	166.0862546	6.632	[M+H]+	6140
ETHYL 4-AMINOBENZOIC ACID	166.0862546	1.091	[M+H]+	2337
THIOPURINE S-METHYLETHER	167.0385932	1.472	[M+H]+	5778
SUBERIC ACID	175.0964849	1.457	[M+H]+	10457
DIETHYL SUCCINATE	175.0964849	1.064	[M+H]+	31249
ARGININE	175.1189517	9.163	[M+H]+	6322
N-AMIDINO-ASPARTIC ACID	176.0665818	8.367	[M+H]+	439918
INDOLEACETIC ACID	176.0706045	1.208	[M+H]+	802
CITRULLINE	176.1029673	8.41	[M+H]+	9750
TRICARBALLYLIC ACID	177.039364	1.441	[M+H]+	14925
SEROTONIN	177.102239	5.711	[M+H]+	5202
MANNOSAMINE	180.0866485	8.266	[M+H]+	440049
GLUCOSAMINE	180.0866485	8.53	[M+H]+	439213
TYROSINE	182.0811692	7.336	[M+H]+	6057
MANNITOL	183.0863142	7.474	[M+H]+	6251
1-HYDROXY-2-NAPHTHOIC ACID	189.0546201	1.114	[M+H]+	6844
ALPHA-N-ACETYL-GLUTAMINE	189.0869829	7.528	[M+H]+	25561
N-ALPHA-ACETYL-LYSINE	189.1233684	7.896	[M+H]+	192590
HOMOARGININE	189.1346018	9.094	[M+H]+	9085
NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE	189.1597539	8.848	[M+H]+	440120
KYNURENIC ACID	190.0498691	6.014	[M+H]+	3845
INDOLEPROPIONIC ACID	190.0862546	1.2	[M+H]+	3744
HOMOCITRULLINE	190.1186174	8.231	[M+H]+	65072
PIPERONYL ACETONE	193.0859202	1.069	[M+H]+	62098
FERULIC ACID	195.0651848	1.377	[M+H]+	445858
CAPRYLOYL GLYCINE	202.1437695	1.447	[M+H]+	84290
SPERMINE	203.22355	6.83	[M+H]+	1103
ETHYL 3-INDOLEACETIC ACID	204.1019047	1.057	[M+H]+	13067
N6-(DELTA2-ISOPENTENYL)-ADENINE	204.1243714	1.482	[M+H]+	92180
TRYPTOPHAN	205.0971536	6.58	[M+H]+	6305
ACETYL-CARNITINE	204.123034	6.876	[M+H]+	7045767
XANTHURENIC ACID	206.0447837	6.244	[M+H]+	5699
5-METHOXY-3-INDOLEACETIC ACID	206.0811692	1.208666667	[M+H]+	18986
KYNURENINE	209.0920683	6.652	[M+H]+	846
PROPYL GALLIC ACID	213.0757495	1.264	[M+H]+	4947
INDOXYL SULFATE	214.016876	1.226	[M+H]+	10258
DETHIOBIOTIN	215.1390184	1.541	[M+H]+	445027
3-CHLORO-TYROSINE	216.0421969	6.889	[M+H]+	119226
N-ACETYL-5-HYDROXYTRYPTAMINE	219.1128037	1.466	[M+H]+	903
CYSTATHIONINE	223.0747039	9.625	[M+H]+	439258
CARNOSINE	227.1138663	9.292	[M+H]+	439224
DEOXYCYTIDINE	228.0978819	6.043	[M+H]+	13711
RESVERATROL	229.0859202	1.234	[M+H]+	445154
SUBERYL GLYCINE	232.1179486	6.567	[M+H]+	6453952
MELATONIN	233.1284538	1.204	[M+H]+	896
LUMICHROME	243.0876516	1.496	[M+H]+	5326566
CYTIDINE	244.0927965	6.713	[M+H]+	6175
THIAMINE	265.1123072	6.767	[M]+	1130
ADENOSINE	268.1040299	5.209	[M+H]+	60961
INOSINE	269.0880455	6.23	[M+H]+	135398641
LINOLENIC ACID	279.2318562	1.031	[M+H]+	5280934
ASP-PHE	281.1131976	7.697666667	[M+H]+	93078
OCTYL GALLATE	283.1539998	1.216	[M+H]+	61253
GUANOSINE	284.0989445	6.887	[M+H]+	135398635
P-CRESOL GLUCURONIDE	302.1234259	6.258166667	[M+NH4]+	154035
OPHTHALMIC ACID	290.1346613	8.546	[M+H]+	7018721
ANDROSTERONE	291.2318562	1.124	[M+H]+	5879
NATEGLINIDE	318.2063697	1.222	[M+H]+	5311309
CANRENONE	341.2111208	1.11	[M+H]+	13789
BETA-LACTOSE	343.1234875	8.637	[M+H]+	6134
2'-DEOXYGUANOSINE 5'-MONOPHOSPHATE	348.0703604	8.603	[M+H]+	135398597
1-OLEOYL-RAC-GLYCEROL	357.2999358	1.151	[M+H]+	5283468
CORTISONE	361.20095	1.22	[M+H]+	222786
CORTISOL	363.2166001	1.268	[M+H]+	657311
DEOXYCORTICOSTERONE ACETATE	373.2373355	1.059	[M+H]+	5952
RIBOFLAVIN	377.1455604	5.897	[M+H]+	493570
LITHOCHOLIC ACID	394.3315681	1.191	[M+NH4]+	9903
S-(5'-ADENOSYL)-L-HOMOCYSTEINE	385.1288648	8.379	[M+H]+	439155
VITAMIN D3	385.346492	1.038	[M+H]+	10883523
25-HYDROXYCHOLESTEROL	403.3570567	1.209	[M+H]+	65094
URSOCHOLIC ACID	426.3213974	1.568	[M+NH4]+	122340
IRBESARTAN	429.2397355	1.206	[M+H]+	3749
TAUROURSODEOXYCHOLIC ACID	517.3305822	5.076	[M+NH4]+	9848818
RAFFINOSE	522.202823	9.241	[M+NH4]+	10542
TAUROCHOLIC ACID	533.3254968	5.908	[M+NH4]+	6675
1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE	566.3816304	4.864	[M+H]+	16219892
BILIVERDIN	583.2551108	1.474	[M+H]+	5280353
CARNITINE-TRIMETHYL-D9	171.169276	7.528333333	[M]+	129316446
2-FLUROPHENYLGLYCINE	170.061176	6.894888889	[M+H]+	5171030
METHIONINE-METHYL-D3	153.077176	7.148	[M+H]+	15556503
LEUCINE-5,5,5-D3	135.120776	6.781222222	[M+H]+	11073472
TRYPTOPHAN-2,4,5,6,7-D5	210.128576	6.588666667	[M+H]+	12209747
4-CHLORO-PHENYLALANINE	200.047276	6.236777778	[M+H]+	736190
4-BROMO-PHENYLALANINE	243.996776	6.219222222	[M+H]+	671214
INDOLE-2,4,5,6,7-D5-3-ACETIC ACID	181.101976	1.206888889	[M+H]+	54301591
PROGESTERONE-D9	324.288376	1.081777778	[M+H]+	71309321
PHENYLALANINE-2,3,4,5,6-D5	171.117676	6.640444444	[M+H]+	13000992
4-HYDROXYPHENYL-D4-ALANINE	186.106276	7.346	[M+H]+	10419891
METABOLITES_END
#END