#METABOLOMICS WORKBENCH shuohan_20210206_090454 DATATRACK_ID:2456 STUDY_ID:ST001683 ANALYSIS_ID:AN002747 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 C18 reveres phase methods were implemented with minor modifications.
CH:CHROMATOGRAPHY_SUMMARY        	The C18 positive method (ESI+) used mobile phase solvents (LC-MS grade)
CH:CHROMATOGRAPHY_SUMMARY        	consisting of 0.1% formic acid (Fisher) in water (A) and 0.1% formic acid in
CH:CHROMATOGRAPHY_SUMMARY        	methanol (B). The gradient profile was from 0.5% B to 70% B in 4 minutes, from
CH:CHROMATOGRAPHY_SUMMARY        	70% B to 98% B in 0.5 minutes, and holding at 98% B for 0.9 minute before
CH:CHROMATOGRAPHY_SUMMARY        	returning to 0.5% B in 0.2 minutes. The flow rate was 350 µL per minute. The
CH:CHROMATOGRAPHY_SUMMARY        	sample injection volume was 5 µL. LC separations were made at 40oC on separate
CH:CHROMATOGRAPHY_SUMMARY        	columns fitted with a Vanguard pre-column of the same composition: Waters
CH:CHROMATOGRAPHY_SUMMARY        	Acquity BEH 1.7 µm particle size, 2.1 mm id x 100 mm length (C18). Data were
CH:CHROMATOGRAPHY_SUMMARY        	collected at a mass range of 70-1000 m/z at an acquisition rate of 2 spectra per
CH:CHROMATOGRAPHY_SUMMARY        	second. Specific ion source parameters included Fragmentor (140V), Gas Temp
CH:CHROMATOGRAPHY_SUMMARY        	(250oC), Sheath Gas Temp (200oC), and VCap (4000V).
CH:CHROMATOGRAPHY_TYPE           	Reversed phase
CH:INSTRUMENT_NAME               	Agilent qTOF 6545
CH:COLUMN_NAME                   	Waters Acquity BEH (2.1 mm id x 100 mm, 1.7 µm)
#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
(2-AMINOETHYL)PHOSPHONATE																																																																																																																																																																																																					315933	350387	244115	273517	351521	315490	238033	224798	258108	148389	251814	318775	192604	209791	264093	252760																																																								
1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID	299993	281966	182048	194313	175354	265253	254737	279731	329657	312952	291581	359708	298153	283506	320430	381196	414795	178332	190817	206461	174408	164838	144556	158285	161790	155679	170557	235747	196306	182583	221005	153478	187843	210449	321236	16773	18581	12440	15541	21445	21542	16452	23645	13875	24021	19308	18794	20289	27876	21022	21786																					508640	622544	396065	630208	323400	383177	428211	325470	235517	416814	361319	289435	392480	750277	552238	548046	709426	429971	419951	382228	434538	362877	425757	502399	434036	406996	10838	10529	11738	12982	11802	12863	8971	12149	9774	12640	12937	11873	10793	13357	13440	13271	18101	17654	14086	15324	15664	18005	17224	34175	26076	28746	31003	45254	39048	43117	26667	23779	24003	26731	18182	19151	16716	893103	624154	624627	803892	667322	799261	585662	783883	953493	1017884	960969	838802	1558274	1305131	3065238	4348264	3432866	4852817	3328522	3326061	3372183	3836037	3893211	4411312	3344468	605589	465698	522248	561094	526530	3062555	5031970	3517810	4565248	2622228	3516014	3511860	3708406	3810943	3901728	3422273	828760	800507	493333	846326	787761	49935	62032	83031	62711	60410	55176	46233	67848	74886	81994	93612	81234	51598	73060	63950	80540	92129	89252	88750	89722	80616	79121	90931	88503	82293	90420	85279	61523	59528	61381	72111	79075	1039736	848653	711362	759188	881099	861582	711527	710774	784386	80215	98924	79971	67773	80857	801067	748516	851679	850347	746444	783699	717788	902987	817097	69014	141461	84580	105246	180303	11139	11859	12968	11768	21379	18404	19921	20956	19093	17449	17769	15586	17085	14978	13464	12380	9903	11788	14480	13518	10834	21244	23456	11078	13974	10460	10649	10362
1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE																																																																																																																									25427	24402	21759	35	59	0	42																																																																																																																																													
1-METHYL-HYDANTOIN																																																																																																																																							4208	0	1455	1982	0	935	23	4311	25912	33556	29181	33138	43894	47898																																																																																																																								
1-METHYLADENOSINE	22194	13798	15913	8382	14112	6018	9822	17917	27577	24060	20429	25714	24684	25625	24199	27150	22236	18555	21443	23367	24218	21994	18835	15320	15971	14328	36851	25283	22957	21027	15514	21398	37061	25988	12644																																					7603	8958	6667	10997	2141	8727	11844	2141	4877	18169	32788	13204	14579	12096	21359	22196	21874	25677	37115	32309	21023	34163	39492	25895	43199	28790																																																																																																																																																																											
1-METHYLGUANIDINE																																				47326	58766	17825	16631	42273	34616	31187	48147	13780	33173	49148	42545	53910	71671	54097	60833																																																												23606	19501	14236	21913	23288	20543	19241	14463	5194	10953	469091	470566	473580	365645	148228	172623	166627																																																																																																																																													
1-METHYLNICOTINAMIDE	10759	9579	10936	22808	10333	20291	14449	18180	6952	8260	7344	6223	6574	7081	12543	14308	13680	4988	7539	6763	25313	17797	22884	9539	10177	10398	16073	9170	16803	11467	9358	19103	9719	7688	4352	276949	340087	268023	110046	125510	132147	185291	101908	124516	101637	192969	181209	170774	229264	213880	224520																					46847	61901	34623	59292	30558	38587	47459	57379	83836	99542	37677	28060	62993	40541	57714	35695	49010	20579	29860	37101	35085	84234	38114	66763	52929	35072														233471	334599	278892	458085	409175	242100	318137	176196	262137	229569	583999	589683	593742	609937	346562	335470	385886								31645	44235	28246	47770	45349	56110	30665	51945	2323	4666	5726	4674	4719	8496	132303	134651	123456	139611	196290	195616	141461	228237	142210	201962	141560	183315	298376	331628	255945	104416	106311	113980	92648	117293	160271	193736	144502	134684	231550	208081	119113	143831	148578	168362	128084	77453																																	30015	25235	25068	31303	21949	17035	19281	25793	17096	107156	83071	74736	61045	50776	20864	20898	26752	29473	14171	15720	16925	27315	12910	88389	72585	64755	55541	39272	300010	315255	347515	309741	392996	441707	257441	289371	296685	514037	333477	381384	335383	343819														
1,3-DIAMINOPROPANE																																																																																																																																							798	123	739	1012	761	1302	661	1312	9317	11274	10174	7323	13994	13894	7175	5447	4061	7525	8530	6067	8354	6460	5529	7949	4620	303764	224640	215268	210074	130310	2148	3709	2699	781	3478	3489	4854	934	3131	2273	2827	318300	272306	201782	277445	258541	252	8601	17484	11254	11065	16690	16669	13666	15392	10305	35792	16277	25315	28683	26250	17522																																																																								
1,5-ANHYDRO-GLUCITOL																																																																																																																																13004	10886	9168	10472	10503	6135	10062																																															7796	10983	13945	12799	10652	9613	18182	13203	15688	10800	11560	12635	13048	16799	15548	13578																																																																								
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE	2470	3525	7028	5661	5308	8295	10812	5884	8376	8964	6818	9420	7322	4654	2569	5844	3683	8813	7275	9041	6982	9317	10266	11501	10124	9600	9868	22146	11503	11124	15518	9815	11995	15196	34644																																																																																													19112	15037	13902	13151	13033	15320	14587	48990	27332	24799	30876	35788	25938	24924	27935	63442	72521	67299	114511	55495	39468																																																	68877	34236	57248	46740	35411	42956	33842	56987	62500	47858	38426	25305	24132	34338	39457	26609																																																								
1,6-ANHYDRO-B-GLUCOSE	176095	233380	197139	18108	20007	23743	13479	22904	169382	213943	191021	201784	232796	204154	229728	195094	189710	14442	25847	5177	25543	21697	16571	15324	16013	2703	26086	18431	12920	8589	17786	20055	28311	18730	16955	22879	15666	27862	18756	15865	12888	16739	15901	18317	12664	19876	15605	19514	18857	16085	15117	45911	66919	49281	46856	58338	48411	57444	42887	49406	41207	48704	61401	33511	50816	69312	46144	65552	79695	65039	66530	365790	342201	389718	396074	23393	24543	31534	26143	43107	296117	163034	357680	296371	303724	367759	360510	343126	26269	21781	26642	25761	26530	277503	263811	160374	282860	67150	59336	57259	72005	76818	79473	98749	92902	85635	58582	66671	74790	68558	15813	19249	10110	7186	13242	7989	11559	13927	5156	14604	17417	15402	10236	12520	5390	5422	6653	236865	209127	183146	153077	163110	125355	206422	291215	392778	415520	351685	429717	220817	418353	439560	2500	1381	1294	234	1128	1920	1636094	1304144	1362351	1431212	1455879	1322377	1367505	1170232	1157437	1251494	1193337	334978	339216	356965	384950	442030	1288094	1285222	1292265	1306121	1634169	1307175	1347089	1110970	1091275	1080212	1210847	319368	246424	342376	307096	284206	76696	97771	116781	105370	89191	94438	115522	82116	116425	118749	118677	76646	84279	83020	81810	95255	513350	618957	579690	539678	514203	617159	652904	647225	553345	947914	836169	519495	648217	645379	608746	615921	275616	295559	276295	254970	224114	249338	248442	230280	192063	174757	108100	152505	156044	160156	213483	245823	224069	229589	199844	191087	200212	206489	196589	129878	102778	106101	107451	79410	16209	19788	20018	13061	18156	20445	23912	27028	23395	13121	14598	20306	14670	18067	55855	59363	49050	72554	81562	67674	61016	63576	90961	48674	56030	75850	73405	80114
2-(4-HYDROXYPHENYL)PROPIONIC ACID																																				2903	4701	6079	16350	19683	10725	8118	10757	14598	8842	25029	24855	24831	27751	14810	23618																																																												6905	6809	9750	11562	8447	10143	10640	3080	2457	1768	193	266	548	121	117545	62325	83987	11925	8450	9622	8936	23506	15494	8632	52	118	0	1583	3155	1416	139	339	95376	80684	70177	98782	24043	28946	603	644	1069	399	284	1182	625	1385	402	252	952	13153	10906	13111	8536	11052	1375	640	742	312	2721	588	2251	948	636	740	281	27087	23665	18861	17930	19668	7070	7723	3923	5887	15598	20667	27842	22842	24946	29452	41782	25909	32522	32592	34971	30783																																																																								
2-AMINO-2-METHYLPROPANOIC ACID, 2-AMINOBUTYRIC ACID, 3-AMINOISOBUTANOIC ACID, ALPHA-AMINOBUTYRIC ACID																																																																																																																																							2502	1996	2019	4796	4376	4369	2233	5246	182253	203231	157031	384835	582787	253840	38975	53953	69780	80390	117331	46342	53137	174122	212468	323811	154400	8285258	239097	252408	77632	132107																	90800	133030	104256	211879	230457	245051	281441	119933	165284	175586	228891	197374	544145	232419	203793	207364																	3308	1936	2943	1743	53313	47526	59301	41827	51154	23680	23683	18352	27218	28854	2445	2400	2495	2050	54232	71429	64171	84869	57625	38105	44727	42408	42397	41800																												
2-AMINOBENZOIC ACID																																																																																																															2903	4607	3783	4232	5823	4477	4088	24136	27070	19357																																																																																																																																																				
2-AMINOPHENOL																																																																								26241	22672	24221	20843	21741	29198	24470	31178	23036	39761	49804	37963	38198	27498	23361	18591	25588	32173	27026	35608	36366	38538	46328	52128	52513	41405																																																																																																																																																																											
2-FLUROPHENYLGLYCINE	230582	353692	289142	263062	296043	352436	243449	344023	248868	316736	247558	320534	356238	321998	373811	260160	339120	343593	325205	345115	275868	257616	269457	240173	260793	256435	329021	296179	332474	282849	263306	246380	336265	301777	322540	403255	383107	488535	593793	407570	421719	608671	442797	550369	428086	582020	426737	463745	416679	399847	470223	300431	465687	562806	674464	366033	620928	479324	379273	378438	577617	722463	449969	423853	370329	561522	615522	604820	432448	574880	458981	3926696	3708608	3898554	4085776	4322300	4389138	4307600	4438056	4837378	4251117	4101254	4370223	4365018	3863872	4309032	4190992	4298895	4540817	4221740	4416812	4423917	4449372	4275640	4173956	4313502	3976718	311769	280955	366929	222200	362462	399000	419452	319196	306724	335670	335468	348379	343385	438737	396404	456670	368725	357152	337088	388555	459468	338274	459597	936212	739042	602929	602896	566716	240862	500529								340789	370580	380271	344033	382907	383884	377506	391881	64618	344	69273	182297	74519	73152	659486	583966	544914	600251	580032	643581	615414	542001	494095	521664	590072	603924	547948	606361	557353	648850	519453	548144	481823	562980	477189	586631	545043	538845	627264	590030	621824	516142	597813	628746	656198	568845																	834883	841725	588066	750261	846094	745036	821482	681672	893950	784663	734061	910812	819672	717644	758086	745160	89334	83163	87486	81638	76374	97514	84498	83055	110000	95688	91530	107018	84528	74034	73155	78303	75603	76752	66111	83666	74565	85882	69569	96056	75195	81542	77890	72501	114720	145507	124017	135078	167479	141381	192927	202168	169468	147390	132055	171620	161622	175850	151394	147469	165383	166316	162957	157438	162597	136808	160663	140759	130636	155329	173147	156626
2-HYDROXYHEXANEDIOIC ACID, 3-HYDROXY-3-METHYLGLUTARIC ACID																																				22488	21427	29733	41350	31830	24399	39335	22979	36074	22929	43275	42358	36745	41073	33482	54141																																																																						36256	35787	31571	18999	100377	156009	66621																																																						48015	68290	66228	81844	78091	74056	78538	96343	76127	106993	121776	78680	74499	92815	73517	77099																																																																								
2-HYDROXYOCTANOIC ACID																																																																																																																									12029	11167	8510	7525	4000	3951	2704																																																																																																																																													
2-HYDROXYPHENYLACETIC ACID																																				20832	13188	22444	26300	29691	20799	18009	18105	26961	10932	37867	32418	26655	32854	23327	30798																																																												7041	9893	8330	10026	8807	7598	10936	7194	9022	7098	47133	45787	51162	44762	53962	60326	36737																																																																																																																		18587	14953	25493	25394	47608	54671	33822	20167	41531	24487	26300	30732	29665	29571														
2-HYDROXYPYRIDINE																																				6318	5418	8541	44552	30716	32835	45221	23983	46654	2761	6846	7344	7169	7169	4188	7463																																																																																																																																																																																																																									
2-METHYLBUTYRYLGLYCINE																																				115764	90327	180706	166694	136827	229044	156301	71938	197771	70825	213414	168213	197347	182596	132990	151670																																																												293966	634944	345444	260216	180057	141085	216667	237144	469488	237069	1078641	1076369	2010644	1138208	2409823	2042924	2178079	13622	12023	8293	12667	16598	7412	13541																															24118	28271	25508	24765	25030	27361	26597	29892	28624	29714	25792	42599	32812	30478	34349	34090																																																													123612	74106	414013	229769	510452	475676	98039	205702	156040	162337	143968	288950	214981	177886														
2-METHYLGLUTARIC ACID																																				21095	22433	31389	48509	34912	37050	38780	30453	39222	17221	12483	29764	39856	34186	16614	21972																																																												2102	21496	14418	29049	22262	15539	9411	1217	1103	2660																																																																																																																																																				
2-METHYLHIPPURIC ACID																																				49464	34684	25390	66965	57279	53235	76249	35216	85873	13777	40097	37214	42569	79777	21651	30140																																																												65172	73912	101484	128115	70925	104713	102366	71119	97975	69292	549371	559331	611172	936672	426432	404243	300055																																																						124873	187333	428825	262159	213768	255776	350114	298583	373191	200241	285957	253187	288389	316497	461886	416470																																													26192	27612	48526	68331	155254	142895	44947	35193	77594	49730	51878	45496	44302	41172														
2-OXINDOLE																																																																																																																																							10480	6194	6258	7440	7960	7054	7923	7237	246240	390494	393115	78068	579701	411528																																																																																																																								
2-QUINOLINECARBOXYLIC ACID																																																																																																																																							780	385	1080	833	956	496	774	965	14944	13512	12913	9621	20207	18140																																																																																																																								
2,4-DIHYDROXYPYRIMIDINE-5-CARBOXYLIC ACID																																				5275	6455	8523	52959	49318	11483	40247	12048	20720	23612	32308	21010	6968	29341	35657	79764																																																																																																																																																																																																																									
2,6-DIAMINOHEPTANEDIOIC ACID																																																				13907	14231	13217	13837	14575	15363	15404	12118	13465	13209	13107	12612	13492	13826	12478	12883	13449	13018	12149	13063																											22474	26490	28989	25829	19306	18547	18770	18208	16119	15588	13974	13070	13646																																																																																																																																																														
2,6-DIMETHOXYBENZOIC ACID	7012	14565	7574	14466	14320	16970	7121	6044	9355	9405	10299	13442	10371	11560	10020	10458	6965	13361	8179	13707	7428	11605	9296	3580	5659	9560	6419	8986	7064	11622	7154	4959	11178	5504	8315																	77115	73315	174127	209717	67252	34046	91236	105304	93690	245997	250309	104447	145707	65434	192468	315220	206996	112983	144137	157859	5189	6665	17524	4300	4392	16194	7562	6483	6771	14164	11454	12482	19596	12494	10508	12437	10525	31415	20758	12324	16256	40168	18776	25504	33510	29774	50519	45003	29207	41909	48860	62465	57846	40126	35064	39780	44216	62938	66490																		71921	73296	78144	46819	154571	162683	144889	290263	142489	211383	122904	346396	297182	201930	241035	627630	224091	157044	101442	19605	65410	73118	126835	35737	37269	27584	50916	18811	27679	90033	21568	20849	114469	23922	45097	161190	75198	18852	3206	44355	29637	61850	36448	35746	38377	26668	26867	24039	24960	26669	18928	12966	20140																	97211	131521	99496	126271	74793	92070	121297	105281	149421	141316	98447	100980	141282	95662	90004	127855	4828	7924	4248	18303	12188	5932	8611	5051	6469	1244	7259	990	2306	34341	6276	9637	17576	2166	2158	9488	22167	16944	10482	21112	17125	17585	13402	10640															33699	29180	33782	33185	38434	36559	28631	24075	29320	31189	34668	38995	38836	33827
3-AMINOSALICYLIC ACID																																				32291	28172	35492	402971	437332	399662	375415	403561	283319	14131	59074	75854	95125	49134	21371	29768																																															14066	12348	12957	17665	28569	19521	18875	17358	14519	19492	23594	15883	14623																																																																																																																																																														
3-HEXENEDIOIC ACID																																																																																																																									61340	60286	49060	39051	20147	45328	29425																																																						50958	42734	61623	60359	57482	67921	40911	48793	50385	64184	32434	66673	56510	63892	64893	68196																																																																								
3-HYDROXY-2-METHYL-4-PYRONE	14310	10128	10545	11524	13019	13587	16270	13845	15770	15647	14610	11749	17214	13142	12045	14593	12007	13611	15684	14226	20240	18539	22548	17145	14928	16641	11311	17132	15193	19881	14080	14625	12121	17363	13639	8791	7751	12831	18771	12100	12020	11802	7654	62134	1059	18401	16489	12905	16515	13591	13347																																																												12805	12271	10773	2761	11878	9234	13239	9559	14849	7646	37280	37479	31141	27689	62084	71526	44050																																																						41266	38369	87483	82676	76531	79092	149557	80305	120685	37015	122848	96836	121126	131200	146612	74224																																																																								
3-HYDROXYGLUTARIC ACID																																																				13862	15149	37615	46704	13818	7817	18072	18388	16124	40127	57009	19627	20562	13189	45712	50167	45039	33095	33306	29543																																																		556	584	2734	128	35441	226171	112024								0	0	241	123	0	0	0	110	26754	25826	18872	15216	30811	28849																																																																																																																								
3-HYDROXYPROPIONIC ACID	20774	26746	21041	3939	4313	5095	8562	8644	19825	22141	23301	24552	25664	24580	26086	23261	21515	1342	1245	2258	2113	1736	1699	3581	454	1185	2459	2439	3215	752	4402	403	3174	4342	874																																					39969	43460	42284	43712	7068	2819	6492	5500	4707	29668	18045	36241	30312	36341	32989	37390	32078	1604	1036	1654	3462	2513	30275	29257	28022	29740	16948	18025	16876	19793	18358	19662	26512	26385	20833	17466	18401	20331	17568																		58404	52710	51439	42136	45625	42259	47549	53486	48652	69279	60812	64039	68113	75043	71875	9530	4373	4871	3298	4289	4155	254249	209186	211809	259500	221605	212894	227201	210386	211471	209823	186873	55457	48335	44744	59011	47702	194016	209885	191783	209603	268744	209206	223982	172919	164254	193678	205139	44986	45327	54963	44802	49601																	197908	237225	226365	198606	193097	221441	229255	221013	277475	257314	275314	149438	177543	195131	190195	151913	50388	51694	48114	40229	38200	44291	42548	40349	32524	22107	19451	18089	25438	18197	37723	39636	40052	45229	32266	29957	32669	36428	33831	18736	16972	14990	16450	16300																												
3-METHOXYTYRAMINE																																																																																																															5277	389	279	5696	941	285	350	0	7709	1138																																																																																																																																																				
3-METHYLADENINE	982	575	384	11915	12641	11121	12128	9501	831	425	481	113	610	281	399	248	447	11672	10010	12129	14553	7977	14781	6884	6749	7708	4983	11155	4222	2014	10242	5841	8726	11421	18134																																																																												2257	1087	1390	2034	1595	1672	1532	1582	1489	816																																																													18942	27606	41931	33977	40886	43588	58918	35027	46818	35532	41450	65661	76264	91908	79347	46817																																																																								
3-METHYLADIPIC ACID, PIMELIC ACID																																																				17287	6842	20329	27817	12664	2250	4474	14414	13723	20969	15335	17295	8418	13486	20371	17670	23705	14408	8619	16214																											28345	24755	17004	27552	24076	21958	21073	19957	8312	18517	12444	18560	22471											12602	12517	9071	8769	18352	11741	16368	67647	65173	59913	47249	38897	41316	36703																																																															27345	24551	29920	27938	27115	19297	23359	22510	8638	24237	23959	18304	19743	17690	16270	10057																																																								
3-METHYLCATECHOL																																																																																																																																52800	34629	33711	31557	43189	67872	32183																																																															67923	74470	66113	72342	56929	54208	61026	61728	78586	65879	76043	60165	54327	107239	55644	100136																																																								
3-METHYLGLUTACONIC ACID																																				10987	8001	15154	15479	11150	11412	13829	8274	13352	4084	16137	15379	16157	13950	9448	15742																																																												7939	6702	7831	8982	6129	6713	6511	5817	6600	4411	64550	63880	50121	59469	44597	49049	37764																																																																																																																																													
3-METHYLHISTAMINE																																				43691	49797	50460	35825	39357	38657	57830	30620	190770	23248	36971	56715	52630	42408	51412	32675	10855	14063	18860	11188	30333	19779	33739	11508	9270	8095	11406	9139	9273	18117	11238	9752	12661	12045	12932	9137																																								25511	28644	34244	36471	29509	27352	35698	26933	33585	24712								12612	27635	22291	36551	38198	26121	34643																																																															58088	50389	54746	65383	67183	63333	46439	49789	50645	58039	60688	77715	94820	95892	66021	63931																													46787	41591	59240	58499	78999	98243	46338	47888	80903	79992	71991	64874	55018	67364	14808	16876	12769	8547	14733	21048	15977	17129	12378	21510	16514	20610	16941	15650
3-METHYLHISTIDINE																																				42585	42456	48620	34302	40543	42683	38369	34675	38063	29382	44804	41018	54242	54411	41096	49618																																																												41975	48809	50408	68441	54593	50273	52055	44435	50888	34914	82733	81037	32865	77303	58096	51156	48015																																																																																																																		39633	34267	45545	53364	64503	70863	43557	49019	51728	50859	49247	46261	41539	43317														
3-NITRO-TYROSINE																																																																																																																									17007	15102	20056	16914	10696	8149	9731																																																																																																																																													
3-SULFINO-ALANINE																																																																																																																									27764	27347	16551	9609	9356	19293	9477																																																																																																																																													
3,3',4',7-TETRAHYDROXYFLAVONE																																																																																																																									13582	12754	15921	12681	5222	4873	5780																																																																																																																																													
3,5-DIMETHOXYPHENOL																																																																																																																																																																																																					10376	37508	25479	30879	26528	23228	24571	22758	70103	21590	37790	17983	17923	20501	27067	39746																																																								
4-ACETAMIDOBUTANOIC ACID																																				29456	27548	58550	74030	56211	52136	76771	36124	74755	12890	97619	71512	94108	84161	77948	85197																																																												37982	26187	26555	41914	33334	36319	41238	23378	40590	24868	100029	96532	79626	65503	119013	147107	107179								3351	5429	4783	5056	6555	3499	3409	4782	10709	10578	12316	15442	11344	23116																																	99644	157594	235468	205412	347485	331067	417638	245258	237208	190568	377610	389450	407111	444561	399432	403197																																													21383	19359	46594	42798	51559	63661	30711	30663	52005	38794	48661	38254	38595	49554														
4-ACETAMIDOPHENOL																																				201212	211612	404350	3611710	4410174	3289320	3678842	2943245	3708287	187741	527587	832236	640039	646281	480580	623687	8721	43712	43134	4513	7503	25886	39751	6854	5238	1092	5343	6358	6004	5427	44220	4894	5228	16413	42813	1016																																								64906	46548	36657	66024	51677	58632	52038	49693	71556	43570	125284	117625	99787	94507	86839	81986	104066																																																						44003	48717	97085	70572	137711	112745	164999	78072	102683	61307	74567	148639	149169	190847	188985	163057																																													8670	7413	19119	15961	34986	35294	24068	21343	32147	13042	8880	16104	14459	6269														
4-AMINOBUTANOIC ACID																																																																								9793	18936	18977	739151	3105	12866	19575	8704	1424579	495922	479966	584181	557348	17379	15984	19339	13602	2753910	2031272	21591	1359494	21151	468990	947943	580363	342334																								56112	56374	52396	92826	171421	193263	135923																																																																																																																																													
4-AMINOPHENOL																																				13561	8929	21940	21161	20722	12997	22818	18793	23210	14128	28202	19325	20507	22225	14299	15251																																																												8574	7982	6227	9000	7145	7908	7875	6697	4147	5837																																																																																																																																																				
4-BROMO-PHENYLALANINE	778115	1296446	1006588	1026109	963276	1247234	773835	1223918	840952	1068097	818981	1270260	1307515	1274094	1399576	863770	1380187	1390535	1329495	1278088	742489	942575	1047388	714504	1011722	968943	1177479	1040383	1108466	959922	902350	678029	1095454	856785	1077378																	1139723	1311291	1591744	1972072	1147903	1745428	1362115	1250084	1170714	1683777	2176533	1346704	1284004	1116345	2042446	2037117	1805943	1188596	1762840	1387311	1627600	1702441	1759924	1786426	1923209	1875518	1921759	1991256	2125023	2057793	2007752	2111421	2121193	1990260	2101780	2075791	2124624	2214743	2111848	2190552	2172502	2171944	2246854	2215245	2322860	2150882	1397177	1393853	1430184	1413518	1449614	1735250	1913668	1480541	1423896	1261750	1381662	1441197	1421127	1294834	1309380	1312267	1291196	1340054	1332743	1314362	1331187	1288557	1306541	4067783	3981770	3951967	3979808	4082068	3629422	4070742	4165168	4139642	4146710	3561496	4237392	4058010	4173311	2625432	3008685	2871608	2741535	2641115	2691362	2718934	2756379	2188817	2434310	2382138	2283939	2445099	2509788	9182265	8802999	8570456	8575541	9281598	9547745	9133736	9097893	8613470	7871055	9550547	8213722	8665854	8516103	8004680	8624922	8475645	8677614	8201815	8562098	8150876	8763473	8327670	8753859	8841603	8823888	9473142	8335060	8640731	8494769	7892012	8647561	11244432	11070942	10665911	11015741	10981354	10840023	10562600	10952338	10378465	10971166	10580844	10973255	10950678	10814532	10691964	10705462	11054258	10989624	11071005	11147453	11199465	11270020	11269442	11235590	11188680	11060286	11236905	11466386	11500964	11406025	11348204	11222395	1793848	1737014	1806834	1748666	1648159	1774712	1713572	1888420	1727736	1485845	1676488	1717352	1708207	1473426	1798697	1794845	1731048	1784883	1654118	1732454	1785649	1729556	1751713	1815884	1733141	1664439	1715573	1686525	1821273	1882503	1893278	1949560	1990312	1967058	2102299	2142290	2114127	1997590	2065662	2091926	2075532	2111842	2193088	2177216	2201388	2252204	2248199	2225311	2272140	2241207	2229004	2252489	2261060	2281926	2258620	2215799
4-CHLORO-PHENYLALANINE	861229	1382383	1074234	1073047	1096059	1314154	849613	1306118	991301	1179756	859597	1361913	1391346	1328809	1532060	957553	1429846	1477274	1364498	1386021	951547	1025816	1140072	843515	1041180	1029199	1254099	1173876	1223091	994532	992347	815147	1268768	1055744	1268729	1593648	1531978	2058647	2314866	1725526	1685268	2452500	1796966	2186430	1588161	2416278	1821169	1921442	1728877	1551410	1957735	1801890	2121886	2611774	3264088	1810695	3107868	2235435	1989650	1878667	2821026	3601330	2166649	2063799	1738488	3332371	3372260	2989703	1967113	2879932	2226200	16429207	16159976	16758552	17338470	18095346	17764396	18173238	18481068	19822858	18801508	18274080	19567694	19503140	18369392	19230404	18994240	19705158	19479708	18920004	19172492	19472928	19332786	20011874	19830160	20422112	19099416	2254706	2280917	2411232	2393090	2430456	2906677	3093986	2180517	2318688	2164310	2233858	2355844	2316780	2056865	2140838	2136952	2181426	2212412	2062008	2163762	2054301	1863670	1967095	6385996	6280284	6117166	5967564	6218673	5317729	5961506	6357366	6243578	6144606	6514308	6415475	5572622	6362568	1978349	2112174	2145663	2009042	2057570	2098257	2029900	2125813	1484908	923412	958567	1549136	1338740	1278826	6595578	6211284	5877470	5913430	6469954	6934122	6356375	6214190	5931522	5406524	6863122	5423797	5915486	5661652	5471033	5855168	6705558	6070992	5610784	5860378	5053143	6158376	5871645	6202326	6663870	6127212	6743710	5692880	5955322	6484174	6284722	6359021	13551713	13188235	12858642	13488840	13527120	13389090	13174270	13580833	12972856	13491867	13168884	13793978	13647210	14403269	13363691	13546693	14599841	14001944	14493307	14609576	14814543	14933379	14363499	14634977	14528602	14372290	14422235	13812965	13754824	13264074	12948346	12130531	1058820	1028645	1083650	1003675	1005399	1063811	955868	1129223	1292130	828529	989408	1041471	1024118	888194	894360	1045534	998262	1046888	1006750	1062684	1056597	1029204	1039092	1065565	1025937	975805	948987	911005	2047900	2127570	2164440	2224404	2266260	2195896	2375540	2463902	2363092	2297421	2362200	2353100	2310243	2380838	2517551	2552268	2561557	2628812	2643849	2624273	2642903	2527708	2540310	2632327	2668934	2667388	2630001	2572342
4-GUANIDINOBUTANOIC ACID	86555	66925	37050	16947	17214	11629	18843	19037	100056	88788	77989	82415	74665	71193	71259	87067	79001	16941	20769	23911	20225	16883	17535	15286	18812	16072	19559	31391	14862	9541	20810	15850	26344	33994	30450	200660	115055	233939	192615	172479	175492	213373	166209	194236	112512	213571	189164	187976	242091	156717	183853																					76873	86491	104117	98211	46527	83062	80790	67897	40339	56802	65577	52791	55019	112453	115673	118102	114491	92373	83593	103562	95062	86439	65751	77063	69747	79625														160754	181775	71124	75992	152708	86818	102387	152699	37365	119290															85778	81617	97969	84333	71087	35222	101401	88148	27820	25359	30183	21149	49092	39423	150720	205446	181931	172629	159735	202364	201009	273935	216308	190490	257213	47866	92483	55873	142892	100776																	710970	943860	1319518	1190247	1494955	1632507	2121004	1290111	1692934	1324976	1532751	4414470	4020576	3248379	2771475	2319790	85125	91528	68158	52874	53096	56782	52848	67558	52385	121880	73756	104929	82759	96709	68444	109756	41858	53243	57523	56688	44303	47667	51528	64347	62418	15121	24501	27668	22906	22425	55561	46477	46529	49374	36719	47591	43943	45397	43161	25759	30026	30549	24287	29991															7791	11290	12482	12740	3907	6003	11340	12836	16642	19745	23377	27530	59034	16126
4-HYDROXY-PHENYLGLYCINE																																																																																																																																																																																					61352	75842	87058	84696	63035	66440	59013	76501	85952	90647	57963	89100	86846	103067	91417	120095	14446	9902	11513	12518	10734	11915	14307	10866	13995	15591	10661	8405	10643	9254	12479	12502																																																								
4-HYDROXYBENZALDEHYDE																																				28998	22136	46171	78188	49247	44577	45758	32570	40473	36636	25110	62816	71331	47094	16114	24430																																																												7114	14992	13870	21930	14348	10375	10734	5081	7086	6095															8863	6712	6653	7411	7720	9188	10436	8242	12395	18071	15260	18320	38904	21107																																																																																																																								
4-HYDROXYBENZOIC ACID																																				8165	10403	14642	29226	22251	22848	34060	17332	20501	6178	13007	13157	10511	12976	11135	12944																																																												7829	7984	3806	11776	8260	8735	8538	25212	36671	24382																																																																																																																																																				
4-HYDROXYPHENYL ACETIC ACID	313	26	299	8238	5900	4314	6768	2046	27	348	824	519	315	593	139	335	424	11604	8142	7008	7715	10004	13080	6970	8789	9307	7875	12453	9766	8563	8909	6117	3705	7113	14135	5866	4669	11002	11830	9033	11487	11823	8389	12243	5677	15298	13741	16866	15718	13615	15760																					2708	1252	1135	4224	7917	7679	11520	10633	8256	5377	4447	3962	906	4606	4050	2950	5376	12594	15757	15848	14637	15985	1248	4546	4552	1929																																						1445	730	1418	920	434	777	1289	606	21996	20899	22037	23982	16664	18186																																																																																																																								
4-HYDROXYPROLINE, 5-AMINOLEVULINIC ACID	297272	324713	75443	258288	218850	21918	313008	21735	259703	234259	218469	249609	229006	187416	171414	256924	246248	394474	326629	287503	310901	298494	391709	303522	334632	384237	25672	32258	32820	27155	41679	31508	53392	44198	42130																																																																																																																		847443	1062916	1181964	904501	1149160	1089781	1366470	1324072	1360734	910530	896876	2689211	2022063	3086387	2123690	1198402	1131155	1251075	860903	1117403	1097334	913743	1225198	1045801	1030396	890339	929305	2286841	2244805	2436275	3649032	2763908																	1659552	2676569	1826105	3052030	1966227	4733382	3652230	3155218	3878911	3233558	2163144	1638387	2144491	1969406	2132393	724236																																																								
4-IMIDAZOLEACETIC ACID																																				17673	9722	20760	16513	8330	7784	21619	8921	8676	2656	26524	9863	20194	9212	7596	16595																																																												19564	57173	45101	33123	39038	33965	33574	45021	40594	16820																																																													211156	280324	384460	367573	300206	327922	417649	267689	348708	254547	288458	299834	354471	382890	386514	378904																																																																								
4-METHYLCATECHOL																																				13600	13942	18716	18357	13124	16243	15457	15705	21379	14310	17616	15746	18643	21066	14110	18007	98207	46590	122357	159276	78643	18275	28713	86746	85052	127993	102767	103973	50487	84467	119058	110554	147440	92602	53810	106349																											136998	127341	88468	132733	128416	128726	121523	113552	51075	109248	67810	103312	132963	20121	17414	15249	19865	16262	17681	19954	15816	17533	13193	28570	28628	25149	18992	36263	26128	29169	132081	119660	123132	93921	79434	93904	71761																																																															107288	94838	121406	110000	102565	84246	89972	92534	33167	104035	103317	89928	79150	81984	72905	34646																																											44469	39974	41433	47899	40528	43550	47901	34051	35527	38047	43738	39482	42726	35312
4-PYRIDOXIC ACID	5529	3948	1411	6448	5834	8666	13561	10534	6527	4938	3544	4636	4899	5043	4272	4901	5257	5605	7156	6965	9939	8898	11900	6986	7828	7174	11065	13307	12664	12177	6921	9793	15057	14990	9653	28881	22063	44008	39924	22300	19720	58892	21371	45771	8701	33915	23034	38121	34582	20767	38031	4186	24170	6196	1534	3350	4696	9308	827	2214	1282	2510	3877	237	4572	346	1642	467	33	2358	1792	12443	12274	11658	15177	15592	18125	19863	16457	13853	14750	16397	13054	15139	12845	13112	13127	13681	17681	23625	23284	22947	25968	15709	18485	12906	17453														29736	41913	33956	55310	41779	38099	43917	28483	43082	35051	50570	50956	60265	44019	47221	51739	40374	19510	22380	14554	12690	23031	23174	15481	17915	12676	19993	17426	19059	12878	15728	17170	35660	46060	48058	34879	45405	49026																																	67845	88331	138702	110566	127823	141883	173135	102146	156182	129164	169821	129253	158786	175584	183780	152654																	6522	7489	6817	11750	10951	8855	8867	9120	7056	10359	10022	11503	12096	15048															20629	15377	28968	29654	35477	35169	25604	21337	30880	29632	30124	24689	23686	27098	11387	12517	11845	9565	5481	10337	11905	11486	15091	7165	9134	9558	9449	10014
4-QUINOLINECARBOXYLIC ACID																																																																																																																																																																																					21216	25298	27130	26901	56489	42923	51356	39923	35674	33905	49771	31883	40419	40217	44742	36437																																																																								
4-VINYL PHENOL																																																																																																																									15773	15021	13345	12272	38088	46782	27141																																																																																																																																													
5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-RIBOFURANOSIDE																																																																																																															11999	22492	6795	8569	11515	10571	15097	13330	16823	10962																																																																																																																																																				
5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-RIBOFURANOSYL 5'-MONOPHOSPHATE																																				10659	8499	9924	12439	13396	10665	15635	13756	9909	7505	8569	8188	7524	9336	10724	8579																																																												2956	4629	4229	6897	5695	5927	5150	7553	5712	11105																																																																																													2363	2537	697	1299	253	0	0	1050	114	8829	2857	3718	6273	4346																																										
5-AMINOPENTANOIC ACID, VALINE	9099	2696	27812	1461022	16893	1008209	642691	1176002	2115	8667	5109	2683	2182	2508	2231	4563	2372	5540	4584	4711	17018	1029294	30334	977811	61383	759058	1129968	1530387	724045	1260810	1936428	1620073	1191043	1185240	1008424	5383	4037	9721	84256	18100	37502	77169	29827	24205	38641	26863	24636	16387	22476	27812	12878																					1394898	1943414	1333817	1423330	409466	1082632	1520049	678053	509423	22813794	23963916	18929696	24596444	6405294	2761216	3406322	5365328	3177894	5283367	3016534	3106728	3763152	25959276	25274650	29786706	21952920														11558	9687	3129	6644	7926	5218	4011	238798	30018	204704															6700174	2167161	2854018	4239798	2001198	2241820	2565988	2203603	0	0	0	3014385	271	0	9582299	19531110	12675207	10590221	17246450	18042826	16028841	23323594	25276792	29279880	22756086	23688192	27588854	22448686	26166558	16438291																	346357	595152	432458	557840	451238	205122	606693	499300	467111	533815	600016	443215	541059	524771	759553	755943	9567186	9695801	9926316	9506452	7067938	7694900	8435526	8695261	9198865	9595870	9598190	6823096	7685420	7727918	8762604	10010415	1976909	1318594	1567277	1887520	3567081	2681224	2885092	2777785	3708652	1769615	2333364	1811500	2299779	2416313	3564035	2747570	3540963	3749252	3986064	5043841	4414170	4453871	4619784	3556409	4841985	4017834	4992026	4494494															979147	916393	980724	932487	988709	1046466	902628	918967	1037971	886902	971351	874740	875436	910538
5-HYDROXY-TRYPTOPHAN	12119	9206	2402	7160	9680	9953	15674	9845	12587	13458	10072	12915	10272	12771	10794	8735	10587	8607	9001	10425	10676	8857	10913	6421	5971	5363	7082	8408	6982	6786	8665	5127	8529	11718	14419	43956	35515	67653	63414	25769	37741	48244	17851	59620	13971	57670	28681	53207	52030	19900	51357	8197	8390	5896	13354	7325	6302	5393	11302	8942	14564	16207	6360	13606	7793	8940	13311	12020	4480	7380	12429	26157	24135	23707	20534	20723	31818	20196	25581	22903	21998	25589	16426	20146	56268	31888	39336	43647	35411	61545	47042	44273	47302	25597	36509	39570	32859														44078	45741	39717	53369	37975	41880	40656	30864	57710	32139	155166	154759	160798	132753	116517	144865	104128	85824	98358	85659	48939	67961	120927	60954	31629	21124	26235	26649	25229	27532	23828	23835	21086	18147	19787	22925	19356	18058	24279	53454	31232	46903	42449	25765	36596	28735	16927	35024	48900	47906	26568	57259	52482	29323	29012	54430	36683	33845	7759	35706	33693	31154	36916	58960	16408	44683	29949	49400	41684	34192	84312	110339	202066	138139	181051	193757	243304	160855	179576	125787	191614	214537	214535	228569	253591	278367	28300	22254	23378	26816	25243	20850	24656	33910	28796	38128	31963	18487	19411	19938	23765	24885	18125	18592	15061	14852	18482	14326	13107	17125	22325	20059	18918	22128	14239	22613	13920	17423	16858	15004	14576	12432	12417	20373	16701	14519	18410	18451	16199	24141	16653	14628	33510	34771	53477	49533	26355	24965	41739	30316	27042	27524	25533	35555														
5-HYDROXYINDOLE																																				1320	995	1704	20583	17963	20855	23094	15963	25553	16043	35571	23336	19055	20445	35288	27573																																																												340	167	207	7868	6106	6671	8134	472	584	126	4972	3493	4863	5331	218224	194752	99970																																																																																																																																													
5-HYDROXYINDOLE-3-ACETIC ACID																																																																																																																									71213	67167	59417	75260	35283	38948	35876	53959	41280	35563	27803	42466	41160	30144															127849	134290	140787	151417	185845	160625	195547	193009	199788	188084	158254	243513	180690	194222	139645	110441	148076	178755	154017	162373	173002	203192	203690	219504	221032	224872	162489	256380	192077	183858	196757	173281																	46121	35813	44131	39893	35056	50249	39549	38186	61785	60385	43702	32074	32532	29568	34106	27785	30768	28332	24715	30338	41315	40808	34270	33609	39832	24281	40309	33628	40247	36644															24214	18660	42714	42560	27820	36839	27443	19823	35118	33124	40095	35661	31468	43908														
5-HYDROXYLYSINE																																																																								6075	6466	4781	6653	17212	12835	13257	11980	12625	3611	4268	4146	3750	8526	5353	5977	8002	15944	16264	19116	15622	18177	4491	5393	4188	4821																																																				27600	30129	26900	31084	27311	26102	26377	24410	25678	29425	18249	30990	32855	27928	26783	19973	16033	27658	19549	24035	19464	19763	21612	21447	23294	20189	20331	20560	18952	18078	28424	21987	5335	6253	8813	6648	8218	6417	11094	7533	7844	8512	7115	9424	11776	11690	7414	9442																																																																								
5-HYDROXYMETHYL-2-FURANCARBOXYLIC ACID																																				14922	17387	27440	27299	24825	19692	25757	20026	34229	8777	31802	32282	36032	32185	24653	35167	24691	14703	28604	32451	20398	7208	12414	23084	23675	28123	30611	27506	19910	22139	25598	33406	31287	21175	22027	27800																											20361	19625	13692	22811	21796	22079	19697	19012	16191	21577	16432	19565	23493	25327	17289	11614	22134	19829	27846	24413	16197	25856	14493	86812	88972	55402	38732	81315	155886	85470	70612	63009	68544	43074	65821	71543	62105																																															40737	46312	67180	60325	138306	120691	157329	70064	64821	66208	131159	102810	122988	112561	104141	105162	284534	335866	333397	303555	280245	230250	303710	237711	300749	346620	308586	296975	251710	296135	282315	229865																													12114	12620	20076	19107	20722	17240	21032	20261	31580	13713	23399	19763	23082	30001	30930	24702	22279	32317	28721	32616	28792	25345	25626	25488	26395	26925	34989	25606
5-METHOXY-3-INDOLEACETIC ACID																																																																																																																																																																																					20544	29892	42243	42810	88258	79756	114271	71834	66396	57111	88379	60032	65069	58873	74028	52469																																																																								
5-METHOXYSALICYLIC ACID																																																																																																															265	2637	321	565	122	130	819	236	461	223																																																																																																																																																				
5-METHYLCYTOSINE																																																																																																																																							5035	5178	6021	5141	4673	5099	8273	6990	22158	20133	22429	23678	30169	36314	181689	163501	133425	199495	147727	134926	133897	140107	141910	131540	107629	58302	80881	29564	48778	99139																																																	38398	40539	35024	31975	29022	31852	22375	23397	32188	27372	17959	19981	17135	20499	24214	26125	21642	34321	21834	20598	20302	33357	29336	32129	20613	32201	14911	21831																												
5-METHYLURIDINE																																																																																																																																							22252	23166	19754	21774	22428	24932	25622	24977	13490	17344	18411	4057	22174	22196																																																																																																																								
5-PHENYLVALERIC ACID																																																																																																															20922	14333	15720	14758	16124	19690	15525	19407	13460	18550																																																																																																																																																				
5,6-DIHYDRO THYMINE																																				19315	13825	15412	18356	14265	11108	15234	11252	12246	57204	10580	20631	15237	16967	10398	23868																																																												10182	13517	9971	11757	9735	20724	13132	11607	16870	14150	19832	20899	14984	15418	18887	36663	18995																																																						38234	40117	62877	50014	93485	67595	107536	60978	61215	43433	69616	52800	70631	77135	88146	94330																																													10871	6443	18953	16833	16496	19447	8060	10719	20420	16668	17307	12357	18632	14791														
5,6-DIHYDROURACIL	3662	1509	1536	4031	4602	14199	20132	11053	1258	2034	2411	1610	1284	1534	1514	2124	1511	9113	6899	8143	6028	4289	6246	4878	5964	7369	10734	26362	13300	16081	22783	6820	12182	17232	35772	69780	38773	61742	91549	51072	78971	57832	41856	86677	112833	77614	44065	52670	87588	66394	47544	9833	14328	15161	19440	13893	14516	15808	13338	13745	13469	17788	13624	31478	12864	16308	15235	14081	11177	17678	14608																																																		91662	60273	33855	39048	30079	28497	27149																																																																																																																																													
5'-METHYLTHIOADENOSINE	28102	18264	15010	89213	64160	70707	89650	86004	25761	21001	20797	23767	21129	25371	24463	28084	29586	46310	61245	59472	103156	96997	125680	67891	67577	58877	79849	98551	72794	70985	65086	65285	88790	105146	68978	176309	120723	223576	231408	155540	139346	283423	85881	304735	28909	208694	166491	143879	205442	112150	177468	8898	5964	6863	8602	7652	3568	5905	6746	7354	8134	12417	7538	5141	6646	8975	9102	10720	5589	8428	8785	25574	22701	24020	22022	12579	14416	15786	13824	14690	17490	16677	12492	13163	58836	38240	45646	40189	40753	54193	49039	44522	63983	19070	30321	27255	24353	15490	15998	16392	22788	23796	23381	18668	18399	17975	20846	25775	14409	14870	114799	127567	138831	153882	123157	119639	164082	134843	235629	161358																													47429	46172	47496	30821	25906	23946	15971	39639	21151	23397	34826	24664	17082	32963	20960	26402																																																	10961	11963	15387	16538	6093	6849	12296	15892	12133	17305	22211	13990	13689	14717	15363	15892	14355	15834	8045	7799	9950	11252	8726	18186	21260	15871	16026	16467	15160	13676	25489	30108	60983	65175	14043	15443	37487	27709	32245	19427	21919	27558														
6-HYDROXYNICOTINIC ACID																																																																																																																																							5888	522	2262	2928	1881	3941	3753	1710	19772	24463	23491	3952	51556	38530																																																																																																																								
8-HYDROXYQUINOLINE	9004	3635	2729	5998	7374	8243	12185	9113	9697	9128	6708	8706	6659	6285	7241	7818	8562	6786	7950	8493	7729	8098	9735	5886	6212	6380	7271	11640	9344	7298	8012	6826	10307	12421	13568	10237	8619	17659	14345	14273	7229	10782	7676	17739	5662	16623	16552	17434	14703	14698	14250																																																																						53991	52136	45700	51749	30518	36267	30626	31938	31947	29310	20778	28191	458640	22416															32137	31011	37330	35103	41244	39807	41470	47127	46748	47564	41348	51689	40608	47111	39594	34777																	36544	21218	21670	23074	35858	38402	77365	31066	35428	41543	49830	37753	43590	36330	39441	29942																																													15232	14018	23875	26306	28995	30760	13422	12446	21947	19787	22786	22119	17254	24217														
ACETYL-CARNITINE	14297	10136	6067	4292	5410	5899	7870	4895	5488	5669	5434	4605	4658	5032	3340	4071	4562	3486	3424	4316	3806	3141	3102	2859	3218	2667	4263	5668	3198	1570	3534	3299	4894	4995	5765	15042	12018	28586	9028	18390	10238	13367	12919	27473	7644	15028	18917	18941	22875	20980	20402	83571	62466	2711	0	84421	510	25981	39977	71329	112	0	66908	23728	91725	119	0	0	0	0	27357	34051	21350	35013	24111	44552	55085	53459	47273	49114	17586	17527	16063	17522	84847	20480	21793	16459	59852	65486	67910	30220	36107	22911	36332	35353	43692	112614	74026	107083	232986	140683	74184	57001	114356	139145	113252	98840	69105	72556	10126	15647	25079	3821	7656	6591	6721	12356	3317	10662								1421508	1145803	1072945	1106187	982382	759775	834951	67382	12216	15499	15328	23268	12910	21836	18724	1352	504	497	0	0	0																																	26869	95834	116030	66960	124579	198424	61742	68313	83291	115215	156315	37331	62528	32952	46588	27991	3448199	4327746	4475270	3535392	4172248	3825989	5025231	3644670	3901818	3551389	4222370	2999288	3247922	4187355	3812729	4074609																																											649455	740967	694835	817786	907098	973493	803061	696506	849654	864141	603815	504183	637321	527118
ACETYLCHOLINE																																																																																																																																																																																					387352	390306	712146	484530	787540	809177	1072573	642073	854600	700237	843901	2011290	2017385	1636300	1441666	2310590																																																																								
ACONITIC ACID																																																																																																																									21651	18039	20833	8768	42676	41536	12871																																																						10632	15401	14708	17667	20762	21160	24742	32275	18936	27020	27471	17921	19357	15044	17696	19736																																																																								
ADENINE	920	884	1273	7779	8010	6589	5609	8698	1694	2699	1889	2712	1558	1113	1654	1653	1305	5731	8362	9070	9378	6802	6276	5050	5220	4616	5309	8003	4004	1192	4171	5033	6889	10339	13282																																					7292	6488	7797	5039	127305	42168	15565	29707	14460	6971	12308	14082	12286	4850	6554	7500	5713	11278	24360	20372	18958	25223	8923	11007	9593	10238																																																																				50083	23511	58174	20698	47336	64996	61438	52572	49229	84216	50506	28761	92471	41944	78456	89512																																																																																								
ADENOSINE	18878	11211	5016	11364	12115	15643	15746	15188	21022	18505	15856	17640	15867	19723	13702	15502	13278	26996	26024	21574	22513	19728	40681	19935	27627	23301	12449	17401	12627	18400	7924	18606	16461	29275	27813	128015	99684	156441	140665	97983	96408	142436	62389	172985	36621	142850	128842	125072	152582	88595	123071	2156	100867	635388	101729	304290	96813	180662	609	952	1957	3470	82500	1235	187206	285927	41094	18939	319185	378799	1204	145050	86157	124299	129867	20134	25304	20509	17703	31092	7792	8953	7524	9735	133797	82883	89551	108311	50103	84418	43332	47428	44433	12359	30953	16497	15279	1983	1319	4784	1211	3457	2381	6245	10008	3373	65831	129049	17210	30091	127578	146619	105805	149539	126612	114863	138955	132537	184000	148623	474722	467316	509642	201646	319812	374016	308943	14428	13487	13172	10056	218703	69901	349482	131376	69491	66847	79819	144340	84585	135603	128466	58541	85405	66809	70118	110505	53923	376507	299291	252159	333649	299648	274753	328609	339012	285181	292667	258332	71414	46300	46050	43946	42657	255664	247581	205104	222139	180505	216384	245944	219497	219571	222491	196267	90997	73811	50274	117646	95789	124765	211152	381572	284135	227926	265056	354659	275217	373335	162303	245011	336603	391944	376047	433971	384728																	70900	78668	54480	63288	63025	69800	52449	57260	76313	20843	21763	22116	19608	14243	51268	47646	53631	55321	53679	48988	44895	67040	52494	18476	31648	20001	22314	40834	35773	20156	57212	60191	101670	119998	52986	51488	73262	64254	61643	54315	35438	56319														
ADENOSINE 3',5'-CYCLIC MONOPHOSPHATE																																				5510	5046	7759	10461	5298	5645	9173	3945	12650	1731	6762	7019	6793	8652	4654	6752																																																												7854	5539	10330	8863	5982	7509	8717	5665	11412	7430	24229	16179	13313	9518	29028	33051	23569																																																						11947	20854	30276	25390	27322	31309	35208	24844	33333	24680	38009	30691	41035	41046	44986	45016																																													9587	5787	12814	15215	19330	22435	8662	7317	11890	12786	10897	11155	10938	11659														
ADIPIC ACID																																				12187	10202	16220	19590	15879	14846	18779	15497	11595	11327	20028	21607	20395	22673	18106	24043	158649	70219	206130	273699	119616	21717	43763	134012	131949	214588	169613	169207	81165	128275	190605	193739	251804	132446	88075	185891																											105966	94697	61438	115071	98702	107066	96610	85298	33467	105968	48958	85966	110209	7910	8933	6338	15415	9867	9894	9377	8279	12158	5503	22013	31706	35798	17969	115805	135431	81490	908342	808922	816989	623796	633285	682057	570463	7204	3988	7473	3011	6123	6489	6556	7763	19149	9525	5478	5763	5208	2334																																	22700	26385	18735	31562	12446	16179	23311	34726	24551	38844	43131	12591	10044	9956	8458	6324	269069	259929	311087	274312	301910	222431	259985	235918	82055	293989	280617	276766	212271	231064	220648	101430																																											88440	79925	81656	106946	85520	96494	107285	74689	75642	87370	110196	74391	102699	78346
AGMATINE	1895	2185	1553	2979	3309	1645	3517	2645	1352	1640	2627	2522	2195	2130	2219	3033	2975	20457	13384	8701	3040	5427	5374	6328	16661	19894	13812	22808	11439	34664	32619	14916	3752	15175	27371	7078	6347	9295	8090	9795	5447	6953	5751	14254	1363	8971	7640	5588	7484	5950	6911																					3783	3115	4374	2982	23752	16276	14567	16021	17678	21745	20390	18913	20683	4826	5065	6759	7607	45989	48749	73923	43030	41199	21796	24975	21765	21974																																																				28608	31638	24453	44448	67473	42970	61021	49398	46355	67952	38704	196452	301069	142009	186021	156956	21873	31858	19908	31698	42516	34561	44905	34168	50064	64346	40816	198093	216988	137727	158745	145972																																	10171	8936	6832	6323	15434	14374	8605	9182	9838	45507	30431	33480	30377	28209	6870	4448	9557	4214	11090	11279	6332	12389	10793	28359	35890	33277	35034	34429	1937	1758	4771	4155	16391	12495	4605	4212	5619	43188	23117	36910	25310	50971														
ALANINE, BETA-ALANINE, SARCOSINE	128252	96060	76568	197911	182204	208571	250748	203558	139213	120533	109352	126489	108293	133388	131776	137465	160364	198326	205169	247944	211264	190889	197007	155478	159677	147902	188066	344973	190437	197496	253651	142273	222970	280137	450250	6957	18011	10444	11121	8720	23391	9279	13179	15083	23444	14777	12958	20639	23790	16546	21005	28136	25330	24048	14618	29295	30041	19881	27311	28599	20775	21456	34627	25758	21221	29510	21950	25410	20759	28986	21914	94908	134194	95365	113427	52379	108006	142936	84393	65870	92616	76004	67318	82946	337339	133286	172308	276519	188969	211255	204383	158999	198874	128890	217263	182447	198464	39598	35065	37793	60504	50302	39638	38939	46570	46945	45693	41587	34701	38627	4613	5801	9205	7933	7074	8308	8787	6435	6528	5595	27598	27004	31222	47290	33290	34463	25897	169137	163990	150972	205144	115646	119933	114942	2216418	823806	863841	1345912	639864	853500	808935	813322	2521347	2827428	2607820	2802058	3967192	2693782	2482510	4892364	3813557	3159009	4194520	5438568	4537086	6406525	8487471	9008357	7189366	6067592	7370148	5726452	5867764	4507878	4744160	9470953	8418317	9419523	4758264	9474398	8555331	12749096	12915636	11912835	8404219	9468350	8141196	5153924	8841330	7180892	86993	109956	148396	99766	110009	131218	140603	136962	143613	151091	159838	224399	166901	218198	162316	135695	529030	530293	508530	510362	477134	457813	398597	390054	426664	451529	428233	429799	307461	358466	398515	336263	171531	187746	294921	336847	587391	420182	498200	458407	584293	159457	454878	380393	466863	503675	629265	482546	603748	618014	653812	790923	707233	762306	747506	745586	981695	895582	1020428	1050660	6356	6135	7906	11165	14182	13703	9672	8814	9675	10580	15618	12590	14400	11723	26634	23985	21805	22287	30916	39051	28442	34269	27928	30488	38457	28143	30589	25767
ALLANTOIC ACID																																																																																																																																																																																					8772	12030	6585	5226	11356	12138	8169	19470	6300	25188	18616	9827	8301	9160	7657	9229																																																																								
ALLANTOIN	13076	17690	17520	83302	41394	52720	40734	36965	11315	13244	13730	13415	12796	14348	15315	16425	15977	26240	21568	20876	69233	61456	57927	35973	38190	41626	45550	31540	42783	38050	40194	41349	30969	26213	24496	296254	228500	307158	372098	321895	319792	354609	281982	341042	148090	338374	309045	237570	261104	278900	270526	16982	14637	13689	10381	14583	19844	18829	11822	14119	13307	13314	13835	7939	13717	15111	13297	13633	13439	17175	13966	55299	59096	44686	62865	163767	146601	169360	173045	273912	81292	58044	62115	68014	32815	41835	27381	41809	73356	85331	110447	85272	150610	49320	61051	50053	44062	25742	34407	27314	28027	24645	33728	27039	31102	25721	22131	27698	22800	19991	348963	311926	231335	273203	319503	273207	287518	327772	251569	338650	485351	442680	311234	245604	116921	206312	127655	43648	44487	44501	40297	52244	49238	57354	31003	45281	28836	42028	50471	52523	37805	60373	71	12	42	1595	893	730	120757	117358	120253	119262	170543	166635	141693	159978	108763	218486	134288	298184	615015	278561	935408	442912	94098	82976	89776	85866	140700	132337	129720	80705	163229	160533	127251	294151	321523	473662	465152	225950	1155444	1241782	1548267	1454958	1544724	1473460	1124942	1329439	1297610	1508456	1174575	1553737	1526704	1221693	984955	1246250	116346	129874	123836	124742	83158	111367	102423	102073	149961	155466	130665	86492	101516	103104	117846	131131	18055	16519	17299	18820	10807	13974	12469	14333	9451	120926	81212	100852	101861	84567	13391	13156	13976	14692	10935	7859	10066	12356	10599	74987	64580	65270	57793	49435	199928	309400	230202	204087	293239	247326	316053	367899	313665	302976	298505	291096	194534	177769	16750	20335	21059	15321	13120	14279	13192	14247	12010	16497	22068	17300	18200	19238
ALLO-ISOLEUCINE, ISOLEUCINE	2539140	1757103	942062	3003220	2916716	2211168	598823	2172972	3266377	2244927	1835214	2602381	1930133	2647507	2442990	2534611	2966131	641825	334767	573707	550733	2170627	2232994	1749680	800902	647483	195306	84541	158458	204470	218182	1441418	21142	25585	140557																	4987622	4896954	5611152	7553028	4351224	4051799	4587216	4689299	4953013	6074152	8131990	5356452	4391558	4565348	5827530	8057460	7264182	4263204	5044052	5529114	2845422	4175955	2432926	2888172	551376	1695712	2044675	839813	745071	2415203	2512531	1033323	1716517	517164	4907523	6297820	8789715	7050906	2737665	6035808	5852218	7655730	4687470	1408495	2984330	4088592	6963439	5793652	5633383	7197910	5896218	7131128	6952174	6459484	5737326	5544527	5023873	5662090	6040041	67039	44223	88768	88966	53400	59841	49710	31444	51063	40113	233979	238923	237230	192379	503508	439422	400995	10246939	9303748	9138450	7662999	9383428	9369088	10172298	11567431	4867951	5493920	7268136	4143676	4456945	5048134	4241550	6186530	8194712	6309534	6278948	5650018	2490705																	28605212	99415952	40210664	96303608	31113482	22723338	38122028	42656784	42204884	47274036	98522344	36263132	41173476	28386062	47275284	34313908	202904	236094	287646	284957	326403	308033	354470	309805	350304	282818	401222	317335	283272	317828	298558	304883																	5944014	5176770	6327070	6986628	11407911	9083578	10823032	10543462	13729504	6298477	10476504	7668536	8362296	9188230	14200119	9894616	12210753	12399267	13258497	15729809	14933408	14413086	14908301	11376248	18145578	13458872	16589908	18885824	107103	75345	158628	227200	639694	858151	261552	146625	314686	119289	191918	160062	205763	145008	11269516	9717203	11089224	9889877	11275787	10310279	10513573	9769448	10612161	9338142	9909678	10489578	9154171	9836756
ALLOTHREONINE, HOMOSERINE, THREONINE	972977	850526	602662	234803	194787	242398	222319	253321	1073363	1034714	943523	1121070	933925	876476	1035777	1213704	1301960	205136	236909	303985	234284	208184	169998	152592	143501	120300	207711	360281	190122	213941	260003	160899	249704	272745	520108	14982	18965	15260	20041	22869	25065	19857	25536	16235	23592	19043	25577	28382	29265	25078	22099	35222	31564	28563	36406	28702	33486	17490	31686	35908	28010	21114	37493	19813	32483	31598	19820	26220	22627	32769	21748	1392921	2093588	1097500	2186040	70061	136209	130221	94369	104687	249557	221386	126101	164400	2418564	1912470	1804883	2517079	463062	647463	391668	435035	523724	336022	518269	430877	443822	53704	53674	59684	69938	45901	45049	40861	69401	47293	43642	44027	48739	36632	18651	22686	20727	28408	25069	24203	23726	19309	23630	19200	34994	34212	39861	40810	38781	36422	33834	118066	91930	104325	107160	55375	60312	54486	2790412	2296489	2061225	2746922	1764108	2610596	1587434	2602170	970784	1040057	993914	991499	807118	955171	8177180	12916443	10239734	12935625	9428121	9109588	10237934	9726836	10810094	10705302	9289702	801589	636510	821055	679259	746745	8824946	13573710	10068080	12829361	7345872	8880508	9918899	10155149	10668735	9850630	9283333	1364815	1506688	878212	1660188	1608618	55711	72936	76498	93003	103501	100033	100968	95864	100476	109977	128990	118525	127799	122748	133355	131562	301252	354431	284179	332403	279243	293494	316226	319717	316257	301820	301183	196236	213656	224442	213360	288419	2239728	1856238	1663428	1786199	1675680	1697871	1401789	1377751	1563742	96567	180223	126302	96380	131745	1679242	1618883	1916705	1893132	1466206	1345677	1220370	1585410	1464790	114130	209808	129793	157059	245006	17698	16551	19656	27627	22888	27965	21531	21312	23493	22743	25228	21043	21505	19280	46103	38525	33722	35617	40512	43319	35456	36651	32728	25050	40531	29178	25614	25306
ALPHA-AMINOADIPIC ACID	7163	8086	2705	6213	12121	16196	17096	15867	8510	10581	6870	13587	9621	9487	7598	8787	11561	11759	13908	14229	11375	5346	11464	6155	5754	6069	10585	21156	13065	8008	9320	6736	13748	18872	25782																	854	2529	956	4173	2076	4169	5856	4442	4904	2721	9268	1378	538	1571	2010	8307	9984	367	2349	1247	113179	83760	76898	91517	18937	219718	168473	67179	134929	166211	273644	122254	193238	125201	96822	98954	87574	142983	134280	134601	132455	175121	193144	155250	182161	139144	2937	2817	4009	3758	7565	8916	10957	11558	10528	3051	2977	1987	2588	3181	4213	2347	5431	4314	3462	4054	3262	2315	2216															342724	146289	160175	256529	251675	272238	234226	291407	962	290	1114	100	161	1979	471668	354287	378676	516297	468644	351861	633724	429788	372255	467224	314797	646064	685123	654630	756864	720571	292360	358879	447161	574630	344875	413930	499388	309028	363116	442545	304568	225147	342825	200498	491181	526501	22515	40201	37705	40203	72820	60884	64900	48797	56439	45262	53440	58462	56831	69047	58228	66164																	97040	100738	81702	95849	67956	71457	95030	75946	85977	111795	104769	107302	99329	103631	67844	81190	79531	79770	55207	53933	85010	76851	76058	86496	98745	106326	96688	84804																												
ALPHA-GALACTOSE 1-PHOSPHATE, ALPHA-GLUCOSE 1-PHOSPHATE, GLUCOSE-6-PHOSPHATE, MANNOSE 6-PHOSPHATE	137	0	137	852	985	585	1218	351	103	111	129	335	0	0	151	0	797	5779	5041	4591	0	0	0	633	366	2287	1236	1318	516	1117	3669	111	238	2689	2697	14972	12668	12023	12524	16424	13210	10324	11055	12300	7190	14377	17086	12438	15078	12895	13877																																																												18369	18428	13776	7013	13699	13161	14464	14304	4654	13031															3503	924	1727	2608	1311	1191	1409	1645	77157	16924	69360	31961	26173	237141																																																																																																																								
ALPHA-N-ACETYL-GLUTAMINE																																				219924	145776	377409	424849	403988	162715	453136	105625	421155	123694	367311	186816	239333	261802	203571	339058	8020	8036	17408	14837	11807	8377	9812	7351	8388	10665	16248	15015	4441	7655	22305	15243	17829	18161	21407	13919																											12793	9896	6961	24871	16020	26612	11340	15467	21258	19299	11072	11919	14356	312888	243385	179034	270109	160814	145949	248631	334445	513506	356743	846404	700759	404469	266254	392211	193015	298476								5788	3968	22051	5038	4699	20086	4969	14837	1128	60	0	15322	269	0																																	336700	453076	841810	615044	574364	610062	804205	586292	701977	438879	555065	765106	799912	562408	895132	431537	25365	16996	17477	15506	14264	24124	14829	14466	19653	20751	15504	17157	20369	20823	19328	18698																													76584	86480	88433	101158	145805	167980	100402	64127	112969	115058	92073	112797	106663	92185														
ALPHA-RHAMNOSE, FUCOSE	14262	13024	11796	10504	7336	12072	8096	8491	9123	11547	12631	10624	11706	9765	12140	10620	10165	9122	7293	7791	9637	7881	8204	6792	7744	9680	9430	7431	9935	8092	8475	9147	7942	6739	7291																																					39552	34707	41948	43081	69224	52898	48127	62804	64996	32595	24813	29967	28789	20828	29193	26901	30116	34293	25605	31120	35871	29157	19762	15348	15925	16538																																						21372	29190	30890	24019	37572	36745	35013	42986	5397	4925	5471	5857	7248	7753	105576	80917	94551	107985	19238	15481	8083	8036	10107	4099	10242	11200	13027	25038	21232	26910	75794	74394	79803	81285	3873	3183	14989	12902	13521	4561	4327	18231	9913	13495	15025	12392																	14663	15336	14770	17449	16641	15295	21353	14417	18599	26590	20978	12468	15231	14645	14051	15417	19396	18300	20756	19380	1917	3008	2394	676	1728	5758	2629	8289	6533	5331																																										
AMINO(4-HYDROXYCYCLOHEXYL)ACETIC ACID	8696	9212	3429	12274	13476	29874	21993	22474	9517	7778	6572	8599	9096	8866	6868	8070	7393	12580	12237	13754	15002	8801	11427	9485	9556	9098	21316	29295	19540	11495	16525	13634	22542	24396	24082																																					24728	22487	25480	26543	52869	42675	44094	53278	52672	36959	38195	32299	34071	19828	18049	21745	22949	26034	30608	37936	33965	36406	32341	35948	34551	28503																																																																																																																																																																											
AMINOMALONIC ACID																																																																																																																																																																																					2987	2640	578	24351	4537	2287	2674	1458	2857	4386	1614	3464	34109	3797	2528	31773																																																																								
ARABITOL, XYLITOL																																																																								19402	18324	19899	21573	45692	29531	34714	33842	46244	21475	24538	25367	22962	19457	19771	15932	14719	23956	17274	23836	23018	25348	18902	17683	17581	16397																																						17560	17797	15244	17722	18820	19654	20361	19326	5958	5272	5953	5126	6223	7624																	47013	52333	52702	37745	36497	26247	22853	24825	24223	23070	24468	55693	55885	81891	64369	50425																																	9806	10025	7680	9098	2501	5964	1174	5341	2300	20499	16239	14461	18507	21053	5168	8029	5950	5937	7112	792	1315	6905	819	13333	12841	10170	14793	13015																												
ARGININE	705825	616194	387092	325445	292982	424659	659329	388515	845783	715851	659015	855608	694111	721900	683046	833181	962226	301398	362828	453681	413536	290732	313601	304494	329914	255142	483185	1033321	463943	417489	700950	409865	460176	686055	1148860	57767	67346	99644	18647	71647	72345	20917	25587	25735	16031	52280	23700	37627	39840	53089	22953	9232	10656	14974	27067	10216	12786	10451	13207	13238	19189	14544	21132	12012	9438	14816	13590	16267	8558	16698	11669	609647	971319	580339	663268	715007	775283	903879	989212	522635	372026	358214	260864	332766	2109378	827701	993087	1072503	814396	1399593	848248	1109130	752731	435510	672115	808296	548720	87357	37379	74037	87569	16282	73034	40596	59707	60895	63150	8115	61946	71929	16397	86604	35603	37682	70383	29437	49401	48826	109097	20317	30844	33421	65037	34261	47885	41837	41984	135180	148480	95851	207771	122724	188865	154142	2367487	1007387	1313991	1590916	1344056	1437562	1249536	1274364	1223576	1374227	1359645	587658	963169	264172	4838037	8557483	6214543	8389500	6892487	5848590	7059272	8546441	9691212	13239055	7865004	14612119	19544796	12523396	14942336	7695578	5206844	12366051	10414811	12324591	6784996	9973617	11751838	14326984	11210782	14722211	12667787	12071622	11666440	8662681	11582886	9553852																	486569	133564	456060	500181	703630	352742	480083	515654	429411	626540	525213	382657	404252	374598	423202	418640	2265214	1876206	1640416	2002005	3220022	2867465	2354914	2228794	2902305	4030912	2482700	2888048	3308928	3009790	2660727	1782744	2383097	2527902	2509930	2770110	2358905	3320701	2715051	2548422	3427934	2929746	3096589	3369052	32393	31725	27427	33508	262093	222256	77825	28222	49736	86547	102244	58573	73358	80106	62478	111573	99546	98909	76716	108718	122065	104376	91461	122448	123414	130462	96737	124991
ASP-PHE																																																																								8612	6289	6433	5469	11450	12061	10378	12699	13297	8890	10294	9125	7918	24386	19954	22502	12800	42950	61518	21217	24413	34584	23325	36065	29469	24348																																						73659	30644	34830	25154	24953	18895	25866	21744	44789	45987	52780	47266	28666	23382																																																																	14760	11723	12362	16310	18878	18279	17109	25603	23685	20112	24544	16561	21135	17132	46678	21864	15933	16338	28688	29632	35951	29633	36662	36640	90391	42643	34535	28765																												
ASPARAGINE	262677	284884	222601	53036	32703	58842	22584	20524	258679	285539	302164	329667	297253	240063	325207	373052	388387	22777	20681	20273	22890	24484	20408	19849	20007	23760	11327	6663	8071	8968	12732	9133	16901	7780	9008	17409	23120	14239	11855	19043	18948	15029	20817	17033	23833	15217	14819	20401	24966	14461	19613																					414555	692861	355778	615081	58686	66853	86857	53705	45651	327360	266178	236022	318208	737481	566883	568624	774730	82323	90848	98482	84671	89014	280512	317044	305114	290182														19876	25248	20410	25037	24421	19935	20882	22071	20469	17822	52573	53446	48501	43990	47165	39459	43330								872854	747647	708822	990544	603012	909750	584042	861067	250823	338701	249656	152127	53819	27485	2825742	4266100	3511583	3796939	4076757	4073917	3821438	3251310	4388346	5476195	3629626	455506	172101	462343	411468	159372																	105402	116862	131040	126211	163154	168889	152604	147625	193346	186842	159456	156872	136697	166436	122954	135344																	815745	597646	549443	608000	844156	790337	728536	609040	655403	52649	83991	71258	61220	77985	610097	583945	679002	694931	695604	733616	669435	740564	723125	59609	46777	58235	55037	95952	21946	24092	27092	28161	24373	33630	28733	36585	32054	24422	27607	20787	23164	21647														
ASPARTIC ACID	143769	170082	126519	309043	258392	273974	249368	304704	102722	114851	121975	145019	143229	155032	165098	151260	162051	253241	255512	294360	278064	290121	200216	208347	204900	179153	240390	291860	227456	277298	281816	221700	259444	232146	270200																																					282202	265387	274262	231618	208244	262337	231203	187024	260793	470490	434700	304552	365746	471357	205367	268943	292212	383755	423793	349440	369323	414101	472924	538587	479112	508699																																						609689	302598	338185	350979	426101	381620	412626	376726	1418915	1296432	1176252	922554	782379	734178	1354958	1134677	1004166	1308910	840351	813366	753289	710257	711359	939521	743964	821562	614165	786080	778227	774201	820727	1120624	1350084	1197057	660890	831248	761422	732832	931016	856802	874745	808326	1155078	777856	1286287	1481123	15741	16688	18157	15701	15240	17328	16214	18684	18184	22630	22539	20589	19140	15364	16619	21957																	165529	148578	123596	118714	99059	82248	121149	111447	102035	80054	95621	80992	69369	86321	215195	181157	189443	166143	110247	117504	133976	164801	148983	61121	128131	70365	100740	155043	1910	2323	2227	56	3075	3036	3232	2216	1747	2980	2630	2018	8037	1745														
AZELAIC ACID	1752	6093	6757	8135	1430	6590	5884	8790	1424	5625	14144	8592	7073	6419	7262	12987	7268	6978	6792	1551	7275	9690	9958	2373	8628	9085	6574	7470	9086	6742	6678	2919	8618	2146	8862	9475	8435	13819	16012	9878	7176	7742	9228	11505	9787	14869	15164	16379	12144	14174	13928	1913134	1012524	2364898	2962344	1490333	391437	772870	1722436	1733300	2696249	2363403	1935900	1357527	1567346	2312348	2858065	2748435	1634806	1278188	2149896	25367	31043	30492	27328	17523	27055	28375	19534	17374	38738	41366	35078	38435	41860	33912	27479	35099	30669	28274	32763	26163	27052	34706	41234	36547	30203	2119033	2513632	1758623	3112896	1991174	2557810	2303054	2021844	1448302	1435922	1475446	1476030	2490807	13019	9113	14044	10741	7193	8600	7504	6295	10661	6461								2203782	1955380	1275142	1484349	1186532	1752668	926411	15916	14060	10483	20802	2393	8099	2856	1670	835	5682	5911	12299	3504	6594																																																	3176680	3752418	3317610	3441786	3396794	2684368	3191763	3062328	2723040	3002755	3413022	2851658	2697032	2672367	2572269	1704348																																											1143201	1013768	1105926	1272134	1017186	1098128	1131680	890849	1048696	1074986	1241030	988934	1187392	947996
BECLOMETASONE DIPROPIONATE																																																																																																																																																					39023	28274	29353	35576	92126	96034	152859	176194	208173	98613	120587	119314	85967	72925	72905	98778																																																																																																								
BETA-LACTOSE, LACTULOSE, MALTOSE, MELIBIOSE, SUCROSE	16514	26434	24670	7705	6510	9206	5632	7601	11580	16993	18830	15286	19349	14288	16623	16666	13021	6556	6131	6727	9322	9138	4960	6498	6259	8120	10182	2892	7905	6450	4591	9140	6838	3648	1592																																					85617	75496	90943	80643	3133	1218	1539	1981	577	85903	90185	109323	87568	27690	40709	43804	37483	1611	850	701	1462	1859	60451	45746	52339	51445																															12780	12352	11599	9797	10752	7159	12372	74114	81063	80986	80410	98755	34856	82067	95911	274	53	78	89	71	163	287595	241351	315283	418068	361679	261488	293402	295688	245272	316631	235034	10051	18029	11672	26548	32048	243470	262902	267389	229396	204775	245815	234940	151523	212837	141829	278949	6653	11178	24359	7914	20278																	10766	12065	12006	10082	6577	11613	10806	9974	17630	14270	15949	11396	15828	14857	13956	13665	23450	38075	32116	31721	15606	20251	17842	17126	3793	245	0	0	626	0	67485	62206	61956	64016	57992	54413	57438	57679	55804	36329	32113	18618	17591	33670																												
BETAINE	117987	85380	84621	113212	165457	120044	219314	142968	125573	93505	106672	94709	77317	70225	73818	78563	81613	130012	128991	134922	109630	91503	110258	80328	91763	104749	119077	165775	131629	103446	133241	95225	115508	144367	154407	554541	526527	440204	362883	767518	521760	358755	712671	520660	2398255	479465	851031	797871	737419	832356	516250	391939	591826	422510	616423	376477	770337	539472	578391	455526	399214	447620	587205	1145975	317685	390596	383496	431400	469368	511731	367642	241656	252774	317415	336204	204356	217155	203329	215592	216155	176299	181047	991172	360820	313493	212025	228814	223860	242171	215746	182381	272007	256956	196255	292520	197612	198672	483590	394959	390112	561248	496905	491515	403153	443991	462807	514176	476500	383578	446918	271699	272504	343198	387851	432860	506294	579669	215128	342205	233221	520593	524656	545910	693857	1941342	1827375	1329261	634271	621080	574135	571380	879048	1006528	642718	255678	215193	206999	200978	206839	240881	277830	255899	325988	384150	292859	420334	410603	410500	544428	909598	678417	792880	636183	724696	798070	703032	914744	748429	670405	928192	639777	624580	800157	1008114	635776	709826	803586	668002	572844	634437	635845	590982	494758	569962	584411	939043	633433	605492	965781	706559																	2130219	2105277	2238633	1778512	2879248	2569453	3086831	2019126	2245943	1537226	2254265	2476439	2549005	2412021	2090763	2129421	108954	157723	173662	172898	145717	135679	140339	138638	133385	128398	211238	174479	146529	187138	129533	127462	125061	128070	119154	110888	107290	140032	109102	124022	164830	174332	156119	150275															478089	370019	327572	369942	492694	592584	447348	479439	465339	537666	602029	455430	506663	458171
BICINE																																																																								26267	27100	19328	24079	28271	28931	28820	26052	22690	27228	27927	29212	26608	15499	14979	16322	17061	14933	18919	18561	23413	22134	22267	21701	22237	21241																																						12026	12577	12762	13146	12475	20826	17346	12260	23496	25431	25184	48194	42021	50211																																	4540	6238	9868	8229	3411	12065	7896	6081	14993	2170	6144	6403	18166	16858	5516	21070																																																																								
CADAVERINE	3071	2743	1720	99539	81459	286263	281069	200938	1884	2967	2531	2620	2550	2864	2783	3818	3087	61421	52723	58185	117569	103498	94089	76225	88880	94725	145145	209346	154399	107762	153803	100428	153652	142306	288914	14427	9287	12992	24421	26195	23417	14321	16360	28023	3260	32230	21180	14446	23569	19008	10570																					5811	4590	5350	6084	11606	14092	12501	11840	9557	109916	111388	82458	121829	2585	4725	4876	6899	4226	6085	10048	5811	4781	98807	82423	95716	82703														6153	8606	10305	5647	6241	9081	7968	8820	14111	16781	42565	41315	51023	63601	11288	12986	17253																						53026	48173	36780	86919	127143	90314	152239	84332	69994	143230	58293	224105	242952	245179	217466	95823	32205	46526	27941	47054	90962	72002	73342	55748	107450	118668	60511	501760	476776	394750	489241	536878	15643	20531	71424	31423	79507	87453	199927	124297	225822	104776	152477	85068	99380	110071	152532	90969																	10272	8053	4763	4861	13766	15007	7020	8520	8150	20041	12597	13776	13958	10983	4465	4255	7725	6878	12221	9456	10067	10776	8961	13817	22523	20461	23153	21212	2235	2093	2687	3854	43359	30691	5939	5070	7613	7083	5222	4398	4406	2509														
CAFFEINE																																																																								10376	7175	11476	5311	6075	7439	6523	6489	8353	7552	9548	9676	8667	9765	11906	12578	11911	10870	12394	11660	11748	11289	10113	9669	15169	14045																																																																																																																																																																											
CAPRYLOYL GLYCINE																																				4602	3729	10424	6369	9605	2824	3327	3560	19104	5747	8573	11369	14064	11552	5122	6220																																																												6082	4734	9800	6475	4022	5472	6730	4606	6833	5282																																																																																																																																																				
CARNITINE	84582	45039	39893	17448	32540	53857	127152	42506	92205	86384	72686	62698	62662	67053	60301	68631	51018	43025	54455	63020	48819	41097	50860	37483	37304	34902	69754	99238	54201	84702	85974	61151	73251	97061	99914	267882	332469	489950	181675	259891	219469	256863	215333	287926	145204	361101	445215	487131	488832	502968	525033	505496	586032	614044	604482	539181	658956	533312	593738	538421	585090	447798	551870	491605	512448	433300	517661	524688	651283	549950	525115	67426	90914	76049	97085	47522	26980	25576	45281	44870	37587	33233	27311	45529	175598	137281	110937	154070	46750	72879	69589	39939	83849	48038	58372	55628	69007	371850	373466	405131	447682	402697	414770	452474	421732	422229	387964	435189	417297	388580	210844	440314	425765	305829	310620	325220	341229	238011	239832	119959	466598	451354	812907	805164	705916	727222	579368	761960	689244	702962	734088	959990	881759	925064	126091	68374	51590	84936	49177	63535	36994	68568	63169	33613	36711	30971	22334	35206	411085	501691	418812	611495	431765	363218	406489	533687	513472	395130	313679	292337	308557	285931	312488	219083	553480	700896	671459	657741	463968	524734	495786	542150	544232	488836	420423	448048	522698	382462	552034	498663	752514	1001789	1212281	670600	1416589	1428890	907930	1030992	1074033	1397443	1067969	1460913	879237	1579737	1260192	921003	1701340	2112988	1869738	1984163	1880784	1814662	2458147	1896470	2002828	2005082	2083214	1786246	2090984	2110624	2235324	2360040	110555	122086	94321	89895	48854	72956	82624	85058	90220	10551	27157	67646	48783	50041	101091	116086	122268	111266	54731	74619	105062	113995	113558	25562	94495	46928	87665	53097	379323	239662	453604	585772	464212	583055	423457	291323	415103	455719	451716	325382	306715	330899	525478	534690	566416	602449	712621	619438	597671	529694	552518	574838	537407	586152	549067	550422
CARNITINE-TRIMETHYL-D9	234806	380717	425219	167942	182309	428926	180276	378815	230556	369368	323909	308832	375543	292436	392071	294684	315825	277462	233052	248851	175700	158343	135702	146399	150920	158914	381301	207532	407322	334892	274094	356304	318813	237282	170194	128634	164359	104742	115686	102786	112968	130050	139185	98382	251711	173886	116391	136811	140213	156691	142730	58531	56701	67799	60352	62524	103993	62764	56895	64245	70882	60446	49701	45102	55743	62190	71694	51676	73629	54664	53194	662281	766205	638610	716976	579516	433799	410612	549176	647486	906461	860149	804431	916305	531798	660382	586315	642659	468811	336099	291043	465988	455138	848808	713177	808780	765651	43137	41980	44742	39944	46320	42313	46659	42811	51241	46393	48915	51825	51381	146969	161554	173747	143190	173416	146456	148258	132075	102958	126974	331980	314849	297237	376791	299970	229808	337839	120708	125332	143723	163543	121167	156146	158318	377975	570766	481704	499571	471468	523337	443142	516129	618398	733078	692718	776261	831489	821735	6293233	5954108	5490394	6000991	4439700	4514246	4117660	4340216	3858002	3382790	3904112	2742699	3489068	3060595	3681776	4794761	5610430	4788170	4553278	5225378	3985593	3518289	3520766	3955363	3270618	3223223	4221909	2313783	2945742	2494142	3388787	3778143																	682169	654961	662248	778838	634006	671789	556405	670049	727826	683020	681954	898659	818686	828718	1141531	742079	1159703	1109145	1226976	1062884	660183	695536	758651	782814	628982	709716	832118	805133	701478	670710	1162853	1244793	1079315	1057143	683119	732889	786399	675954	734748	1010488	803384	721354	634854	641829	984705	1201868	674612	650339	553448	551301	993404	1039049	696642	877721	859920	802594	821771	798130	244887	231464	247167	265252	250198	223101	261577	259695	246881	238711	214878	265649	241211	245703
CARNOSINE																																				14317	17350	14126	14411	12561	14110	13047	12871	14516	8639	15968	15375	16829	17967	10270	17298																																																												14123	6659	5998	4782	5278	4287	7386	4941	5197	4970	16673	17970	13135	11577	10084	10465	8138																																																						32381	47933	56638	40221	73294	58767	59744	38854	73679	63118	52595	88607	91726	126125	82922	100539																																													9609	10614	15593	11210	14916	18629	11093	14296	12613	12154	14950	13746	14914	10240														
CATECHOL																																																																																																																																																																																																																																																															15550	13688	17664	21781	15766	19228	19755	15711	14111	16652	28685	14840	19675	16393
CHLOROQUINE																																																																																																																																																																					281536	244829	239877	273608	204858	235797	169745	223838	172318	144059	151140	314420	206695	222495	168622	188673																																																																																								
CHOLINE	1885519	2265831	1483683	5927788	5921054	595114	1800444	493056	1463320	1533120	1473328	2203606	1953843	1854416	1728698	2057575	2045415	2971850	2927775	2935078	4966832	4777532	4931648	5164037	5254258	5497166	659621	1528564	536003	389193	1060138	319934	415263	992088	1976137	1002650	851378	1221511	356074	322477	405483	444078	427380	551034	2373009	769252	762738	719976	698828	550892	694171	875627	967406	893223	1048640	878899	744224	1002343	827922	783301	984401	1108789	850397	892618	971620	861344	952844	987172	1020420	803392	1048125	6143722	4815752	4929588	4078481	8081139	13671501	17358460	11746701	9009599	578398	279459	810613	511794	5817763	2903892	4984386	3709100	4464574	8088858	13436092	5256318	5257694	580419	1218069	1807531	1837660	1050235	1050774	1045379	1016171	985004	979790	817326	822673	821031	758832	685268	636822	719104	788425	926602	792790	998374	884192	1042739	992148	370430	586230	468190	1543738	1515045	739103	947227	834876	739788	832089	1255593	1161103	1173683	1443016	872644	840928	759068	3907958	2706965	4999074	3893120	6622848	3874344	6766562	4545087	2944916	1590206	2045198	2315877	1700849	2167645	22862048	20563708	23801874	21664846	30905176	36000848	43310956	27653486	36908944	34357200	39697740	48597432	43591708	44966124	23527696	31949582	23090102	19578220	32137456	20217360	27534410	22315536	33302040	36257432	37752244	36477512	38267988	48182372	48796012	39258332	37306228	26153270	3097582	4451598	6918794	5620784	6741828	7503046	10898449	5880534	7334118	3907796	5837332	7057627	6147712	7400044	8573943	7773349	13608678	12243462	11393567	9934320	14448190	12448406	10633038	10253861	9002770	9897435	9297966	9759326	8049170	10423508	8844318	10625588	3843711	4013034	3665036	4116395	8685903	9411254	7336645	7610946	7949048	7478869	5863388	8178242	10017842	8761392	3453376	3408576	3797565	4008848	7539578	6919118	6642851	8327256	7270654	5002892	6051784	7308536	8781504	8517839	921415	669642	954943	1059956	1205900	1011739	504351	667524	1027283	866708	907403	980126	1292011	845883	2063248	1891541	1902296	1967076	1945816	1971621	1752820	1825374	1953008	2215951	1854282	1627412	1769203	1563426
CIS-CAFFEIC ACID																																																																																																															2333	3113	2925	4167	1777	1226	1269	14198	11816	13998	127366	124685	99003	86778	33495	32868	14866	30247	29250	25563	22395	20840	24088	20014																																																															24242	20486	27976	24398	25871	19565	20820	20379	11091	21528	22073	22073	18657	20157	19338	9535																													4546	2322	12094	11090	14269	19896	8774	6754	16778	7079	8616	10073	9182	11483														
CITRIC ACID	109	111	0	197	211	118	228	419	920	664	799	1804	690	570	756	863	619	502	832	673	901	625	755	477	15729	383	815	1596	0	224	373	0	1827	1948	1448	2812	2836	83	15551	46770	12968	16176	8142	3153	69581	26611	28165	11006	15596	85546	65973	14644	10205	21575	19153	19424	7901	14950	13416	12342	24349	29900	18044	8624	12523	29611	22355	21240	17137	27859	20278																											16077	23994	16910	23845	28870	28093	26744	32666	21623	19279	14404	19044	15229	1797	16369	147086	145806	24980	1999	18880	20570	23222	11901	108	5144	29013	158294	406054	931002	84712	74629	66454	70828	60157	84870	68835	78275																																															64054	302309	52538	329407	36283	93994	53614	395556	23403	422118	974261	13263	15340	2663	14587	11924	38830	37569	43563	55832	27000	53567	40104	47257	62100	89816	44382	43816	35385	30722	58085	55059																													53606	89393	133214	85303	35008	16966	103404	28574	122926	107745	325827	220656	240595	458182	21464	29632	27658	19856	11494	19032	21263	18077	17078	26863	25824	28066	28386	22926
CITRULLINE	20249	16388	13515	97177	96464	261902	355021	140957	19952	22548	21112	19081	18830	19332	24303	28782	27148	159603	201901	299226	314491	221925	233334	323335	156576	113736	222818	369068	229907	298826	476555	129044	267371	310877	580509																	31086	25350	26848	36665	25594	33688	18425	25482	29364	36597	34006	29191	21310	30854	28911	27619	34692	21805	27325	19750	63781	78862	39150	80250	27933	40710	21929	27238	25491	5882	5518	3655	6336	91311	88036	93576	96956	23570	26338	30750	12773	10131	17790	50987	25828	15334	42192	49110	43909	62784	49138	45997	42605	51643	41826	39941	36051	37985	33129	12948	17632	7722	9467	13485	7751	10504	17122	2126	13149	6337	5615	10533	6163	6861	4523	5281	68756	57096	74421	58217	59061	45778	37331	81672	76901	88418	88491	57357	84636	34909	73109	1525626	1367012	1775549	1190746	2158797	1636383	192831	367989	246108	342022	315482	347521	428961	300550	353486	607223	320886	206388	229572	214831	292856	219241	174300	325827	222670	323609	249006	339565	364092	313946	516546	458796	340846	200312	243284	161957	218879	142846																	383432	392546	367878	424120	282755	362054	329447	332845	331346	497670	352877	205477	280082	244060	258969	315378	80474	71778	53075	57975	81402	75308	60803	70672	75480	72119	38205	51639	50662	60489	54253	52255	53966	60203	66860	58674	59826	75458	61091	41366	53947	55169	56236	59191															59251	63084	58496	51230	42715	47503	69312	53636	47303	56390	64241	63117	53730	59747
COPROPORPHYRIN III																																																																								2876	5140	6004	3093	11433	17168	10424	8883	8406	15513	28620	13399	14473	14355	13128	18331	13175	27417	33569	27516	32579	30385	28970	28614	29555	28614																																																																																																																				5579	4903	4913	6032	7399	6915	9036	7661	9900	14954	12974	11992	14895	11450	6399	6895	5966	6867	8455	7905	10225	8567	7765	8641	12150	13011	15429	14188																												
CORTICOSTERONE, REICHSTEIN'S SUBSTANCE S																																																				22862	8527	4734	13540	7681	6915	13607	4980	3260	10136	12080	7337	2779	12765	5981	27037	8786	4979	7483	12575																											36601	74974	60451	32004	54495	65851	70676	48842	39510	26654	46565	58211	32169																																																																																							46356	48308	24782	126003	66695	95336	91221	105385	61224	86055	130538	39322	40478	39788	62462	77733																																											31568	32208	35782	35063	8449	14093	12226	12278	12916	25142	21991	26506	28529	21492
COTININE																																																																																																																																																																																																					464964	761010	557216	915140	1206377	546060	680499	510918	293988	313864	862638	716468	449892	614839	633545	613722																																																								
CREATINE	425260	359964	239176	348079	336046	635711	1305917	408172	230761	223569	206551	220618	191144	202681	110642	173536	158774	342683	339741	425205	291116	262789	285330	176611	210276	237722	291654	1066687	255391	209270	567734	128646	201320	577683	1326694	427346	674393	635284	770103	620847	829706	559712	756514	1068856	1283865	1060305	856756	1523717	1268231	896276	1361558	259352	192217	211695	250968	228198	217638	207777	224255	220363	223469	285712	250340	210956	223807	287550	249609	325575	188946	307129	224910	1123276	1503634	1295764	878586	678144	1117833	1300030	931183	882137	655982	653186	608573	824727	2279080	1085767	754887	673208	1100419	1165076	1392835	1094324	1197163	587929	961383	903890	1003711	281217	318533	353548	332910	412434	386220	411722	407435	345917	324254	355365	283388	322687	1056926	1127939	2044888	1293457	1204556	1359468	1470845	695910	1166030	290728	1945147	1915701	1392817	2446842	999361	2997569	1272061	534287	473528	489528	494118	595286	466105	406757	1889830	1033367	705119	671014	848260	1462641	1179662	858427	1004525	229062	373077	369236	255821	269047	1768391	1957888	1713576	1762813	2074126	1537742	1419040	2209246	1209389	1619010	1497566	4318330	2791054	2518614	4324518	4229114	2132718	2195156	5296848	3152585	2478885	2580347	2117871	1744358	1569838	1653846	2060459	3307276	3329131	2623875	5057751	2081376	7026762	7280263	4289037	6133063	15540428	17801702	16315418	8103316	10405539	6306826	11757263	8017553	15302528	13722899	13751819	8302654	4089464	4567982	3638012	4546664	3527605	5473804	3722137	4071711	5600846	3757895	4535150	3192940	3191658	2711941	3128700	2875922	300844	493592	379767	335829	283002	276151	374343	299776	310271	414432	606687	509506	464030	519072	449266	529167	518327	471286	380739	236749	348458	599272	424354	439331	796036	778702	924553	622152	484293	313538	707140	621546	380116	566865	872101	1066920	1616051	323187	1850309	603306	708557	1203370	394144	407658	355638	297718	362408	470436	385022	432212	396450	460218	580261	333875	348364	355069
CREATINE PHOSPHATE																																																																																																																																																																																					24463	22843	31483	27492	55738	85870	28322	27499	31884	34231	31280	47202	52588	56090	29707	53833																																																																								
CREATININE	1043671	726772	425172	1182004	1192182	1707322	2721830	2073886	992220	875463	798913	866371	716948	696423	693429	900467	883646	885269	986750	943880	1341687	1160195	1406399	1181234	1167788	1140507	1326661	1603301	1500960	1664682	1576437	1377408	2088095	2130840	1555747	3230626	3243494	2359176	2862462	3177934	3262025	3411137	2800003	2759073	1704428	3319950	2799021	3617510	4151497	3553269	4666392	24141	17444	16082	23122	18969	25152	15763	16395	14295	22383	21154	15090	13396	15837	16747	21448	17463	13503	15620	13955	5286696	5929823	4862582	5701614	7016638	6472572	6210196	7238769	7111369	9024576	9039100	8034972	9186539	3879248	4519656	4048885	4731052	4590305	4803998	5347905	5224980	5870629	7494484	8125474	7506316	6978872	22286	20855	17925	23974	14600	22621	13365	20451	12733	17546	18221	14406	13233	4634438	4874606	4458300	6507590	5544566	5135622	5079424	4561924	4759044	4261867	8217678	8180696	8894822	7686829	4530032	5255432	4746630	52692	53746	57340	53407	42306	45476	38629	2855935	3179262	2969804	3501111	3630490	4555916	3648154	4080481	75452	70878	71789	141264	114749	128829	13900718	13077554	14065811	16167030	18259950	17181434	16714062	18092558	14961600	18216740	13074148	19390884	15892432	16223587	17771186	11587158	11405742	12251532	10728710	11602155	15138915	15873975	16682851	12462308	18117718	18782778	12561378	14257811	12127898	11611154	12756777	10431948	3847023	5051168	7829076	6860722	9123822	9127394	10780257	8508776	8960879	8524589	9706638	9115904	8648888	8601998	11949847	9557957	259762	235828	191716	233610	263055	234386	269108	280989	300294	345745	255518	135135	126965	130621	182540	169192	2726601	2374530	2008570	2421904	2824146	2847326	2413254	2054549	2330976	3672681	2376552	2575834	2722648	2150728	2014089	1787302	1998164	2051837	2389232	2366138	2170979	2156330	1951222	2113010	2146497	2117000	2220805	1927323	1077608	1321296	1160664	1284718	1328845	1529838	1978500	2339200	1611395	1791923	1892648	1615960	1697066	1605679	37584	45704	42656	26627	19284	25850	36540	29588	26017	30449	40657	36408	37027	39794
CYSTATHIONINE																																				12322	19059	7381	6883	14055	25081	7562	20603	6980	7126	7613	7232	12220	13526	12035	9008																																																												8086	15365	16225	14962	21521	19592	16305	21836	24298	15293	23599	22825	29494	32726	45693	42695	35315																																																						65060	95199	106053	85828	64867	63347	68586	83864	98711	90489	52744	87408	61938	74796	53045	78469																																													18065	22854	19591	24602	35190	42542	34535	28009	33414	15020	28385	14502	18030	11834														
CYSTINE																																				15240	14157	13778	2982	18538	26082	4699	12799	3630	7206	14193	17966	20252	15103	18871	10761																					19972	7631	15119	12298	2650	3481	4055	2785	3992	7975	6595	4001	6157	31072	5237	11788	7851	7208	7272	4636	7747	7849	7412	9865	8970	8028														12059	24273	12634	7714	20430	9725	10830	15535	13431	9610	31329	30657	49651	26730	11307	12499	8506								50889	12066	18831	17421	36910	15116	31909	25920	5709	4884	5200	3014	1580	1000	34904	34850	23363	60357	32655	37773	36989	60971	61454	87250	59490	31101	20485	22705	27712	20193	14856	18624	29022	42517	23714	28922	43586	41155	47933	52282	51772	32517	33913	40296	33971	41971	54419	64237	106335	55912	154907	137290	150075	137929	84275	124492	68873	115907	68138	65691	72216	96483																	15753	12417	13431	13726	22893	20462	9872	9835	9088	4015	10476	5759	5373	7909	19318	14347	12159	9546	15704	11807	9551	15682	9321	6607	9204	6374	8351	8437	11500	8470	11359	14473	29946	28133	31809	15882	16491	8648	18783	7659	12167	5456														
CYTIDINE	41416	30123	14295	16542	22511	24993	32143	28390	43127	32820	29977	32243	24746	21715	23384	27281	34480	21620	23624	24152	18359	15157	12607	16959	15542	15017	23427	33081	16953	4190	22724	18324	27275	28273	30744																																					167048	108195	106150	127287	65676	98022	64770	75420	77725	42139	33096	36919	35695	90844	115615	110306	141417	74671	89245	87914	63859	91117	37822	40972	15730	52769																															9345	9403	7743	7287	8581	6155	5596	46611	42913	65922	73273	112922	41159	106384	113723	0	5738	0	27135	6164	0																																	58394	73067	28151	86216	59852	66339	32061	45361	14920	78381	69659	35288	11218	10586	20324	18814	40054	51753	40683	35500	38685	44033	42447	39953	45634	41087	40900	48001	40834	41173	42497	47842	75921	70678	55916	63726	48419	44050	52459	42969	50601	32894	18850	18797	21567	21162																																										
CYTIDINE 2',3'-CYCLIC MONOPHOSPHATE																																																																																																																																																																																					16135	15452	15795	16178	8720	12241	14942	16481	12106	9528	17091	11831	9888	3297	12186	10149																																																																								
CYTOSINE																																				15047	16971	14549	15831	17681	15862	16101	14363	18581	11190	19244	16733	21121	24067	17615	21540																					3233	4911	4236	4319	11255	15118	13334	12534	14221	12824	13665	12239	11366	792	5060	2768	4272	9007	9175	9232	9139	6635	11513	10505	8409	7789														16765	15075	11962	19764	18857	19140	18464	15132	15237	14193	32009	31059	29441	22174	37756	38151	45595								0	2718	2128	844	3898	5110	4020	5029	34384	17338	44951	63178	17648	51005	786792	523198	472827	492087	383814	366596	409571	386707	392595	430580	333320	22303	57154	20955	67958	22890	562078	499664	320009	388889	313608	339552	395744	350824	342940	367964	247293	13313	15339	16643	10092	117720	28010	29409	35595	38118	45797	41488	50580	43519	46442	53658	43842	37832	42328	50346	47545	47064	60319	74276	67251	60542	56754	73530	72390	76982	85347	83725	74445	79511	74052	76866	78390	71446																													9360	11331	11832	10484	8977	10225	16869	21172	14639	9343	14474	12954	13333	9959														
D15-OCTANOIC ACID	26114	29198	16632	31381	30231	31110	13377	32301	30812	14829	6668	25618	29506	38603	38735	7474	27485	36516	36769	37603	8949	28802	31389	21603	30647	26776	35301	30398	15666	29162	25588	14807	32742	25501	25628	32510	29082	28873	32245	38607	35800	42128	39354	29944	26393	37552	42244	36325	38903	28818	41225	55308	56516	66015	72433	47947	73214	63366	53753	48480	60669	71773	54488	54237	48393	77382	67565	65590	47162	67776	56788	5700	5793	7364	7847	8062	8331	9430	8689	9947	12307	11993	13105	12951	13517	14091	14353	15240	16324	15299	14663	15950	16278	15365	17926	15891	16543	57944	56023	56384	55489	62146	61470	69372	52197	48978	41752	49327	52446	51603	73382	68982	73833	71753	69813	76037	68806	66472	70444	67044																													96826	93875	93402	95591	90655	91093	87401	83666	84644	79638	93200	73764	81458	78636	75797	80326	87850	88228	91281	91208	88791	93942	82769	89172	90092	87126	93822	81686	81457	83644	78087	82813	133438	138890	141607	153122	150596	150719	212076	224904	222199	231864	244880	247259	255186	248016	256280	256975	176765	115465	185203	184108	127772	116807	85426	93624	68090	79988	82128	85642	90279	89307	101758	74477	25349	26744	28043	27179	26148	26354	25753	27371	24904	21090	24308	23638	26202	23432	22444	21126	21774	20955	22698	26179	27581	27371	26544	22152	21240	22331	21388	21937	25946	32264	38412	40186	50716	53698	60450	59736	61163	43439	41338	45871	46568	54058	29852	29567	27214	23919	22496	21862	25124	23292	21238	28771	26175	26847	26172	22203
D19-DECANOIC ACID	6218	6895	4188	6462	8653	7950	2691	7199	6565	3492	1544	6532	6535	9703	10002	1976	8243	9727	8618	10111	2511	8197	8028	5967	8344	7943	9279	7401	4554	7123	6747	3558	8405	6546	6815	16620	13780	12856	14621	22301	20977	21153	23427	12699	13131	17671	26323	17404	21627	15736	23373	29875	29854	33143	26134	23112	35364	20375	17737	14936	14219	22771	12857	14304	14675	25484	20789	13598	13488	20887	13777	7596	7920	10195	9485	11717	12464	12735	11147	14937	15022	16375	16403	15431	15391	20773	19640	18439	18104	17352	19435	21122	22103	21880	20149	22901	20824	24915	23156	24886	23241	23873	14862	15324	12452	9519	8080	9752	9102	10160	31028	30304	29477	30004	30867	29643	30074	28965	27515	30104																													70041	65980	67892	64321	65730	71096	66083	61098	51896	53943	68509	49286	56801	58552	54359	54379	67339	66788	67764	71767	71607	75244	58874	61172	61557	68460	78891	67439	66928	65471	65061	66262	38464	37962	45363	44649	47292	46422	78260	83416	87594	102917	131091	140836	150929	149194	152209	147575	43883	42129	48738	46927	41347	36623	28623	26515	25866	27399	25003	25516	29968	29300	31227	26232	13335	15662	17467	13417	13999	14359	12922	13778	9007	12369	14494	11342	13639	12809	7412	7408	7354	7786	9960	10732	12567	13928	13621	7739	7664	8030	9119	9812	9900	11332	13417	12017	23136	25691	31808	36795	36162	14788	14525	18297	19921	21553	8201	11104	9499	9648	7140	6858	7012	7866	6280	9353	9485	10717	10471	8431
D27-TETRADECANOIC ACID	4203	3057	2939	6559	5482	3736	1724	4714	5811	3576	1370	5374	6055	6630	9506	1987	5284	10269	6911	8825	2393	7700	9000	4040	7765	7087	4667	8115	4032	7462	7260	3720	7570	6134	4437																	22912	21136	21528	21560	17237	25797	13517	10927	11015	11506	12738	10939	9618	9423	13404	10527	11092	9449	12254	8696	11117	13151	12505	14214	14165	13778	16399	15083	16737	18586	18117	18141	17603	20940	20959	20631	26793	23652	20654	23269	24950	23663	24020	22255	22759	24048	14781	14730	15052	10483	9393	9024	8207	7960	6390	5348	5392	6644	6237	20438	18744	19230	17893	18641	18213	16985	16008	18614	18351																																																																																													25785	29222	26513	27199	26305	29832	24684	29679	20476	26433	24005	27127	24195	16788	5483	4113	4276	5465	11754	16169	23602	23099	25864	7079	8201	10771	10740	12123	6461	8481	10175	10009	15600	22349	26769	30661	34129	8831	13882	14710	15384	18019	19441	18688	17489	18034	5770	5573	5350	5502	4900	20074	13687	13742	11675	6082
DAMP	0	0	0	0	0	115	0	0	176	0	0	0	0	0	0	123	0	846	152	1079	116	124	512	249	623	4137	1677	7529	2565	2680	7551	218	0	3100	23104																																																																																																				15953	366	226	274	0	0	0	133	9123	6025	29331	7025	10949	82438																																																																																																																								
DECANOYLCARNITINE																																																																								24182	14954	20755	22924	17487	36545	22515	29488	28974	21540	17614	20816	25328	19932	16888	16110	17967	18069	19575	23891	16071	21076	13466	21907	21506	19957																																						15466	4949	8466	9607	28195	12038	14914	20923	1559	0	0	0	545	0	48891	55263	33719	63112	52217	46104	62250	64820	59818	61691	47326	118636	101434	79827	114337	89761																																	37076	39709	18748	32772	49784	44974	51859	39672	23761	27009	32417	32866	23724	23528	28872	24195	12636	17347	16911	15053	18103	18450	15329	14979	18320	34707	22733	17852	18983	17034	9005	11001	12461	11943	13369	10587	10546	14785	11416	12106	15511	14827	13915	14215															10152	11737	10638	10566	15664	10946	7553	7852	11703	15174	13252	10389	9242	10120
DEOXYCARNITINE	11031	6935	4458	29640	30932	48699	61285	48071	11400	11102	9464	9282	8506	9860	8591	9689	7926	71765	59900	54598	45174	38091	50050	42114	46756	50603	32070	58837	38394	52035	61338	32393	49125	82263	97923	5122	6790	5686	4713	8000	6311	8208	7136	5726	6462	7923	8356	6700	16180	9330	10940	80094	108342	89601	157240	105927	78334	70762	106395	88306	99118	133942	119967	97224	89941	90514	129702	123717	83564	87239	91966	17105	20182	13008	27815	10101	11430	15260	14693	7744	11255	12755	12652	9359	28049	26897	23928	31403	17067	21621	23508	21374	21200	13775	19664	15025	20010	80815	76375	72474	83969	65346	91602	103568	91656	72250	70666	76681	72721	70178	5723	9348	13994	9228	8905	7008	7782	8617	6608	8401	15964	12750	18217	20052	13448	10436	14974	165991	162109	156944	146554	127494	138629	126878	17949	21950	16836	27605	13352	21349	12521	22782	201880	414846	654040	311094	354395	711895	68504	92465	60663	82887	135999	154327	132204	139433	144759	148508	119111	856295	1006753	832455	1356599	791652																																	585377	670135	614103	488241	498076	584695	662095	568863	557110	578766	561827	486091	523862	520753	498464	558698	22672	21857	16540	17617	22448	22004	19959	20014	22236	252895	179716	190348	169403	167196	22610	19991	20031	21494	29166	26701	33320	35088	36298	198720	257356	246235	177665	191652	6898	5469	6747	11125	13163	12256	11988	7197	7487	11607	7961	8867	7496	6896	146355	166860	176001	169880	147584	130313	167773	159121	150461	139354	137825	150482	174904	156839
DEOXYCYTIDINE	13370	9005	8274	7590	8914	18815	18633	14676	7120	3919	9615	4591	3693	4720	3636	7836	4799	5271	7581	7018	11799	9860	9522	13043	9319	9588	14849	16834	11182	11165	23240	12420	14258	16726	15638																																					67745	51933	60932	62512	47093	35449	37814	50671	48543	38248	35736	35352	37317	50753	42391	49872	49018	42269	49237	40082	40843	39257	33712	31377	27090	32965																																						57152	43071	54032	49051	80171	28468	61865	69856	66	0	0	0	0	0	215431	172739	190560	200787	220204	155303	207014	211611	165195	168704	147797	49218	127012	39239	145378	49386	194830	131300	153967	171863	150200	175040	157553	182357	147388	161436	148134	39090	32797	32816	35527	80104																																	56620	62431	42625	54272	53319	49321	47570	42907	48260	21654	33006	13002	15030	17730	43434	42289	47708	48066	36175	38120	36824	34083	40197	25596	38796	14862	13733	23129	14100	15517	19313	20320	26550	28143	20358	19537	16442	22734	19020	18811	15088	17717														
DEOXYURIDINE																																																																																																																																							7053	4686	4070	6477	4728	6853	7259	8035	26753	29513	32226	17212	55978	46788																																																																																																																								
DEXCHLORPHENIRAMINE																																																																																																																																																																																					16592	24140	33112	36384	53211	49813	74243	41590	43687	30901	44266	26086	53589	68956	68891	52171																																																																								
DI-N-OCTYL PHTHALATE-3,4,5,6-D4																																																				4046	1152878	636422	195675	1865321	614431	20099	117048	59632	35270	47336	176698	38184	53679	43423	27725	31662	73834	33008	22635	3655	22395	25430	50391	42893	17157	30205	11983	32373	36562	25304	23700	25697	1828	19529	23596	24362	8592	9603	11940	17637	13396	23187	9200	20963	27182	877653	980884	429247	1092150	1131541	96142	91482	84771	23670	37216	37563	31133	21012	43338	38988	33211	34155	23212	21790	21919	24517	17148	27760																																																																																																																																																				
DOPAMINE																																																																																																																																							80778	93999	93321	87300	91236	91710	89972	93412	46645	32594	43525	41609	46427	49079																																																																																																																								
ELAIDIC ACID, OLEIC ACID, PETROSELINIC ACID	13908	6203	8725	13654	19164	179478	218203	71210	13080	26668	19549	25144	7015	20025	8286	22567	5356	12354	7609	11995	28254	11418	19124	9774	12981	11023	125082	475453	128088	103297	163207	76021	116253	184208	346088																	35277	35622	40269	16556	33504	18521	13099	16831	10135	9678	5484	10287	9568	10376	10405	9853	6520	7610	7202	11195	102442	24260	91432	22412	112183	88346	98628	78647	89397	1023771	1384283	921061	2109115	72610	84702	109490	88358	90357	79149	86739	103232	67061	1791757	1976772	2135203	1305066	41634	34241	33736	40152	33871	12507	12309	9351	7551	7511	9467	9735	11243											95086	122876	131881	108307	117336	178351	178362	88365	76841	56532	65341	98919	77451	68946	24985	76	118	640	4283	2178	31419	44181	4105384	8228730	7311722	3049393	11359823	6083970																	126265	264482	192821	244817	159515	51310	83292	104139	270801	168226	201019	92821	115368	115278	124694	250895																																																																											28916	30536	30886	34928	12169	14116	12264	12396	14719	26167	32387	22120	31903	22799
EPINEPHRINE, NORMETANEPHRINE																																																																																																																																							343	5244	0	0	0	12577	0	0	67759	42495	48693	96456	99297	118627																																																																																																																								
ERYTHRITOL, THREITOL																																				1858	7432	5083	4187	1581	4655	4542	1142	6408	1881	2389	3757	7733	2530	3033	7305																					3248	1731	6329	6051	40740	40972	25538	43773	34145	11749	12118	9897	13427	4040	4816	5387	6256	22769	18833	23038	31528	23920	8294	10671	11636	8415														3063	3004	5663	8160	4509	8635	6615	3108	10951	2107	14930	14486	20654	16550	55832	106564	47582								0	938	0	272	12	1621	807	587	35018	48760	42986	55934	123236	88967																																																																	8127	7795	7848	7959	17192	17390	8790	11640	13653	27171	13380	16323	16875	12695	300	916	605	2801	38	2074	1321	488	1337	8018	7215	10645	9797	9552	28812	33547	47272	42171	44516	48254	49431	57189	57656	40904	52976	43760	45203	57936														
ESTRIOL																																																																																																																																																					4667	6918	10155	2958	16114	19471	21144	30223	32704	44171	59795	20343	29301	20719	8694	15616																																																																																																								
ETHOSUXIMIDE																																																																																																																																																																																																					25530	28899	29672	29160	26733	20554	28972	27731	18699	32121	31863	29087	25777	28358	24503	17919																																																								
FERULIC ACID	3337	3257	3262	12354	7894	15617	19105	17909	7226	7615	6554	6766	6652	6588	6502	8954	7430	18284	21244	18113	18719	21263	27605	11531	17253	14283	17146	18221	18859	21502	15742	12288	25443	20400	16888	10197	9124	17100	24216	18722	21464	22614	17610	31518	7309	23452	23311	22116	25186	17125	21333																					4089	4061	5441	6323	5963	12535	9858	11123	7573	5424	5069	5214	5814	10069	6857	9854	7084	16265	16343	13993	13397	16585	6603	10227	6757	10759														11748	4775	12139	17757	11462	11849	19169	10562	12612	6494	103407	112564	85275	84937	127902	99973	108947	44385	25709	38174	30897	31041	40696	31433	28783	27727	34037	28835	19692	22715	28187	20437	60458	86583	80617	136488	52897	70057																	20089	14122	13505	15384	20982	22955	25212	14964	19453	17370	13891	23981	24111	20673	23790	17815																																																													4290	2803	9612	10584	19112	23205	15039	7153	17246	7232	11014	7781	8790	10864														
FRUCTOSE, GULOSE, MANNOSE, MYO-INOSITOL, SORBOSE	8834	12727	10676	10458	10571	11836	8899	10530	5164	8349	8276	6871	9541	7178	6751	7019	5498	8199	6495	5216	5499	7148	5148	6430	7194	9823	7913	5016	8462	7299	8361	8056	6830	4316	5457																																					45602	28907	43562	42612	25910	23676	20911	19678	24655	32363	34240	44245	36015	22158	27661	19533	18072	10276	6272	10994	10120	8061	25414	25088	24405	17547																																						25743	37334	33271	29289	55939	48270	47520	52075	11876	7833	8746	13735	10024	12214	104709	67472	57291	98395	64340	50776	61576	55385	39679	30253	38999	119561	48856	35312	44072	37160	55949	25281	25703	29309	42366	24114	29224	19013	21254	18069	55371	24960	15726	14494	20702	8737																																	11114	20586	16321	14346	5599	15319	6002	13132	11879	14270	11589	18536	19771	16872																																										
FUMARIC ACID	0	104	0	2070	2654	2770	3723	2073	0	106	0	0	0	0	0	0	0	3232	4040	4559	3946	3631	3888	3474	3160	2337	3421	6434	2200	3716	4362	2331	5016	6115	12609																																																																																																																		4707	1515	769	2222	3892	4646	5105	6010	3774	4778	1376	38605	44023	37541	32761	22178																																																																																																								
GALACTITOL, MANNITOL	32586	39206	36418	23197	17739	24117	18339	16971	26854	32973	34749	30055	33458	26512	29298	30714	25294	19584	18200	15763	20738	19204	15165	14750	15587	22097	22064	19122	21196	16896	19270	18636	16816	16115	12794																																					160408	131060	139179	173172	289386	215189	191385	235337	270954	104590	89392	83256	82203	70185	89034	87464	82703	114069	89399	102077	109755	109370	44850	42740	38869	43586																																						72820	101188	93729	88125	140142	129870	122538	148042	9511	8098	7349	5317	10989	12433	382043	306252	318116	331251	45293	23668	15584	46687	51872	31923	43454	34682	35538	28198	43143	63159	263343	261210	248667	251154	54764	50832	47677	19012	38214	43098	19486	44594	41047	41889	53704	31956	38584	29707	69811	28501	21932	22956	30772	28503	25434	24440	21554	27389	31477	27187	34700	38025																	38898	44262	35196	39529	729	1433	581	886	1075	13989	9062	11193	11207	9206	29548	32052	33546	29600	1441	887	4368	1181	1445	7957	7389	9681	7359	7014																												
GALACTOSAMINE, GLUCOSAMINE, MANNOSAMINE	22875	24442	17159	15980	11643	24301	19419	17159	20041	18200	24505	16830	22393	20200	23406	20663	16731	10476	11165	12148	19658	12036	9968	10804	10797	12854	12551	9284	12784	10997	20597	18305	23831	11966	8655	6150	9244	6088	5163	7054	9515	6565	7365	5263	7115	5364	5250	7224	10373	6657	7255																					130352	164425	85440	131492	70139	42992	43229	80028	60756	70400	65158	80407	53416	80997	76948	79573	55231	30423	20682	26108	28867	23472	47157	48305	50423	50392														7993	12745	9000	17434	13790	10717	11580	8433	8156	7789	22247	22728	18979	21667	11491	8672	10866								48435	75794	80203	89995	150184	140990	118796	130321	37889	32584	22390	69942	64423	94176	698813	482943	253866	786462	18945	131842	146581	32472	122218	158619	115591	496902	295939	317758	336536	237353	422495	454124	399199	406303	109784	84773	107813	88660	133450	116645	139177	188615	217433	182344	185453	158995																																	195817	193632	119757	140607	38205	41739	27078	24589	37122	128749	47222	82856	72994	63308	104072	117074	93498	113476	32408	35145	24573	39471	32311	40627	46003	44065	39080	47690	13402	16974	15337	18229	18041	19607	17995	26037	20965	22332	16237	18365	17570	13797														
GALLIC ACID	4789	3380	2882	1345	1643	2043	1850	2438	5955	5456	4332	6152	6730	6144	8806	5425	4437	2527	2285	3052	2206	2483	2379	2062	2539	2129	1772	1279	2178	2512	900	1955	4064	2288	1240																																																																																																				5684	11610	11214	7941	2714	3457	4385	3828	11246	9522	12384	7874	13107	13920																																																																																																																								
GAMMA-CAPROLACTONE																																																																																																																									7365	7400	7650	8660	10418	10019	10976	21841	20706	20563	14953	14172	16374	13133																																																															41341	24142	31586	28426	28355	22210	26048	22224	10392	24389	29180	24016	24803	21955	20616	10389																																																								
GLUCONO-1,5-LACTONE, GULONIC ACID GAMMA-LACTONE	8700	11963	13198	9961	8028	5710	5751	8790	7854	11419	12648	10437	11518	10882	10869	11661	8874	5162	3556	3846	9952	8258	6504	6936	6235	6960	7013	8288	7706	5804	7375	6706	7145	8264	2759																																					35885	31514	32382	31395	39468	34340	39316	38715	38292	32338	35681	34766	24265	27949	30875	31993	30320	52280	38285	38592	56336	45281	35855	32820	34293	31903																																						25293	36269	33120	31693	36854	34315	36275	36774	3690	1981	3149	4195	1425	2129	78555	79356	70421	91275	69926	67225	70704	65188	60746	71283	57987	40497	86459	83623	93915	81128	62432	64710	61769	60598	68031	55056	58552	51514	53732	58201	61269	49124	54129	50642	54515	41044	17930	20170	22829	16610	19846	20804	20210	13710	26254	22312	18184	31329	25874	36372	30709	26309																																																																								
GLUCOSAMINE 6-PHOSPHATE																																																																																																																																																					32692	31450	21448	25679	4621	13658	23018	21225	18178	6974	6024	5322	558	444	5986	11792																																																																																																								
GLUCOSAMINIC ACID																																																																																																																																																																																					7077	9091	7338	7023	7309	7157	6765	7367	8939	9732	7761	9299	8611	10281	7208	11496																																																																								
GLUCOSE-1,2,3,4,5,6,6-D7	9989	14664	20952	9760	11015	6533	5081	6731	7452	17101	11017	12938	13670	13732	16582	14007	12037	19181	15410	14879	13347	23070	11875	10756	22766	14053	13352	7511	15716	13146	7678	11864	9408	7503	2988	5727	6380	2795	5221	6612	5674	7831	9493	3575	28280	3678	5036	3316	3558	8054	3180	7528	8232	9597	11853	8868	14752	8707	9701	7675	10475	12242	8021	9566	8181	9209	10819	10455	7954	8738	9697	44571	37154	48378	39181	36510	32831	30922	34388	45377	34993	31943	45593	29836	37396	57576	52382	42250	55877	54021	43774	53754	64878	45837	47062	59738	42365																								3752	3037	5627	7010	15101	6837	13548	23713	22342	23348	27357	25763	25918	26695	29080	43916	43182	31069	30739	26995	30946	20532	37312	39072	34864	28668	23921	18506	18714	25476	44391	25180	45744	36075	37373	35739	29106	18000	46738	36243	58057	67440	60261	112912	42809	23551	41611	24523	40834	35005	57062	53480	60276	24222	39823	97168	112805	128036	94566	22404	72152	37919	16259	27897	16494	20737	11243	15450	10919	15560	11871	14254	17239	6567	8814	10670	50322	49080	44570	48547	44209	43635	38247	39077	37072	36187	43608	45667	41682	45913	46696	44575	4028	15147	18158	17185	9328	15765	17803	17127	12053	19032	39784	30589	31571	30825	14004	17833	14211	12121	14783	14410	14201	11738	13816	44625	35393	33521	33935	27653	13735	21894	7208	8170	6655	4281	12797	8928	5931	8531	4189	10466	10976	10572	15937	19544	12019	17589	13333	11346	16502	18631	17178	14095	17336	12999	16988	11183
GLUTAMIC ACID, N-METHYL-ASPARTIC ACID	868110	951519	579921	2018241	1787487	2921186	2773127	3137493	850151	830948	784131	1070336	913321	884932	906246	1018473	1169693	2114852	2026105	2010624	1802435	1720689	1659639	1786654	1872527	1987513	1856078	2299718	2176128	1955096	2494405	1687767	2015192	2298898	2723835																	14804	15821	12836	24679	22805	14196	9692	24909	18087	15393	14176	22821	14849	18019	17783	18517	19660	10862	21390	18615	2075166	1745921	1697375	1786128	4166168	4455724	4731219	3650354	3020532	4451819	3664141	3024220	4101235	2708815	1328310	1635983	2004698	4347710	3633388	4213514	4394284	3667772	4164240	4566386	4144108	3741970																																						2930112	1597705	1746762	2092692	2467888	2141949	2151098	2275169	6668236	6521672	6884148	5317911	9843154	10054876	10830584	12611227	9850036	15553540	8744972	9469312	8250030	8945885	9413778	14400104	7253812	2088302	1595193	1523879	1687740	1574425	8668392	14228981	11290700	13488201	7832122	11944890	10168765	10795111	12605511	12927422	10158316	3305272	3657764	2069019	4076704	1339306																																	2157708	1892797	1346819	1447038	2243164	1917201	1661151	1752179	1700832	176490	187321	157469	149564	175123	1900208	1763034	1991668	1880300	1825232	2169570	2165382	2691638	2483372	158800	339156	212564	338352	564532																												
GLUTAMINE	809581	693583	477361	431300	469052	451712	397852	397736	926355	879528	805039	967450	793299	766131	915585	1105648	1231835	331258	377917	471512	389447	356040	315293	276354	305654	227460	345172	576051	312213	304498	357493	230222	376518	441722	691512	61520	74753	55100	78107	120109	123817	84576	118086	56064	227034	101734	101962	111919	154227	143573	115020	92586	87124	95432	83711	92872	82009	79620	85029	89637	75852	80228	89297	79107	96087	95587	83010	87544	88633	91522	93840	981759	1864548	889462	1682148	463775	808399	903284	652237	446061	950242	626789	616901	1142588	2627455	1677748	1633526	2600033	854105	990671	810413	825399	869286	722083	1076107	934703	884117	83932	83407	78337	106907	111343	88360	86152	86902	91954	105846	93572	97020	91206	49568	68008	70034	214887	165050	104097	148511	81017	86895	72094	111015	102493	136973	143848	189529	171589	150232	260134	237463	212373	255226	232554	210405	200058	2921840	1833503	1720505	2688402	1336675	2196412	1448686	2331186	823081	885846	886711	952210	511334	521063	7682521	14533803	11145838	14480697	9957490	10532128	10414680	10998099	13710822	16035817	13016028	1124545	963147	1243318	1262357	1103613	7488560	15111942	11242109	15957652	7672796	11027131	11251494	13736658	15472884	14643903	11755107	788362	928869	516644	867250	1263364	217356	365886	313660	360715	361649	380439	407500	414761	457057	510718	742145	431601	297539	402544	372719	247559	750924	696369	689546	861710	682363	752069	614479	660753	568939	517655	840322	644325	584162	578917	631011	608808	2963586	2029462	1833581	2161978	2747464	2447410	2310526	2014579	2488229	139137	217902	171550	137506	187338	2471217	2104230	2620206	2702090	2405993	2548298	2294230	2622930	2490852	151591	278713	176997	235310	362926	54618	62564	66827	91890	109470	143169	116379	84656	124765	72479	109744	86003	92773	88847	103056	96455	95328	86606	119885	123305	118870	113720	111608	121930	124075	113104	114352	118343
GLYCEROL 2-PHOSPHATE																																																																																																																									26961	23220	21513	18776	4514	6517	5634																																																						42434	48540	106040	110846	61902	67503	105492	87455	129571	94586	100234	71803	131355	94856	99608	117240																																																																								
GLYCYL-GLYCINE																																																																																																																																																																					2155331	3441430	2663994	3854148	2939542	3557848	3637194	3722669	4772356	4422142	4179464	309953	323474	26159	84398	376124																																																																																								
GUANIDINEACETIC ACID																																				508610	514489	430613	455370	431212	447083	507483	449235	385868	402337	371864	438458	473966	589802	327297	410245																																																												452352	490351	401679	724489	577274	565849	623916	478549	644770	506095	807128	796068	861706	725588	710843	692279	571673																																																						847858	1071839	1172541	897837	1170053	1019754	1219928	1110519	1235860	919871	929138	993614	1001094	1103956	1073909	851570																																													396877	344481	446101	473102	513190	572960	387980	438605	474950	532197	498213	508664	468810	401264														
GUANOSINE	251836	162297	60162	25298	34180	43435	70529	35822	226122	170964	159192	204601	149687	152504	108585	143853	147419	58419	72325	83595	84077	70587	62313	40064	47835	37706	65652	98486	61240	69381	45727	58545	86846	69107	76645	6655	5431	10135	8809	4883	4278	8690	4230	14523	1543	6306	6701	6144	6892	4085	5448																					792553	537247	679755	678127	56018	71256	57324	56063	48397	23855	28773	28015	28551	713153	498388	582330	611524	134309	200571	101282	105685	118283	41202	83107	59434	56762	0	0	27489	0	2707	0	20747	22474	231	35632	13479	25468	45128	5598	6596	8319	8332	5701	5649	7571	5391	8368	5628	13227	12354	13510	19691	11583	15651	10916	4612	11839	14051	11565	124566	71671	43934	264640	187818	195419	235064	355833	250990	325569	323366	19236	43449	26519	26153	36648	31992																																	13994	20411	34389	24269	11104	23205	42122	17160	29101	13597	27411	29547	36439	39068	37788	19725																	133078	143253	102619	114976	119602	118245	109241	126509	151239	1052	10208	2704	4705	5144	86984	87547	104310	104002	97276	84550	91496	123407	105588	1587	8700	11419	11203	12410																												
GUANOSINE 3',5'-CYCLIC MONOPHOSPHATE																																																																																																																																																																																					3276	6735	7424	6306	4562	6409	11295	5881	10003	10197	13943	9414	10323	7532	11435	7448																																																																								
HEPTADECANOIC ACID																																																				931	79901	68106	25210	18885	56244	4391	26049	27369	34524	5889	8914	20400	16000	24700	4669	4792	9798	3231	6334																											118606	155431	148264	100384	67068	60562	87581	47992	36789	32087	38846	33840	29543																																																																																																																																																														
HEXANOYLGLYCINE																																				847936	496059	775925	673231	851175	356886	668576	239197	1312263	249543	1156771	928982	1043807	1184547	555017	630422	23788	21369	32811	34035	34011	7699	43845	21980	41996	32105	42379	17327	11013	27628	25218	41199	39458	32780	28593	54969																											54239	30619	61001	33506	32363	20137	40728	31127	24575	13087	22527	26694	14979	1196128	1347982	2847632	1648556	801869	1006197	1649350	787068	1223548	1150406	4932512	4998048	5505332	8600729	3011676	2621525	2739265	88580	93174	94576	131928	78432	44508	52169																																															888956	1391492	4012476	2250508	1942689	2616694	4321851	3018592	4849880	2135247	3432376	2049836	2866404	3557043	5920231	5066160	86930	99069	75001	85715	95201	86572	119021	113104	154089	127679	89820	69363	77860	75397	85541	88942																													324489	281121	488619	831319	1754598	1894927	620486	339635	763628	678607	631098	603462	547603	432460	19390	26817	24331	32344	35845	24577	22563	17581	29804	26284	22701	23472	19672	21762
HIPPURIC ACID																																				151071	145311	259005	6309750	4080446	4706286	5902755	3561118	5133955	67951	338681	265949	318184	247902	181226	271590	6443	53074	89523	3324	4106	38710	76466	3056	9095	2748	6132	4506	1227	5485	62945	2353	5817	46545	69604	2764	1333	1555	589	2546	1535	1913	2720	1969	2722	6145	8609	7282	15114	2342	912	984	509	1805	2539	3619	1920	2708	6854	9360	9054	17010	4786	3354	5982	5583	2869	8017	4120	7003	2070	89436	92460	114560	86565	225961	179051	155690	283149	205580	228640	215048	6173894	7922291	6313615	841737	834589	662203	483868	8376368	7159316	7704054	28041	33017	38726	39545	316232	158472	202337																																															465047	410838	606953	461899	925868	951552	1222577	813952	713611	656670	988284	776934	1031900	1047679	1096334	877955	49783	21608	37919	24117	22531	19126	21036	28743	27469	32217	34401	12450	13291	15648	15541	15024																													76290	65370	144586	130870	110731	113461	90135	90805	134601	74028	129305	109689	100895	143160														
HISTIDINE	89329	79422	56827	75507	50849	109464	70111	60185	96098	71570	68608	86862	70243	66924	81060	98707	120142	41294	43721	47476	57659	50895	45807	50592	52199	45170	54377	79107	50514	57066	68154	43942	61488	62581	105977																																					116489	268383	99477	139555	75617	101448	109849	165468	89964	134133	116195	94012	138620	310405	199734	155576	226514	89032	115145	95905	86792	96745	124979	167467	158012	135689														9543	12864	11887	16895	16299	9589	12124	10553	9409	10079	19466	19752	17258	21047	15488	13775	17784	16760	17107	15807	16400	17989	13978	13489	257734	119664	185576	360596	220819	183100	218105	171264	64168	50068	60449	120226	48621	62110	791573	1387475	986257	1209072	1338392	1370310	1603259	1436761	1817975	2838296	1441313	1608589	2934926	1438866	1844124	868018	943784	2144275	1502907	2024823	1021586	1877635	1683468	2416412	3161010	2333750	2086029	1103045	967721	699770	957539	677391																	41798	20572	32507	37308	45824	34208	34517	33380	31441	15206	35409	46517	35140	32971	17169	35694	546321	367116	313582	382138	711644	575785	523132	419453	565943	390272	287145	312641	379913	376655	499265	417782	539977	560780	581831	684944	586532	652674	630678	393368	406311	453088	500650	545675																												
HOMOCITRULLINE	11398	11396	8620	18137	17054	20466	12014	18381	14173	16281	12387	14730	12849	15118	13774	12384	13418	14899	17559	15304	14558	14495	13150	11327	12190	14009	15622	22681	13745	14206	14149	12739	19036	21494	30102																	9812	8168	9561	8432	10709	11689	7913	7842	7980	9197	11449	9666	9167	7598	11312	9819	10870	6331	13057	9050	54564	57627	53807	54964	75152	49490	53488	78863	56763	46333	58687	46568	51398	59643	51732	57852	53236	54427	56150	55453	51801	58670	48273	56548	43794	55540														13385	20331	8997	12112	14062	9287	10713	18738	2828	13687								8425	7043	6321	6384	17218	13286	18006	23664	34012	35938	31947	43717	16551	19050	40115	8748	7501	9979	9416	13276	14729	166878	167607	154305	189996	208995	186497	168974	189104	181078	197419	180852	198991	203700	92347	260643	213909	134067	173784	142573	173353	60780	195899	190191	165927	164871	196997	178169	80502	153924	66607	75101	70680	134556	208020	286642	176507	299026	303627	357511	223218	280429	222607	260214	274948	191509	354971	305673	360069	45480	44206	39308	44463	38989	31114	35328	33895	31924	48709	39400	31802	32393	31365	39240	44344	18749	14067	34248	17736	40692	13859	38044	37816	41533	68659	49233	55121	47763	40947	37505	31144	38271	26726	40918	41702	34269	40648	37825	44595	53574	51761	44332	46964	26083	26902	40708	42039	46846	53985	30538	30119	36979	35222	33908	35490	32581	34810														
HOMOCYSTEINE																																																																																																																																																																																					226240	193827	220583	237986	169348	188817	259110	228202	153327	100290	172713	149602	93308	89968	203753	165054	113437	109247	103987	117437	116393	110565	114599	115159	76967	139039	121170	79562	82056	76879	80509	83114																																											20077	21724	22168	15474	15321	21294	20595	18238	17047	21435	26574	19598	18892	20124
HOMOVANILLIC ACID																																				21548	22804	29061	36459	23111	31082	33358	38039	37998	20038	33866	30503	33174	42208	29542	37848	215298	95418	273903	366039	166224	35837	62060	185490	180702	283795	228648	229306	106435	177808	266457	247992	334087	191496	118329	229755																											131702	118317	85407	125740	120904	118063	113578	107659	46814	96167	66046	102197	125884	19410	16440	13374	20313	15032	16130	18131	13501	16687	13446	122900	124307	86786	80517	211996	123761	176222	858569	807713	831456	682038	442535	459697	436219																																																															549921	500462	635676	549792	573275	425316	479390	487783	148078	563050	540330	484665	418262	417962	434668	168047																													7261	7058	23133	17367	19788	23712	17940	12904	19743	12977	18373	15323	15332	20777	172380	165033	185113	206164	161626	177485	199928	148449	151994	166786	203245	154874	188013	145601
HYDROQUINONE																																																				59502	25637	74450	81948	42143	12074	17390	47287	47665	67477	53153	57420	28840	43806	69391	62324	80204	48133	31047	61525																											68339	58245	42190	66487	61811	61138	56819	52115	25281	58085	35173	49904	60428											10308	11846	8472	6282	17106	20874	12361	82911	74363	74180	56193	58555	67604	53435																																																															57095	57941	60419	58206	46992	38248	49309	41363	55039	65717	62820	49485	44530	42992	46369	51354																																																								
HYDROXYPHENYLLACTIC ACID	1419	681	644	10497	4318	2904	2505	1891	683	694	827	566	839	381	1141	987	1830	2275	2507	2175	9266	6314	7805	4065	3668	3444	1536	2368	2248	1616	1874	1989	2102	2353	2757	23040	17803	32243	24099	19815	18823	24403	16851	27066	7022	27094	23800	26220	28045	18968	24740																																																																																				5012	6491	6329	6222	6614	7113	6098	6567	8041	6364	7332	56522	4622	3472																																																																																																																								
HYPOTAURINE																																				6251	5266	3809	2479	3829	5770	2946	7714	6545	29110	5461	4386	4563	7779	8476	6486																																																																						12392	11051	20607	45493	59635	30814	38756																																																																																																																																													
HYPOXANTHINE	115807	57465	31990	81227	87705	171360	527166	117523	99823	61522	84333	70365	65318	70403	56059	64402	75814	165826	199761	192094	78253	41288	117496	128815	109008	120721	135699	556336	146607	171965	366673	89384	184158	390457	1199489																	0	87064	30569	57619	14395	1733	17307	0	95	262	1668	22606	33	19159	9109	76843	18039	2750	68041	188	233000	125937	145091	91273	69961	91691	34873	58807	47827	285980	365242	436876	254034	580424	130810	157008	172548	111820	259308	179693	127355	161757	356307	480956	399523	378926	0	0	12474	100	106437	0	82596	78731	192	90720	303451	44335	23593	23543	27048	25717	15533	15169	9455	27431	31606	15505	8615	55411	47172	45836	38799	16840	27785	24486	118556	140498	139591	30555	817255	529971	372919	628911	101654	130982	139089	223723	137773	169392	136034	6551297	9063088	11091929	1288587	8991984	10183008	197387	193821	109385	175378	135685	71961	126677	119340	155701	86656	110769	2014285	857672	828711	641390	279907																																																	43178	53092	43460	40242	35399	31215	36110	19068	32023	132228	88507	82432	89761	77376																																										
INDOLE-2,4,5,6,7-D5-3-ACETIC ACID	176687	612698	751937	389819	162709	463688	276737	454983	185701	593213	662223	534185	596974	435520	562921	707692	494606	502519	444584	223411	367741	368285	336781	179673	360454	400718	436380	312567	548975	381899	368237	245582	406079	184576	306998	292274	301428	408395	27328	44064	64407	274931	133434	462744	193517	626119	162183	245578	296147	437233	434196	660197	769448	935520	1122814	673166	1032468	794419	718069	678644	950051	1197504	777306	734852	639515	1156904	1123570	1025947	691017	1016016	794934	1187686	1279605	1182116	1234244	1433477	1069886	1230751	1167736	1274620	1149500	1051971	1120847	1087581	916650	1061489	1034464	1024271	1042800	960401	1006948	964459	956941	1087550	1001184	1029754	983175	964664	951179	995042	985646	990096	1153612	1245788	1009965	984732	579958	957095	820932	941108	832246	509519	623948	408640	485554	633439	620367	692969	611621	695528	2559405	2505808	3002750	2897344	2047028	1955263	2184996	2996901	3000456	2042562	2787816	1326661	1185308	2463944	1086095	1293333	1540316	1310210	1106020	1474736	872157	1395790	228196	492004	554518	581650	513044	320564	458766	442656	454040	463865	506291	503817	476848	493816	471122	432096	507437	436224	468391	446757	437005	473604	460410	466810	473648	455322	481353	503991	495397	507205	504541	515712	558726	473098	509539	493498	439509	506958	628792	635181	615111	620543	644189	646448	667481	634194	641659	610300	642798	630418	662621	640516	685116	634601	669722	660202	639710	620543	620904	617556	623931	602801	579649	622720	602364	666853	592132	593134	586555	580296	204554	190166	216877	202163	186791	205588	201742	210111	185967	155406	195389	191432	193902	174874	221314	219177	211654	214474	198065	202366	210178	206073	210709	212564	200342	189760	203284	187595	495453	499916	469480	463751	410500	379652	404180	405438	370730	464864	454329	451818	440756	449536	382614	361932	377613	379084	360502	347695	366988	368183	361918	391454	384557	387048	382672	368877
INDOLE-3-BUTYRIC ACID																																																																								6063	3061	7623	6873	4476	10594	5139	7393	6266	13388	15918	15616	14487	5788	2599	5794	6223	7150	8444	8125	7667	8083	12534	11971	11259	13521														1128	6548	7672	15047	17054	15626	18252	960	3811	6665																																																																																																																																																				
INDOLEACETIC ACID																																																				8010	5543	7251	12299	8282	6517	5028	8019	7302	9559	11045	8562	9090	7767	7979	10456	10388	5933	9371	8929																											7633	8332	9960	9547	9613	16128	14589	19077	11596	4448	9005	6908	8969	3517	3632	2927	3022	2540	3271	3678	1206	2653	1635	24093	23427	29412	21212	30733	53129	29626	62126	46177	12657	26348	13254	9926	15732	4984	6956	8719	4944	1031	3699	3661	4240	8469	3184	14658	32004	25980	11596																																																																																																																								
INDOLEACRYLIC ACID																																																				403	9969	14744	1945	358	5498	9897	730	795	1700	929	523	1371	210	18961	2231	787	10165	15423	1152																											104	390	844	1161	2285	2969	1378	3089	2026	28837	34364	37027	37471																																																																																																																																																														
INDOLELACTIC ACID																																				24463	26638	48821	40129	36685	30681	34356	22351	53953	25285	88335	67340	92499	93344	61188	88150	20634	12139	16073	25009	16392	8820	8274	16531	21806	19927	23422	19328	17421	16193	15679	19431	20934	9715	16859	20943																											35284	29775	30847	41016	26107	38762	33834	40526	25885	14226	20925	15700	14721	62973	67655	88925	111632	70112	73858	98024	35489	53385	37052	249886	250436	287020	331762	110189	109374	75227	100650	80683	75902	55127	75766	100344	50413	2165	1037	1315	2203	729	1922	1842	2231	6163	6792	4536	69080	5673	9488	1821	2946	4488	1803	3198	3407	2586	1685	3843	2075	1084	36234	25017	26445	28051	21982	2113	712	1609	1116	1732	1714	2895	630	1770	1511	597	42041	30813	27094	33205	31286	38843	57655	80092	56166	105526	118881	204930	129372	147593	135600	177656	133448	183220	197416	218946	176073	48271	45580	34517	38444	57588	52117	67460	77951	57319	74289	54997	28840	29182	32121	42216	41489															419	715	575	659	1101	126	1025	331	879	10306	12376	12616	12089	13531	17378	13093	30877	34843	55398	54229	24060	19661	32793	30788	32822	29407	25677	33033	17499	23099	23893	18220	12870	14660	17329	14895	14637	18865	19749	18670	18904	19503
INDOLEPROPIONIC ACID	0	0	0	0	0	15799	6031	13840	0	0	103	0	0	0	0	123	0	0	0	109	0	0	0	0	0	0	17562	25511	23908	16596	12387	4242	22807	8481	24513																	979	331114	554451	571	895	131035	280025	557	687	1039	731	839	652	742	520093	787	219	310793	485096	1524	467	55	153	0	311	547	0	454	257	175630	207694	136729	188808	397	134	257	190	1009	106	412	297	117	274239	247765	264312	211903	670	440	1000	1470	222	2415	1110	1419	564	1251904	1607781	1412964	1477067											3002	11282	8317	5280	812	712	574								474	312	698	857	514	454	470	752	0	4751	20438	2882	1798	6371																																																																																																																								
INDOLEPYRUVIC ACID	4192	11350	9803	8597	6147	9880	5166	9594	2750	6465	6230	6251	7249	5794	7196	5961	7849	8762	6130	6458	5451	6122	4454	3457	6648	7315	9782	5707	8732	7688	7506	4789	6611	4937	5542																																																																																						504283	498615	495048	528010	499884	440137	428368	697627	677504	671380	694145	633906	474109	506825	280237	424549	384843	357952	332463	333489	338619	347055	227861	202786	185719	149682	127165	220495																																																																																													9565	9893	10060	10257	10754	10701	12802	13258	11853	11637	10980	10197	11944	11602														
INDOXYL-BETA-GLUCURONIDE																																				877	564	626	10728	9375	9005	11605	8385	12156	5691	15432	11537	7935	10425	13022	13963																																																																						79	163	3133	2054	117811	106466	54803																																																																																																																																													
INOSINE	108657	59308	24621	65070	61677	57678	165222	103860	84435	68989	61486	74890	47745	67474	40133	56427	60190	36614	71979	94494	90494	63801	47645	45289	52920	40065	61251	159758	54906	50810	53306	51705	90975	101425	99543																	0	16555	69632	47589	51601	4215	33302	0	0	624	2762	37072	0	23706	40675	54815	6709	10376	25767	0	366586	242781	319435	303126	178365	189113	144799	181071	158531	93587	93120	103346	146214	633683	216669	283458	282995	348205	494724	287994	272908	301588	136089	270766	220518	202967	104	0	69280	105	26746	115	106880	119958	1345	157721	146515	136503	174400	5049	4174	10453	4960	4215	1784	4103	2931	5693	4545	12632	12445	12613	22284	9986	15926	12513	62598	47979	66617	38604	680776	299670	496639	1872	3836	312	581	1072	628	1513	1063	150928	428793	244693	9222	400336	169348																																																																	27940	28151	24513	25988	33220	33265	26674	28210	38953	8936	8623	7916	6299	6780	30248	28150	30365	32349	33511	27420	36285	51282	39076	5121	9253	9506	12063	11969															135	0	0	120	5566	136	2869	26009	4270	0	106	2348	249	298
ISOVALERYLGLYCINE	4257	3040	1422	6300	5588	5455	9002	4183	3954	4618	4388	3793	2739	2982	2412	4279	3111	5164	5843	3842	6123	4517	4952	3841	3539	4256	4024	6570	5092	4337	5602	4169	4546	6329	9189	1230630	797728	2959794	1615556	1317921	1026016	1022466	680291	1629029	648966	4056084	3733806	4354096	3044609	1899024	2419372	43734	15041	18399	33454	37631	6952	15074	27090	59588	18234	31408	26497	13769	30805	17929	23230	23142	12436	14860	41053	13454	7775	14919	8129	13467	18041	14662	12461	17985	12371	11932	10054	17350	13519	7856	10503	11048	11314	14100	13451	13701	13354	11311	13311	14034	13077	84618	39759	76349	111939	69781	52165	48291	40987	36485	27050	19430	16422	23508	4144304	4290432	5681201	3806032	2788818	3034103	3615778	1519847	2011513	1209326	9082009	9178623	9120994	10847136	9848749	7746592	5295970	303952	236671	180667	213809	266745	154284	176534	17381	10683	12727	16999	14101	12372	13242	11997	8044	9271	11443	43621	10183	7826	32978	25927	26932	25080	29292	25562	27733	30287	41511	25888	31254	49761	32050	37648	40894	28522																	3727924	5550524	10535991	4933297	9250128	10016495	13853252	9887967	10913775	6688062	10853315	9755459	11111961	11749455	14344256	14484545	204863	181245	154578	127389	192132	181925	185271	216050	194131	246854	166247	157114	129428	131701	132441	187686																													1212749	542058	1238900	2263732	4667607	4524422	847601	1054926	1960459	1174619	1050593	981988	1004052	1017220	41934	34507	34430	42675	37761	58932	27562	35378	45322	33214	33742	26490	27427	40625
KYNURENIC ACID	3956	2597	1712	16188	14586	23769	36435	22405	3162	2536	2862	3113	2657	2151	2088	2740	3478	15095	13072	11799	13647	13131	16753	13277	15963	16270	17766	24780	20797	19152	22284	16046	18696	26268	37835	210339	141767	229413	326286	136641	168740	273595	134271	266083	64859	243669	217206	232306	209011	141713	192290	15668	7001	7919	13218	10123	5772	5541	8353	13711	12983	23922	14050	3383	14501	7776	16510	16474	10963	9899	13502																											13893	12616	19608	20542	7499	23386	20106	46582	11820	7520	7176	15904	6079	270402	320728	360259	297091	230093	247316	286043	193019	415072	250127	1624810	1624190	1841323	1696912	1307408	1338345	1295658	88013	72569	68613	71499	49438	36336	46586																																																																																																											162468	162056	235043	306560	674434	617462	233179	229625	396574	291694	375152	231464	219307	347110	16552	29893	29735	29648	13709	18944	21441	19495	31524	18226	26797	17526	17671	23857
LAUROYLCARNITINE																																																																								84770	67159	85326	76931	55732	125946	76934	101720	97119	73921	90689	73906	86592	79247	57913	77466	70617	80693	91074	106759	77689	110651	63608	75173	74716	74142	11595	10248	15620	14836	15890	10899	15003	10943	13575	7687	10147	9556	8573																																							204876	250588	140517	228748	221397	188234	271602	278165	257657	234966	225581	479455	462332	440308	540526	390732	145649	210934	109642	194807	156515	155395	198465	181234	207903	231460	149965	209208	233183	190240	218365	202069																	59488	84335	31680	52904	85059	78798	95328	74016	110840	65834	62563	57507	44793	41853	54391	65607	57413	70835	69301	68874	66712	69928	64571	79995	107945	126908	111079	95332	86651	78435	45421	52713	61814	52776	55544	46818	47068	73745	61476	66252	91415	83396	83259	76129																												
LEUCINE-5,5,5-D3	1027275	1594680	1507902	1165640	1270741	1534641	961483	1458198	1056744	1500328	1264158	1514583	1659083	1342438	1664276	1271585	1457633	1590264	1408970	1341772	1169362	1154424	1172478	1099254	1197790	1259319	1384327	923455	1486446	1151329	1044312	1168893	1279452	1072242	804864	1632487	1640402	2020824	1994981	1619075	1436606	1969549	1655627	1928364	1722253	2397459	1796164	1941590	1733267	1658533	1985176	1414486	1669952	1989941	2084433	1417080	1912065	1741470	1548612	1450586	1893754	2148647	1589652	1367815	1336271	2291998	2098827	1932313	1502203	2029916	1655832																											1444890	1290656	1520875	1152601	1520758	1658916	1857451	1415874	1458808	1438921	1398389	1439615	1305231	1966135	1958727	1959219	1965804	2009777	2034665	1984718	1992911	1901697	1977458	4484087	3686452	3588667	2653798	5658445	4940760	5259814	3309640	2939363	2928846	3272885	3403714	3340904	3247203	1716256	2831651	2614364	2260441	2475866	2443724	2400193	2494174	2040141	2159178	2251617	2137267	2138948	2593346	10045235	9098587	8712191	8916656	9254474	9303346	9228302	8332270	8275664	7450944	8577591	8035264	7708940	8169424	8239182	9074227	8734585	7824174	7503998	7738958	8850153	7528678	8308596	7050279	7011549	7840751	8601836	7130394	7845671	9190720	7903984	8319379	16650125	16283165	16136974	16770420	15397657	16365213	15217157	15857158	17073190	16063227	15386445	14682785	15488712	15399362	14726085	15355113	12231560	11355880	11807706	12324601	13300652	13198711	12430079	12581871	12731157	12507574	11809676	13388857	12690928	13314046	12311183	12272087	1539868	1523066	1616783	1509098	1246071	1419962	1305082	1417276	1242133	1329104	1361626	1482068	1460810	1204917	1251372	1394444	1268771	1312107	1173487	1154446	1239085	1152864	1190144	1425351	1156539	1202062	1153359	1054477	1972806	2018906	2087559	2168922	2247812	2222452	2435490	2473581	2434874	2180004	2259788	2347261	2399794	2461817	1844362	1860037	1825829	1910449	1798777	1815549	1922542	1804386	1821223	1935585	1904302	1883355	1890428	1841138
LEUCINE, NORLEUCINE																																				302582	349741	614918	450131	492410	425284	276495	313162	636396	216535	787371	627929	695946	921731	745210	453140																					6417436	8822683	6453550	6108968	1272339	3823330	5538626	2212774	2005808	6281580	5856768	2862242	5615692	28801496	10029588	13097339	15853780	16484115	25813700	14468153	16132511	18549630	11758961	23752652	16797746	16123654	11994801	10193281	10074993	14325512	11366118	13937960	13088777	13107836	11386832	10435194	10698998	11327602	10509307	440153	576429	553794	465101	519685	367344	586516	401277	565996	230170	946714	715709	922874	682193	557709	1335181	394307	21184584	19110688	18245020	15311568	16780026	18928858	17822948	23727252	8411328	10640006	12133575	8803504	10341181	10634525	9787365	14188299	16782656	13722210	14692985	11325021	5563272																																	764876	1292730	3547272	2042718	2244908	2363664	3014379	2668024	4087329	2249658	3559112	2948672	2822826	2851603	3008336	1883178	80900624	77820920	71095328	50789432	70597600	71905936	46912056	46620004	52304868	82757176	77160128	70684656	72453392	70282904	72982912	70272896																																																								
LEVULINIC ACID																																				21497	15503	28960	20521	27397	24366	18690	22716	18623	10507	38058	34943	31634	34764	21904	19912																																																												16351	17439	13657	9726	11494	11800	15162	10789	13200	9189	57010	61176	52929	57013	23606	40323	35137																																																																																																																																													
LUMICHROME																																				29986	24838	42340	75473	49458	38651	39338	25846	38146	24330	23685	44503	44060	36551	21633	32815	6802	6193	9573	12744	6971	4334	6481	10500	7966	14293	39922	7043	9780	5394	10279	28518	10830	6714	9214	17909	2605	698	2517	1134	6469	57532	9624	10184	21320	9431	9576	6146	5892	8719	2592	2540	2136	14532	50516	21121	15502	28028	10819	11962	10459	9382	3471	4499	4300	5130	3698	6591	4960	3586	15389	1652	8043	2270	8415	11431	26514	19882	51403	37831	28222	35395	16405	27421	13728	20258	20397	23452	10046	47313	52015	34563								993	329	1228	351	1727	664	47	1522	57017	41190	54703	50265	2864	37056																																																																																																																								
LYSINE	172535	136995	99625	121749	107334	144152	224398	136721	214677	168967	154848	196892	153610	178266	162512	205276	236141	93820	116091	139567	110265	86767	106636	97093	92687	81255	113481	352745	133923	137778	194980	105737	136413	224694	353715	11696	13443	13359	8381	16724	18838	6453	11862	13113	8963	14235	16768	19627	17033	14563	9388	74209	84432	72703	95058	65255	77815	65693	84232	96345	72248	78197	78208	52599	56352	89117	68431	85212	79097	81572	65039	235999	310998	223104	260759	281268	303579	317884	259705	213486	229999	225887	190512	221478	811962	336417	369330	517902	424191	574582	467546	406703	440457	311914	484057	364520	365130	50753	53209	53810	64482	49452	50652	41533	53308	46783	43025	44646	41007	43296	5282	8622	7003	9336	8258	7058	8585	7559	9995	4912								121431	168514	117204	181011	122452	105486	81410	587570	293691	352017	464330	383768	408452	331801	366409	449839	478202	420595	355529	553927	460810	1234488	2505454	1556594	1777723	1879836	1878873	1919920	2363621	2527778	3315910	1666668	3500596	4807738	3425942	3439426	1473148	1161913	2468276	2642534	2759050	1488483	2543465	2452228	3049010	3035642	3042935	2264202	2239124	1976467	1279524	2890038	1539911	21147	33733	71205	39116	64120	64684	103974	52623	73336	55481	58661	164085	180840	278333	186852	227047	366733	359922	332114	339276	377886	350383	339495	326878	330069	350783	324353	343015	314771	295807	274856	284093	567961	386634	390161	467804	758014	663564	550925	515899	617576	1047493	471972	525180	890974	593183	738535	508699	675687	696906	690730	715440	622765	923234	738307	694997	928973	769336	844098	905207	6488	5610	5903	7687	22051	23160	8300	8596	7775	9435	13310	8118	9615	8554	69491	64725	56974	58189	62983	69811	64741	59844	57431	77054	75449	72169	48326	66541
MALIC ACID																																																																																																																																							33124	26920	27695	38482	53216	35748	51750	47147	16653	31509	22395	16353	29094	30743																																																																																																																								
MALTOTRIOSE, RAFFINOSE	56352	70367	71748	0	0	365	937	0	52834	69570	65090	65726	71105	63580	67562	65457	58046	851	207	1230	632	0	0	1534	770	703	0	0	0	0	0	1294	447	0	0																																					203471	207640	225456	207358	6905	3729	3017	5614	2446	141708	145060	171694	143746	159150	181526	185896	175491	5152	2266	1531	5261	5976	134734	120215	129795	56408																																						101554	45590	138087	127648	126287	67178	140490	143889	189	2148	2962	3944	3888	7221	346876	320902	129732	444987	382734	64708	360861	344408	363758	384383	328651	19895	32839	25573	49754	49056	301406	334196	369136	336070	104840	150500	311698	286845	106098	207951	416753	1651	17441	44026	17541	30962	14228	20660	25302	21441	14020	17385	25599	17804	18587	24687	26895	12259	16091	15032	14349	21692																	114322	98995	97034	97886	90571	97685	95856	86049	75150	120324	93446	114396	96683	104945	81817	93044	80912	84621	78731	73851	77748	75053	78250	85783	71365	75832	74121	67917																												
METHIONINE	692646	401204	227121	976411	785205	959536	1392920	960305	587042	350255	314548	399919	337677	610530	476074	429520	530766	1044194	1187197	1487795	1083501	930240	1180145	842774	771536	667325	955261	2777493	940227	1098541	1394469	666992	1414337	2059721	4465432	119507	179354	412561	383861	463682	262104	215915	379079	497552	304937	626411	783477	997222	904539	794313	516156	1023400	2496577	1848478	1852344	1152592	1562061	1423466	2140700	1997780	2012661	2712994	3740060	2117430	1859331	3411227	1997145	2642214	1500082	3007006	1838235	731106	887447	730110	699633	612207	857654	1094867	822484	556066	714147	711798	654402	543782	3811846	1157714	1457340	1939399	2224636	3799343	2147432	2265054	2654929	1192565	2187203	1551094	1597943	1589639	1065391	1833205	2071279	1594891	2774086	1773177	3012001	1123662	2279774	1933814	1633714	1600479	183526	227920	176745	290482	253018	271091	267824	179314	221398	121239	383898	380024	414862	289033	178730	265948	106837								5836234	1341001	1642274	2314668	1542082	1669570	1683036	1580817	3088826	2839376	3292426	1592393	2629249	1513286	2217154	3125596	2329510	2432544	3559682	4004920	3452936	3850077	4826357	5140308	4501642	2239375	1275453	1619088	1529146	1680844																																	4505230	4595442	4792979	4315203	5274076	6061185	7109888	6401002	5986478	8183700	7270962	4326352	4405880	3741909	3999701	4343143															1214513	814402	1081502	1048098	1135599	583160	1310461	1445040	1309231	307561	915369	416008	574647	869473	32251	29312	64343	104216	130075	222733	101952	57521	131297	23589	91441	66706	126758	91840	1001128	958500	780438	565470	806016	877096	1233623	956453	885047	722654	963579	707934	817267	879258
METHIONINE-METHYL-D3	659922	991149	855040	774894	708022	1038093	602694	965777	631970	728677	643128	800381	909151	804802	1008854	718928	905519	1010714	905304	931617	700121	683979	709805	669671	733763	756262	918942	826288	991735	790280	788201	728468	889366	794222	826711	612622	591518	740683	768074	574391	565834	931230	656535	881472	589325	1023359	642624	749159	649640	689206	796260	505231	864764	1041518	868779	495660	759720	864974	680978	647585	1018235	1261038	824627	751074	706797	1164368	1002981	1066542	760504	1040525	845075	1565302	1660876	1697062	1663695	1877062	1819217	1865573	1926956	2104040	1871088	1794017	1877641	1866608	1715160	1829012	1797116	1821158	2032478	1838748	1948423	1939593	1935152	1909850	1860496	1832546	1777637	566966	307460	671497	546557	656740	782003	840870	669202	263331	590756	644541	652304	641175	845333	817911	874576	792574	826053	827766	828608	887153	770418	872316	2037800	1950027	1885779	1916641	1915818	1049494	1841022								1640601	1886040	1848449	1719094	1809672	1813231	1788084	1833994	836264	579754	814883	561476	863531	916365	2134434	1900735	1844954	2089956	2017609	2337854	2083464	1885384	1956929	1666247	2261068	2048663	2156458	2090532	1997659	2050390	1987390	2118968	1780702	2143792	1770026	1713093	1876600	1165807	2150692	1921883	1998078	2098308	2105945	2021382	1938246	2011085																	1594216	1551340	1571249	1437887	1491767	1569116	1485546	1589299	1436299	1620000	1645443	1721750	1960899	1664210	1857581	1515102	430135	458666	424982	411751	417446	428031	434317	449363	425435	434076	434171	467260	464218	367176	408066	413578	380073	381686	373577	361519	404128	395856	345150	432188	409798	405953	409962	374167	287260	334610	276470	324072	355510	357137	393868	412619	380614	361337	326897	432530	444312	451016	376864	382367	368433	385219	386705	360894	378486	342633	331503	387221	315641	350233	366241	380322
METHYL INDOLE-3-ACETATE	7479	32546	56153	20730	4007	9574	3825	14164	12672	30309	148367	81794	85107	78559	71220	160381	8700	50687	73425	9921	42081	73381	81486	7652	52916	48463	36836	46806	80217	75420	30285	10805	64663	10899	22200	42484	42389	79171	28846	16670	26674	34343	30935	49795	30397	32242	52562	72500	91441	22143	41213	40837	21741	13244	26518	29055	22907	10731	25172	31539	11575	7531	26295	22058	37691	9894	7076	19724	5140	9786	25300	5202	5546	6456	4013	3782	6845	4845	5560	5571	11905	18703	9103	10382	20008	36757	41582	20898	40201	57904	37381	47772	33372	28934	27627	34586	32212	63765	59504	53642	75466	54304	52597	40429	57265	49368	112053	68522	132163	98784	6713	20390	15486	24452	15351	17522	16143	4042	5903	5148																																													10048	5417	7093	4640	11393	7548	9757	7735	3636	5584	8269	21197	14191	14614	9752	12192																																																																																								
METHYL NICOTINIC ACID	2417194	1303549	1030511	725961	744136	229023	254048	455715	2366564	1958260	1978207	2138274	1878542	2140782	1671408	2046656	1811739	1135477	1447678	1424416	1319761	1262006	1585953	949251	952216	860420	627562	639087	698261	755150	414868	684218	1308760	980349	318781																																					110214	140402	166397	93687	45372	63425	78166	65255	47212	266956	355179	131711	137860	775355	1153772	1376982	763669	959121	1402310	914577	1194685	737047	769163	798615	893770	965522																																						666542	1110588	1317748	1001948	173141	218528	389913	182684	19177	11230	12925	9056	11676	12849	224023	449915	681838	184467	493234	773162	632028	839263	1059109	598381	1308903	356971	273531	401683	317026	520315	4127769	1701451	1769438	757642	4395755	2732083	3026107	1845060	1252817	1197797	1573963	8224639	4251745	5440890	3324248	4407442																																	50198	74984	264616	149948	107773	70849	469972	682402	480825	53802	494539	110052	108178	262936	313170	227132	192956	184514	416308	405333	482396	179073	376752	297368	466441	313909	348309	424282																												
METHYLMALONIC ACID																																																																																																																																							9725	6017	6109	7557	9817	7556	9618	10211	12123	9358	13096	6438	28533	33751																																																																																																																								
METHYLSUCCINIC ACID																																																																																																																																7855	6604	6254	5062	6125	15106	5011																																															14433	11285	21702	20012	44662	55341	69305	29818	34095	22691	54393	34184	43985	47066	51911	39476																																																																								
MEVALONOLACTONE																																				19191	19551	30315	35187	22691	19361	22771	23879	38371	14886	38652	32402	27546	35069	19444	14975																																																																						52453	55892	32250	38872	23235	12593	19826																																																																																																																																													
N-(3-INDOLYLACETYL)-ALANINE																																				2153	1642	3352	296980	209925	208877	288943	118178	259763	673	3446	2638	1396	3034	1565	2427	9682	10957	16931	21391	8335	7030	11818	9075	8031	26250	22334	8216	14160	7430	14201	19765	21329	10336	13418	10882																											14305	16979	16125	23599	21533	16974	20371	22119	14762	54456	42638	35025	27885	2017	1710	1456	1961	1403	1604	522	1451566	1943918	1543973																																																																																																																																																				
N-(3-PHENYLPROPIONYL)GLYCINE																																				10272	11140	14125	41231	22800	22954	20941	17741	17836	12011	8204	20616	22357	15976	5337	7992																																																												740	7573	3972	8535	8223	3492	3208	414	2806	2336															12979	9435	11107	3050	11527	5499	3126	11063	81075	103877	129252	118121	145778	182860																																	14014	18007	30268	29226	35002	35916	63522	29339	36123	29124	39394	33465	40711	45238	56636	44890																																																																								
N-(CINNAMOYL)GLYCINE	55867	60814	51815	41769	39216	23317	31183	28112	17874	41074	64922	40119	36015	36848	21516	37553	35277	38428	27872	26132	53718	55437	43734	37238	39853	45004	43743	25440	38083	18456	24569	35809	37472	28693	23210	11784	12571	21747	913590	633647	533624	843335	354533	433288	11360	19308	19047	27123	18992	10100	16659	2116	9159	18469	1668	1053	3992	11482	676	1973	1657	2025	716	1304	971	10663	2779	2181	11014	11449	2122	27554	32479	40329	23832	13241	21374	19642	15011	16037	42421	58220	21285	33205	95330	92260	100110	86692	115918	135969	110710	120933	98211	84899	91042	91249	99572	2528	2992	1676	3518	55	3198	2025	3334	4521	31365	22164	16728	18401	14741	13962	14018	16552	11861	11329	11449	781491	1220864	850788								2933	1613	1500	2117	47463	52182	70214	76758	57990	72819	58135	15660	59400	87256	35827	11638	3081	17654	8537	45737	8775	21387	32161	47105	18680	34777	50883	46959	61071	59696	29384	81139	30126	22453	29299	20768	29742	138097	79053	86460	43610	118125	94049	99158	71822	56753	60401	74751	199506	122166	148953	113133	133136																																	5929	7947	17333	11085	8990	5867	20528	26506	26986	4683	20380	8743	8643	13391	19369	13768	14027	13136	20010	18142	21859	10453	16064	15123	22416	17681	18942	21643	6637	5360	12159	11731	11803	10092	7833	7670	11976	6385	10888	7606	7710	10481														
N-ACETYL-ASPARTIC ACID																																				4155	2162	6773	15968	7438	5771	14433	3740	7215	3173	16919	9245	9257	8749	7969	12485																					1934	1043	1967	1281	1037	3779	353	1533	4732	46695	45026	46920	89496	3011	2354	2815	2020	4171	1227	3337	4691	3647	30341	38005	38285	12805																								4579	4108	10677	5401	84897	73663	52358								4369	412	713	871	1051	1837	1352	148	38163	31004	49509	80938	26913	80582																																																																																																																								
N-ACETYL-GALACTOSAMINE, N-ACETYL-GLUCOSAMINE, N-ACETYL-MANNOSAMINE																																																																																																															7785	8409	9519	7962	11204	6565	8265	9265	4876	9553	11376	10063	7843	17780	4376	4106	5856								21177	16224	31015	17767	25408	19198	19858	23680	65566	69302	62887	70093	108479	116966																																	37015	44208	65852	67758	61395	64012	79442	55936	64140	61861	62967	63142	87163	83515	83589	76465																															12676	27791	18901	29430	10635	18534	16607	16768	15652	16395	10464	19439	13562	17830																												
N-ACETYL-GLUTAMIC ACID	773	619	0	13180	12526	25381	39253	33473	136	319	110	353	219	107	244	324	273	15420	16822	15223	14905	13017	16445	16813	16767	17363	19189	26275	22455	20792	27646	18142	28863	34294	29744	11582	15866	34756	54020	49392	24502	51210	20214	49827	12018	61004	55424	53620	55135	45486	60526																					4132	2270	1901	943	12583	11696	8730	10070	15699	69829	32533	121102	129875	678	1530	3113	1592	3797	2907	3535	3664	2808	41418	34019	42516	27258														22505	24052	10981	27874	14259	11468	19632	20024	27848	14547	66996	68736	70028	29740	145030	129228	85219	15576	15215	15088	9354	15822	11176	13272	4199	4292	3672	3247	6659	4461	3892	5429	96341	106746	123219	117754	115759	150914	3781	2621	2077	3499	16089	8007	15677	9549	7214	22036	4088	33179	34526	35162	34514	9763																	68541	96087	142896	118381	54623	77211	97265	122531	66763	149114	213877	119766	97730	54750	85257	40768	24549	18924	15728	14098	16657	18140	14980	15401	17750	24513	15942	12151	12154	13531	18556	15867																													13206	12626	24817	25682	32209	25824	21645	11912	32550	23522	29109	30519	25803	31065														
N-ACETYL-LEUCINE																																				26404	38453	198541	122098	190564	47171	64714	69461	319472	69935	250794	261426	318585	164932	215651	140806	26289	18931	19910	33497	22224	25507	20224	16409	17928	19809	36483	28195	19765	22087	20592	24674	29546	18825	16748	16989																											26983	19327	18293	48013	31154	57059	28322	42725	32835	40684	23301	22262	25528	94943	73024	49848	39495	22889	53655	52193	51993	61205	40598	518264	528814	412709	238187	370310	486525	141849	274269	166352	158867	110950	250280	188997	254240	10412	7555	9961	9871	8067	9410	9824	7135	8365	8809	6857	37395	11648	10539	18115	18481	22657	17270	15388	18068	19130	17602	18448	14912	18115	29257	27149	23424	22562	30624	16315	17147	18897	19054	18013	22212	19350	19058	18359	17752	17433	36925	25405	24631	24330	23095																	114298	96216	83935	68293	86823	103283	79170	85989	107397	137376	88492	88953	105676	89597	161871	140631																													13875	9283	30597	39959	45326	70007	15335	6805	35488	5111	9509	6899	10570	13941	26299	22841	25512	17640	23484	29810	24730	23790	35998	22424	30928	21174	24935	19293
N-ACETYL-METHIONINE	18211	12995	7707	27933	21553	33024	55119	40013	19326	16065	15198	16636	13337	13964	13356	20573	18434	33552	29806	30117	38056	28446	39216	26479	27712	28875	31193	50082	41140	36957	39073	33514	38692	54225	67762	25778	18454	47286	21397	46297	13778	23586	16038	61875	9833	81361	67357	71056	49201	53575	45641																					58546	58423	57409	57297	95745	101009	92716	97227	77718	95517	94638	85593	94930	68717	55130	57244	63142	86173	99849	104642	100947	89170	86971	106414	100658	88839	8320	6140	6417	13853	6861	11800	4227	8618	7533	9366	4680	5466	5046	47260	30122	33757	31314	20943	31671	34488	33127	48493	27120	111134	113740	76193	27467	104728	105411	66491								135898	93354	100471	118887	112148	113681	123996	101864	43002	43374	49179	63121	44961	56484																																																																															30710	29783	32578	34042	43967	44441	39005	41465	40079	38862	41269	47123	51766	51830																												
N-ACETYL-PHENYLALANINE																																				8211	6398	11841	271262	209623	153572	185511	130783	239679	7836	12724	11290	15331	11402	6305	8840	18297	14432	16927	34189	11955	21496	19415	15854	15739	28608	34623	19577	62440	17959	18536	26617	32046	12995	16650	15180																											24357	20795	17907	37198	31708	42516	30184	38747	23864	22694	19119	18428	15699	5311	5439	5009	8182	4130	5536	5720	156033	251017	159895	20435	28924	25760	6743	1463066	1101928	924030	2820	2175	2720	1863	53054	33095	33950	7517	7895	7008	7057	7857	9638	7618	7448	3100	10583	9071	40213	12546	11157	12040	15845	12098	12636	23970	11578	20236	16479	15673	16145	16022	23347	15759	17013	18598	18924																																	103096	98616	84645	89818	109850	125962	101753	115929	111998	159591	115153	82404	86938	79809	136296	112056																																											28402	35233	41338	24302	20975	27658	18980	22429	30724	29728	35416	28701	33559	24689
N-ACETYL-TYROSINE																																				13722	12822	25633	407476	256455	312751	363494	165831	357833	6370	25552	28065	30187	26921	16823	26606	4068	6899	9371	8167	3399	4998	10776	5538	5158	11144	8981	4584	14704	3242	9855	6208	9300	6302	10851	3958																											10940	13881	14014	15003	8867	17564	13158	22120	7322	12112	17253	15946	8514	12901	11070	10998	14994	10397	13235	11623	445719	664823	509507	36929	37920	29502	27989	81310	69332	52370	45068	36883	35483	35396	37321	49002	39935	2759	2444	4164	4919	2583	3476	2638	2654	8155	10489	15006	23461	16084	21417																																	29116	35792	65274	51269	79201	94227	119511	69179	65785	61678	38082	76035	95203	96853	110130	72188																																																											21862	24948	27055	16205	8921	14195	11318	12754	12036	17801	23605	17237	16298	18440
N-ACETYLMURAMIC ACID																																																																																																																																							0	0	0	0	0	0	0	0	17942	37759	22421	20681	69110	38713																																																																																																																								
N-ACETYLNEURAMINATE	28300	28575	14608	21260	20645	35392	28309	28402	26350	26348	19444	25201	24869	19562	18960	25449	23065	24116	20380	23251	24565	18432	17411	19882	20429	20707	23619	34805	18312	16624	46682	19484	26783	34471	43125	9674	6728	13292	12308	8808	8666	13959	5791	12319	4221	12254	8302	7636	9722	8741	11360																					138376	115012	110395	120431	890353	861621	706745	836636	932386	82428	82468	82797	80994	100599	92369	91151	101608	659492	656530	636325	652637	786629	82800	69837	65222	73889														11581	14294	4843	7933	18410	7045	8626	13941	3556	12526	23648	11818	6563	10548	3592	3029	4039								77885	62951	76089	83326	135030	113152	103911	109555	27497	21929	31892	44433	38959	59301																	298519	346002	289701	379999	233262	265139	260650	291227	266743	224236	303335	242362	159240	199590	223977	196801	29177	44274	54531	57461	40756	42272	52064	35828	58923	43638	44248	50938	60277	48431	56077	63098	20325	28932	22436	19298	13526	14212	14221	14425	19239	16708	15466	10680	14024	11009	11327	14889	99606	80429	59809	68099	63501	68917	69035	57561	61422	112045	57233	82638	68997	71381	58982	59213	68433	59640	54701	52962	52902	54343	49184	54687	50734	58263	49100	49208																												
N-ACETYLPUTRESCINE	5836	4882	2665	349010	437836	45563	33673	27464	6516	5190	4270	5377	4444	3921	4383	5928	7306	514944	503185	389746	366207	275795	454736	289585	353445	344604	38805	61711	29592	13708	35994	28399	33408	43864	81063	3727	2831	10229	10059	5176	4716	8836	5348	11283	6753	12539	11384	13294	11319	8983	8456																					7083	7410	6109	7430	40110	43370	40782	44364	40605	28624	27450	24240	40878	5355	5527	6815	7518	29883	36339	46226	41563	45245	24568	28086	26866	21758																																																				18767	17936	8192	20721	65724	54462	63293	60212	63559	50147	51927	286752	189431	184137	222674	183657																																																																																																								
N-ACETYLTRYPTOPHAN																																																																																																																									23110	19483	21253	19722	350259	230040	235434	123655	93099	95234	73542	89760	69504	40518																																																															85794	85363	75205	93307	63223	65995	63423	82570	89447	108005	70682	41372	49800	46850	105084	91128																																											23436	30389	38678	21785	16072	24430	15447	18337	20432	26619	25989	21402	20003	14675
N-ALPHA-ACETYL-ASPARAGINE	1028	981	454	19258	22687	19296	31385	35126	0	1108	47	515	9	515	1015	0	670	10056	8323	11993	17627	10982	9077	14662	13136	13942	15625	14990	13700	11631	17704	12879	19621	26977	39534																																					861	927	17117	7635	101705	105649	134120	96338	84327	167	2864	3583	763	221	280	179	286	82402	97571	103985	138790	146721	240	271	5683	2655														9001	9614	3591	6319	7922	5734	6627	8094	3367	6886	2728	2959	7866	6146	13702	37139	11930								3790	3077	3144	2522	7454	10200	7191	6311	140577	117321	112158	196870	571247	265455																																																																	17396	23183	4077	13720	13479	14526	15302	15981	14909	64318	40571	45303	40040	40999	15215	19966	14562	15895	10965	12377	11482	10119	12635	85146	76742	93514	76781	72323																												
N-ALPHA-ACETYL-LYSINE																																				65888	44755	89521	99788	66607	70688	88935	64618	93746	43565	86707	68434	80542	71786	57242	59514																					511903	412872	413899	420073	565453	525228	355156	531614	517796	414014	439206	433993	411188	223774	397996	414540	428085	228264	278212	175006	215342	193726	365446	400175	378208	415959														33538	51483	27628	32140	37303	25941	29298	30426	7432	31941															188120	212489	306804	218036	392685	264371	337979	248053	12579	10631	15012	14436	19102	20974	855554	1007089	810188	958575	893893	705345	831990	834030	850110	639373	742134	710391	554776	508511	641878	536499																	227883	280719	413591	329231	331277	351684	423515	325591	415839	336451	382598	388488	453368	377843	161377	360832	53122	50113	48754	52038	45065	42206	45289	40964	50551	61393	44166	34342	34313	35736	38656	53048																													34820	37727	50092	55733	58962	60766	33537	36614	48362	50293	45023	43751	42573	44258	6860	9723	8880	7102	6482	6863	6722	7631	6654	7528	8025	6432	7113	8763
N-AMIDINO-ASPARTIC ACID																																																																																																															2404	4528	4054	4810	6188	3743	3594	3873	5546	4053	5010	4998	8944	3085	8866	10641	6032																																																						11504	13051	22092	16626	37987	32637	28315	25194	24152	19850	21066	22328	18820	21893	25443	13762																																																																								
N-BENZOYL-D5-GLYCINE	182150	309408	304193	213462	237500	231510	144029	237820	185199	301603	288195	283219	306599	257466	313146	284239	276737	277776	245383	253811	244010	198647	184955	179554	197379	195909	219783	153492	235811	183486	168361	201018	196523	165933	154826	166153	172700	214608	232807	175623	171126	239280	180925	223103	175074	244101	170525	191817	168731	172081	195489	166315	194414	237322	288145	166515	271216	203845	186068	172607	245971	311793	199614	185956	157216	301032	298768	261912	175332	258691	205031	664563	664395	668632	666617	691360	656472	660796	643206	703901	655922	596684	677272	635836	591451	644498	626646	645458	640879	592525	624749	615076	602649	629346	603987	640956	607399	252286	244326	249795	254708	259159	317256	338078	256636	242051	245160	242316	250578	235048	250835	249396	249155	256083	260434	270997	279005	249342	230903	244655	2941003	2886482	2890777	2741553	2382190	2158436	2455132	3016192	3024437	2974905	3124173	2921796	2821681	3015725	1599669	1912629	1806614	1718317	1729360	1771220	1749753	1788927	1106020	1262168	1184091	897953	1284047	1280848	933036	907694	881748	879288	944334	985112	927729	926186	876253	809634	966508	864928	910463	884573	855416	920711	892485	899807	862916	894292	833794	908004	863307	916091	907826	974606	979766	854750	918394	921728	845541	943054	1061552	1043093	1037298	1070154	1070938	1091080	1063577	1070678	1041495	1080920	1085807	1058589	1100038	1075274	1042394	1046506	1083542	1043716	1073974	1069679	1075021	1074774	1073834	1076495	1066230	1149493	1073821	1079001	1078080	1083246	1077698	1049454	180013	174057	187307	185900	171013	182628	176054	193649	171545	154890	178432	183176	179466	158056	203195	200518	194089	192425	176645	186316	186822	190580	183071	198373	187488	176933	185279	172699	306390	306399	299295	303095	276889	276437	289356	286722	287465	306034	310221	302652	298481	298523	275187	269307	274986	278153	273114	273536	271062	267550	264122	273515	275990	273118	266882	268298
N-BUTYRYLGLYCINE																																																				14936	43168	40711	15624	20493	12861	32514	9463	23028	20308	25720	21932	12276	16785	35588	22029	21915	22636	35530	24642																											25703	17691	23218	19387	17180	19819	35859	29126	18411	14847	24503	23302	12569	128388	127294	320156	240812	134257	158001	206907	70516	110460	176693	474632	533573	510690	1178076	809339	464473	750148	50170	51756	35174	48635	47156	34405	44058																																															123548	158774	413657	203988	259731	266939	366956	325420	437426	182466	272017	211249	274468	333958	878416	459916																																																																								
N-FORMYL-METHIONINE																																																																																																																									27129	26556	26604	19515	20181	22072	13454																																																																																																																																													
N-METHYL-GLUTAMATE																																																																																																																																																																																					64436	87632	96412	194043	64859	67734	72447	71466	95909	89481	71292	104812	369486	119512	107870	367880																																																																								
N-OMEGA-METHYLTRYPTAMINE																																																																																																																																																																																					87228	177380	272898	230189	226705	229745	366903	358140	283319	170984	309408	207679	315885	318292	409216	310651																																																																								
N,N-DIMETHYLGLYCINE																																				57743	59221	51638	58330	78859	55496	46203	88343	108511	101541	56237	81135	70330	79076	77670	55612																																																																																																																																																																																12865	13042	13472	12659	5520	4567	4154	6519	5266	19698	20601	28068	27794	23773	31014	24992	47197	47197	61281	74567	36178	39619	50544	29289	45427	39621	40580	45715														
N6-(DELTA2-ISOPENTENYL)-ADENINE																																																																																																															1999	89	463	117	728	2171	2631	338	182	1011																																																																																																																																																				
NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE	40770	33057	29357	18250	17115	34229	38489	32420	41521	35890	36957	36132	30753	26728	31837	40707	44158	25530	23113	21017	21078	19326	24966	19454	18592	22422	29631	43039	33403	38039	47006	36309	34467	41334	53300	196100	202482	188155	164714	138630	188953	164130	157028	175000	113346	165230	167166	179445	204113	134790	173024																					81761	120741	59992	88284	55796	64615	69502	71828	49172	40141	41169	35935	46706	113004	87313	78122	96900	63550	64195	69189	66332	61325	66717	69760	85647	55622														98692	97322	99856	110422	98683	100614	111231	79575	104579	77881	205765	213940	175255	164202	181695	177297	159531								74161	67520	66911	84890	90336	77501	69417	91608	41248	42102	35309	48410	57183	56896	635107	905324	658697	1048632	570664	596625	505586	676304	741167	773896	538035	555085	686951	575602	696099	490271	429835	864846	515835	578789	430682	481356	516669	632176	424219	568007	446941	427631	455180	350241	498374	475602	471785	681681	1002102	751350	802226	825470	866903	562225	992348	625632	593400	1172798	1133183	1593915	1144186	1729919	64494	51087	62087	76139	28538	49615	33822	32952	32197	43467	62259	64552	54828	64888	75129	73938	279220	241819	215563	210817	229822	212749	167112	168403	189400	213031	170720	184151	205165	199907	207133	207960	232289	225092	195478	188673	158881	212831	197552	185341	198939	197761	184541	190225	167373	155587	185850	187970	234908	278403	161740	170120	181783	203044	178447	174772	170801	149884	16544	22566	24650	19493	15169	15417	14293	15524	13122	17440	17935	19920	15729	15254
NICOTINAMIDE	70302	33109	31405	51349	36340	44768	100369	103085	46500	43449	35092	37824	33768	78718	47872	51232	48611	11943	26031	16937	11961	12208	14140	4311	24740	10084	16308	14785	16175	5623	4573	12972	10114	13775	10180	236698	162991	793374	405691	265048	122383	423475	111206	350958	12180	496472	385237	408284	277489	244082	470662	282375	305441	427683	486154	278133	67572	150156	293055	247554	289399	500903	318163	217188	314927	405908	391334	618904	305042	355947	381061	84266	75353	101324	74724	302862	354616	237533	319905	315756	37563	45713	37625	36184	395782	100695	142117	108071	602563	767698	560155	561297	575480	111763	249532	228524	170380	299097	309552	314029	310492	530076	319871	447951	378208	353285	343512	421725	295509	259344	275769	369678	327147	475522	403252	411815	337472	190654	425232	281278	670817	688283	844036	708502	882290	912741	634071								456542	98941	127576	121833	94027	93460	121287	104961	94427	71060	120667	74665	38654	129504																																	394632	945736	816682	587601	760506	796705	1230415	694445	1150055	600734	789382	987354	754256	1356939	2076441	1308061																																													137176	104320	194939	190210	266531	304403	106995	116959	210169	212397	135987	177272	176258	187086														
NICOTINAMIDE MONONUCLEOTIDE																																																																								1059	625	505	977	16520	5657	11384	9869	10749	1407	269	1967	968	555	764	905	0	7321	3456	9622	10323	17398	0	957	0	1290																																																																																				2629	6110	8662	6905	2204	12577	5187	9848	13307	5866	31124	7707	7886	14095	1853	5320																																																																								
NICOTINE																																																																																																																																																					7738	0	2573	7432	1288	1487	6004	5614	2045	8659	3890	26149	13136	21390	31827	14431																																																																																																								
NICOTINIC ACID, PICOLINIC ACID	53416	26117	20898	233450	246863	251174	630621	268414	147991	100052	71109	92121	76381	96691	81430	77813	59566	451969	541406	544078	464795	434227	619580	451334	445050	399113	473558	971314	525166	446799	574304	402089	506590	849624	1060368																																					9844	16747	14248	10212	37867	41076	33452	38647	22610	306686	427201	316463	325693	69440	108538	121572	76514	110170	120214	107497	128261	94446	536361	506884	563937	684960																																						61875	88095	91809	75870	27246	33611	39568	30379	2953984	2328745	3377901	1306466	5235034	5218988	14340	29598	38445	23163	408930	515069	463822	613157	689765	497918	540450	391388	237979	415402	474417	321445	105918	81809	47724	48860	690860	1303077	1031582	1238099	856696	754848	754890	952991	1083104	1082025	1302213	957750																																	0	2505	0	3162	107078	79036	106053	114713	154379	60333	104778	71827	90707	77792	18817	585	15846	18263	151196	174180	171250	220386	184318	162267	208251	187016	139775	186919																												
NICOTINURIC ACID																																				2061	2201	4826	5328	3710	2630	4236	2193	10934	8103	9512	5711	8664	5922	4318	5146																																																																						5960	6637	8782	2220	11943	29968	15134																																																																																																																																													
NORADRENALINE																																																																																																																																																					60051	65535	70132	76200	69912	61688	82660	70826	63220	72800	73907	28098	27818	25077	34590	25968																																																																																																								
O-ACETYL-SERINE	107387	74928	24436	190920	184658	236470	295156	269622	108019	80034	63380	79208	72479	81815	73428	89726	106640	190875	202528	193390	164851	127458	188186	166228	165156	155777	147431	281732	181792	175121	230036	124522	182747	329842	469671	3720	437	4643	6638	31477	11669	7340	15680	5659	600	1530	3756	4277	3992	3636	3726																																																																																				510552	237779	310118	351964	343887	253115	333755	333482	684	5603	4163	271896	5358	4274																																	42019	43491	60373	50353	55681	73781	58419	49712	63507	67244	66264	85345	70335	63550	69825	56554																	340609	391780	229014	279212	509663	333501	384169	338870	357101	11618	46396	9260	45429	51283	334730	279632	329537	331339	354376	482638	506123	494809	440791	41429	65597	43495	36831	82010																												
OCTANOYLCARNITINE																																																																								16975	15416	14734	17609	12136	14644	11790	13955	15067	7030	6898	7920	10523	15654	14530	13894	18435	9437	10692	11793	10605	13442	6708	7202	8221	8704																																																				40049	49266	29393	58376	45503	34025	49661	51604	45891	49165	36545	47951	45478	38069	48880	39362																																																	10145	13588	10054	10873	11125	10333	7565	10094	11289	15489	8438	6806	7792	5557	7582	9048	11264	9554	9541	7526	5239	9747	8571	5518	5849	6472	6353	6949															10714	12385	12014	11996	15448	11850	9370	10627	15055	14512	12182	12956	10810	12845
OPHTHALMIC ACID																																				11903	6252	14072	11910	8669	5720	13791	4075	7494	2030	10929	11402	11885	9175	2007	8930	4254	2916	3313	3009	4931	3831	3728	6236	4243	4461	9265	6506	4309	3547	1921	6707	5784	2868	3401	6775																																																									12868	12522	12655	8156	158542	211414	61323																																																															13136	14110	9920	10930	6543	14924	18569	12629	42195	13208	15130	9800	7717	14520	15030	26680																																																								
ORNITHINE																																																				23337	13678	11174	20459	11412	19790	9955	15507	17352	14591	22917	22073	14182	16299	17155	14203	22592	11872	14452	12908	7456	9970	4120	7856	11726	13725	10449	6774	6868	2068	1827	1742	1078	18107	10535	11368	14128	14476	29251	28663	21008	20783	6921	3246	3166	6358	14754	31195	14427	16666	34959	13630	22621	16667	14414	14577	33515	12855	10229																		43140	50564	58624	46632	32623	29896	19701	41	613	1173	6980	592	3604	3969	4740	8401	3432	6955	34754	10360	72906	48375	94940	70150	66649	82902	79448	86508	84867	107696	103792	75617	84155	107398	68897	104751	44141	43550	86701	78732	74506	60125	73184	80036	101367	76872	78174	87806	53419	40567	43047	57162	42086	17659	24850	65867	27412	36683	38358	59000	67403	69475	43231	52200	183583	207013	336918	127684	177811	148191	416636	157411	148830	169007	243430	164779	151050	129129	157043	169592	111893	141135	121618	91253	108593	16172	9667	9200	10327	15675	15629	15903	14570	18905	13973	9404	14134	12670	12065	14574	9527	20188	15508	33709	13211	31013	21301	22533	24946	14972	26883	12015	11867	2222	1990	2615	3209	10138	9402	8788	3698	3980	9440	15000	5735	6401	10934	38545	17533	17049	14824	19175	14917	15498	20941	20704	15984	16043	15047	18402	16688
P-ANISALDEHYDE																																																																																																																																							378027	47953	64787	76360	109915	75953	78126	111235	1576151	2184704	838861	505414	1085722	3715323																																																																																																																								
P-COUMARIC ACID	750	805	356	2247	1622	2672	5157	5041	1262	1053	1241	1680	567	1604	1318	1437	1063	2922	3766	2778	3895	4003	5198	1974	3904	2638	6283	5977	4774	6856	6200	3445	15369	10345	14267																																																																												1813	3033	3230	4808	3853	3039	3661	17197	33969	14836	9332	10420	10137	10894	18351	29589	18844																																																						13747	12346	17593	13030	17756	18556	28617	19655	19028	18424	24994	21211	30191	34194	28363	27167																																																																								
PALMITIC ACID	31732	9244	29092	16257	19042	9877	17384	11913	33907	24613	26348	37206	43764	57253	35547	21725	20079	62303	45134	58832	16941	56861	53380	73262	44957	75465	56052	46123	41002	69571	61194	57560	39392	54175	79818																	41100	28140	67583	67052	44868	21868	45156	28591	26692	38182	33746	29830	13199	35613	37355	29105	45460	50747	26421	32015	22360	19585	31811	19759	16935	24174	24270	23064	16076	23866	32786	33022	30978	59174	35523	47280	37176	57449	58698	53050	60485	60550	39321	56627	47072	43522	143125	129955	110805	102315	97592	74460	91711	49575	39613	67068	68073	70115	69293	15373	14370	14308	14267	15097	13244	15154	13573	12462	11858																																																																																																																																																				
PANTOTHENIC ACID	20267	2369	2301	38099	29536	67123	100536	74929	14718	11206	10377	20226	16519	19942	8701	20598	7511	67207	76005	84119	57871	43612	67730	44088	33717	32785	54269	118069	59200	63450	86864	43027	109953	149553	235290	286892	222167	464155	397114	287972	250131	368766	191264	409161	70670	406628	308874	429750	357695	207514	365111	25131	32019	40044	34168	28730	25639	33787	29376	25136	28390	35483	34558	17943	16526	59604	32632	32178	27750	43092	36367																											29172	29341	29758	49163	44075	59688	38676	44963	38612	43580	32838	29928	37049	302049	300420	337528	577091	340124	352495	421890	250144	489360	274801								138537	110198	107408	84412	106843	95954	86604	48477	33868	35611	40116	44167	43178	44064	42386	469701	890606	554299	258620	1241099	805799	50109	49588	50150	59212	53576	48261	46863	49039	58742	57019	36755	176620	112667	131387	126037	77635																	291021	473513	921594	632205	971266	1081268	1756696	731549	988800	748520	1192154	915173	1101331	1034357	1396534	974026																																													136313	90775	217803	259250	382481	369911	162090	123421	210775	243297	225614	182728	152643	236489	31761	30028	30326	22868	36874	42321	35733	30060	34256	40525	40124	31522	40787	29948
PENTANEDECANOIC ACID	0	0	0	3536	3341	1176	3904	2943	0	0	0	0	0	116	0	0	0	7742	5650	6571	2225	7218	10121	4316	7124	7139	2978	9238	2752	6568	9514	2707	8102	7148	6529																																					1517	591	219	273	2234	4427	2947	2763	4025	326	625	542	1064	532	1662	297	354	17171	19825	16992	20229	21971	210	187	193	1143																																																																																																																																																																											
PHENOLSULFONIC ACID																																																																																																																																							0	0	0	0	0	0	0	0	33805	40001	30529	36572	33573	36651																																																																																																																								
PHENYLACETIC ACID																																				19328	20476	32446	40825	39405	27892	29240	26018	48708	18352	71897	52638	60270	59183	38969	53495	34899	24078	38897	38155	27947	14510	17912	32559	34851	34405	35436	37626	25413	29917	33069	32115	38046	20620	21056	37370																											58647	51513	39428	56705	58380	61151	51227	52449	36406	57937	41350	50338	55063	43593	38713	55371	40496	35611	36612	43028	20871	30122	19857	97715	102181	81501	101873	42221	49640	40366	130925	124093	110495	84486	143223	183577	124581																																															36402	44491	54380	49933	112792	111386	178247	120502	129703	127656	187973	105691	145871	154371	167703	114795	207678	209321	225270	194735	205369	161856	194655	193771	141244	244592	211276	194425	185925	183828	176279	122404																													13692	10586	25000	24969	50591	25699	20821	16555	29524	20017	31619	24811	21531	26286	63392	55219	64341	87848	65183	68781	71273	59299	57606	73017	108747	61915	77589	61666
PHENYLACETYL-GLUTAMINE																																																																																																															2714	5368	4969	13419	7440	8539	11468	8963	11629	9721	11549	14465	13180	11187	32912	41202	21120																																																																																																																																													
PHENYLACETYLGLYCINE																																				1392264	1025903	1772955	2925048	1839005	2013222	2802428	1256171	2197914	530139	3033010	2646388	3597865	2957150	2407887	3080724	57470	37185	51600	25793	62926	24278	50344	38562	61405	25600	34070	51642	21309	51549	54391	26518	36044	32462	54212	51828																											41628	27700	45943	52356	56180	42987	52716	51248	35148	24577	25687	25026	21278	1586010	1767343	2103669	4214614	2429970	2517725	2763520	1303027	1907822	1385542								132639	107967	91352	124707	527765	372037	293767																																																																																																											580326	452946	901112	966059	1380208	1455927	632187	578005	986095	964168	932372	875850	769872	911738	24713	33679	30017	23743	21588	24333	28238	20963	20750	27618	29219	27435	24562	29835
PHENYLALANINE	3912792	2294100	1159413	4015013	3861476	2705694	4031548	2844322	3889648	2227542	1720051	2729541	2069608	3457854	2664092	2347581	3485464	3540560	4412344	5758340	3715059	3247596	4265309	2735739	2971314	1970832	2633410	7747952	2329238	2828192	3290036	1532943	4134651	5656610	12726131	103532	89366	180819	153035	125180	106736	127257	88540	213470	77697	146145	165771	167968	183881	103541	137405	5213136	5163299	6082990	9231718	4473202	4029220	5041244	5078796	4912476	7350707	9913289	5732422	7914858	4339612	7331074	8464541	7977354	4866330	6804324	5897064	3310683	4488422	3390756	3200433	1612722	3536475	3959895	2936999	1702529	2953950	3009837	1423325	2334577	19129402	6282080	8334197	10994675	10694814	17423086	9536459	10304487	11674802	6423274	11832377	8825876	8958778	6340298	6486168	5674929	8139012	7738948	8800769	8503008	6901801	6385125	6557182	5942962	6219424	6260140	110980	121249	132501	138578	123740	112293	125112	89728	148456	71231	381656	386183	414790	454243	480628	607553	411501	16300069	14266929	14272416	11658884	13442452	14562576	12318841	22533322	6953712	8671636	11338813	7235732	8173586	8748860	7697673	12659154	15717201	12258092	12153089	10362946	4835574	24587332	38310130	31060422	31533384	39209812	44773022	39108708	52634554	61138521	72563842	60746231	52646701	75035102	56531380	64881114	45210724	29676404	53379620	44746112	47319936	30304246	56193172	49946004	34626544	38601396	41533032	45664672	55212868	47920388	29587064	45504180	44617264	262260	476697	834068	653338	758445	820655	1260018	708129	933060	647167	1104760	795498	985890	885810	1151928	824721	32836078	34261184	31491562	31947686	30451642	32950782	32584262	34634816	32507102	34177780	33528082	26083248	26041564	25301300	28744730	28691488	6675001	5371162	5985513	7133511	13966124	10788738	11461029	11604311	16446767	6705100	10676700	7523461	8888935	9583034	14834838	9866164	13085461	13276170	14945403	18793522	16731199	17949028	16969426	12239859	20190882	16428112	19650655	21700425	49142	39208	110557	100147	188309	217560	81315	79171	145230	82263	104853	87823	130086	104415	7887423	7635033	7827014	7244115	8520610	8361280	7482085	7708389	8889912	7812490	8248900	7715698	8194085	7733262
PHENYLALANINE-2,3,4,5,6-D5	1321823	1884472	1485628	1459766	1652077	1836095	1234869	1796451	1434103	1831957	1304462	2010265	2118773	1795013	2047084	1391453	2075710	1994495	1863654	2076479	1322994	1476056	1548485	1327889	1529445	1515918	1708265	1538362	1712215	1444510	1386258	1278854	1633026	1501194	1426591	1723236	1685614	2140808	2565770	1893250	1858847	2887482	1926145	2403035	1709875	2743275	1909065	1935432	1848124	1691727	2087178	1608176	1892041	2609719	3127948	1581236	2856547	1943253	1765097	1652032	2653776	3418516	1930006	2007772	1542969	3201883	3220006	2846374	1909218	2792192	2215477																											2220794	2166109	2164498	2266655	2289988	2595090	2881352	2343353	2257223	2226584	2164297	2223681	2152153	2111188	2098280	2068706	2150605	2108750	2066140	2069770	2079143	2026575	2034186	7052564	7043870	7145766	7323844	7293154	6380834	6674182	5096072	5883176	5093111	5429753	5177187	5030934	5231272	3193613	3852722	3623425	3325908	3516053	3557358	3379692	3666380	3137857	3186551	3068096	2815881	3106555	3305888	12249927	11716470	11426250	11159622	12114866	12424091	12041261	11718739	10902662	9868431	12108259	10782695	11027002	10962059	10433392	11032909	11374661	11009132	10855177	11072132	10723318	11058919	10746578	10526723	10764390	10635178	12286721	10870518	11391342	11674846	10384235	11695718	15295755	14798095	14667502	14384432	15163980	14983257	14752656	15209493	14564282	15231757	14942350	15004560	15032319	14710381	14819552	14619537	14119238	13719853	14172359	14094190	14202884	14509126	14185662	14240624	14157934	14037829	14071626	14471709	14639282	14607198	14480878	14245415	2452398	2410786	2564882	2451833	2204105	2408382	2321394	2511280	2294308	2070458	2333534	2413151	2369086	2042544	2389659	2422501	2326965	2343846	2223229	2276764	2356709	2260040	2284707	2455893	2260484	2231391	2259058	2157446	2223344	2309315	2424396	2520388	2679565	2665988	2826632	2903127	2868289	2618640	2692502	2704093	2745973	2790607	2833279	2827000	2877361	2935391	2923837	2894914	2993817	2962350	2950449	2953479	2946377	2943809	2962125	2912755
PHENYLPROPIOLIC ACID																																																																																																																																							4924	3030	8953	12574	8563	10502	6901	11006	0	17	1231	477	152	421	20230	22094	22564	19148	27863	24208	29671	26577	26357	27994	26665	48442	44644	36548	33920	36557	16384	18924	11682	15612	21614	17355	23791	17710	20932	26549	17713	32224	31565	19584	25013	31880																																																																																								
PHOSPHOCHOLINE																																				6078	20200	5599	5973	15448	10134	4204	4565	4244	4279	5593	4515	4043	4524	5017	6317																																																												6211	8583	216654	9228	8702	11243	11968	12295	8570	7218	14272	14011	16466	541708	8805	22094	50403	12530	14443	16990	15957	13296	14356	11731	18413	12213	9941	15494	11964	20088	20455	11525	20051	8436	14323	39074	15632	27411																																	19984	83549	73340	37669	48911	978115	80750	56195	104902	117578	115114	64855	30853	64033	79931	69133	19857	35131	22334	18236	18600	25257	16791	16987	13390	17924	20753	18226	19805	12685	11369	15568																													6361	21240	5197	6342	21248	24944	38017	11390	12060	46847	7112	9792	58666	60055	10268	7514	8199	6839	8587	7586	6614	8080	6785	7141	7099	10860	7158	7358
PIPECOLIC ACID																																																																								16003	20052	79249	25508	110772	65072	76098	89804	139730	148351	170707	177070	169442	49644	16243	972	48917	89775	48212	85599	133475	85135	223903	181770	212601	154922														84661	78613	65754	19471	88874	65333	77909	90196	15396	72564	214604	227123	186685	188090	269014	401142	219185																																						307312	375566	243107	391752	246301	315453	432262	191022	159834	428611	151169	578917	307656	501941	921652	315240	811722	1207852	1746949	1344232	2305885	2195197	2489893	1754422	1940132	1808798	2089266	2326540	2736054	4099563	3043922	3231734	335168	318276	345474	310173	298549	253708	268599	284544	324833	441933	312690	249542	268207	345283	288770	312027																																											48143	53790	48248	43023	34937	40035	55053	46480	47861	62795	53797	57201	50397	49293
PROGESTERONE-D9	1410581	2443255	3146062	1402374	1359831	1573983	1436143	1626738	1548226	3028102	3475353	2242055	2556886	1889031	2245932	3331964	1147114	1911298	1342150	1821068	2692889	1630688	1476236	1471548	1574481	1636559	1648426	1546678	1372011	1558058	1467463	1936574	1753214	1634533	1553245	3806361	4035340	4805124	4267694	3294196	3501972	4083050	3311217	4531060	4168070	4309650	3194679	3920063	3332104	4037243	3620072	2293935	2388007	2424200	2093647	1853634	2784038	1977367	1679469	1402458	1400662	1669913	1269582	1434027	1415253	1901447	1485300	1350926	940316	1723485	1373984	2448832	2401512	2218664	2415118	2575742	1895839	2264026	1966610	2370654	2090659	2016401	2047285	1882650	1779268	2066805	1925572	1980628	1853502	1772529	1894244	1833469	1855396	2077943	1994359	2051642	1948181	2051966	1911331	2012844	1974092	1980567	1628134	1730502	1327387	1040116	885504	988640	951694	1033959	2716694	2824540	2707476	2767157	2881322	2897460	2751800	2877949	2728950	2883897																													1104164	1047759	1054744	1085003	1138147	1149695	1091308	1108402	1040015	973121	1152736	993226	1008244	1013199	963013	1013203	1146232	1138745	1113805	1150497	1060690	1179789	1094392	1219276	1172269	523371	1287612	1147980	1169562	1150972	1111407	1213590	952618	950826	1006874	1012829	1054430	1077640	1388115	1397125	1329285	1393429	1446413	1463738	1442288	1487336	1506270	1478714	1279018	1239230	1293448	1269067	1174131	1135202	940386	934595	864238	864120	852739	839587	858968	869559	922464	824424	837648	841889	865938	793694	784883	802648	754268	835597	784099	755224	785086	784790	809959	666726	486749	456065	443812	410133	574370	640563	751468	807930	856734	454338	432890	498673	527313	536360	868593	782661	1092012	1169673	1337478	1291617	1375657	1412132	1413786	1179944	1160578	1363856	1337864	1356968	774432	900211	829560	827149	570538	586830	605632	582750	443417	876615	875371	861438	816440	771982
PROLINE	3823426	2991347	2350647	4893221	4774149	732027	841407	509829	6520803	5806447	4685616	6566064	4836136	4705286	4981974	6128652	7013422	7041502	6622000	6941396	6964141	5450610	8025670	5001582	5801614	5823014	655703	1792738	689914	526255	936331	457741	814969	1442180	4224890																	417432	307642	313913	593573	340272	462744	218542	445880	440913	426923	546669	590887	494719	364897	611650	459401	583465	344650	550254	316721	2784455	5880755	5657482	8347744	2665636	5326116	10876835	2839493	2340953	658336	427389	335600	451965	13942258	11151231	10746692	13201114	16793152	17427700	19603684	17218468	18137968	864841	1138400	1051054	1090047	450777	389485	374185	670261	417466	577003	412664	566291	438525	437925	343853	340502	315526																		953280	604591	716279	655695	381105	620173	337055	7405168	5333121	5368798	6756126	1561607	3618307	3668354	4254050	2098584	1545287	1632930	1714339	2102093	1373401	4183455	22851506	21960526	10702532	12646272	22475174	23299156	28166636	32746462	32063718	31487594	11954159	14459630	14893910	9146747	8542303	25867962	37514580	28161442	34703764	37932960	36160732	34934876	35389460	38667064	33051942	32241378	32790042	28756948	31451756	7713133	34137832																	3232189	3574188	3454912	3352393	3486511	3495079	4155248	3352978	3902225	4258301	3930218	2533212	2789074	2482290	2894256	3075344	644492	2026470	5534020	4601141	5684304	4145858	6082740	6397644	7059998	786659	6974206	4686212	6296710	6877960	6513628	5885124	7423042	7014221	7682517	7646548	6958400	8056476	7696065	8628817	10043074	9745794	10452110	9874576															392524	380086	335195	310626	374484	391544	431718	396667	340146	362256	463732	360678	347132	345872
PROPIONYLCARNITINE																																				6781	7751	17807	9160	8554	8195	10360	6631	15206	2497	11853	16041	17561	14834	12254	16547	107355	130423	101533	241932	152821	141461	53215	123535	101624	70688	150863	205277	104792	159242	108372	110112	131826	65445	118845	99680	11118	9942	7344	9620	81348	71789	55617	75365	77107	8257	8644	9855	6190	1812	5008	4715	10547	63015	8129	62787	34674	60261	9914	5716	6870	7171	161054	75814	88864	134205	101266	149725	114907	229177	128660	129111	111245	67589	73851	7289	10664	9622	7292	6220	7358	8187	7316	8256	4438	22924	23898	32931	10195	38471	41480	29155	985009	937344	779843	620986	746061	655812	520651	24020	6266	5533	8576	7555	8902	10755	8047	28651	35389	41370	28203	68497	63112	49813	46102	38792	53548	54570	42848	55518	58660	42436	45589	47078	22910	20997	15164	15995	25066	46245	62394	77926	67104	49131	59453	54169	55317	59799	55055	56351	19293	19700	18365	13787	8922	27346	22725	79644	40461	78468	97208	76575	60172	67243	30297	85290	80648	68909	50988	96803	62994	1597846	1821490	1957760	1091670	2663144	1578407	2307351	2335518	1433565	2064886	2727948	1102998	1791607	2246572	2302131	3743494															3772	5356	5346	4215	4045	1163	3172	4781	3380	5055	9549	5755	9218	9191															135478	146742	166455	190991	111271	90553	126042	118275	218087	114966	149784	125521	191720	167146
PROPIONYLGLYCINE																																				8653	14095	45224	32083	41690	13815	20136	12337	51319	14108	30857	55847	68420	42356	19077	40769																																																																						55175	59221	32483	13574	90761	88550	44256																																																																																																																																													
PROPYL GALLIC ACID	5538	7454	8091	6504	3128	4418	6424	5079	10650	13155	30944	20389	20725	22418	20935	34692	12902	11684	19979	6994	9859	16303	23304	3992	12631	11279	8086	10084	16418	13493	6620	4178	15822	6147	6678																																																																																																																																																																																																																																									
PROPYLPARABEN																																																																																																															11853	12426	15281	16769	11958	13143	13454	12975	19706	13431	101969	106385	113122	184335	194691	226479	176817																																																						19834	25313	36600	35571	47606	40177	50066	45823	47425	38087	49921	49761	50952	57199	54122	48289																																													8604	6548	15764	15007	25333	22325	12366	10016	15988	20689	17772	15094	12532	14717														
PUTRESCINE	0	0	0	27446	20651	2872	2738	2065	130	0	0	126	0	0	0	111	135	16737	13827	15498	25124	22692	22028	17756	19668	21464	1850	3345	2456	1717	1983	1412	1482	1969	2324																																																																												13434	17096	14570	25022	21522	19955	19230	21424	21136	23580	743795	710125	693945	703404	454394	462117	457509								2003	2560	3523	3700	1575	309	3357	1599	18034	18649	18014	399303	19595	25984	22775	23466	19019	37022	42609	33074	50878	34925	28359	49494	22280	877144	716479	684018	774834	566386	23557	24724	19241	22146	36051	36816	32889	32247	43936	52203	24919	640271	475014	443400	535592	605982																	46057	36933	36928	36774	69594	56481	79105	70063	45737	39619	51850	32972	40182	42479	42891	34788	3270	2758	1893	1997	1670	2195	2051	2692	2658	77559	41679	56254	53503	43552	1829	1655	2014	2045	2712	2336	2033	3156	2497	46712	49125	57906	54505	47678	70529	63929	91726	92734	121484	121831	73468	76196	92530	103234	80835	83692	80296	74443														
PYRIDOXAL																																																																																																															2429	2460	4627	3894	5427	2310	3088	2636	3284	2119																																																																																																																																																				
PYRIDOXAMINE	30757	24975	18527	22377	18318	22929	34381	18941	40664	31879	32651	36455	28430	31119	27672	36755	39620	22659	24495	28281	22525	18442	22481	22262	19812	17393	24925	66086	30045	31134	38387	25043	26505	44820	64106																	30899	34994	30483	38761	24588	32598	31817	33347	38829	35011	32309	32693	22652	22885	38788	31264	34186	33163	37611	27007	41849	50436	30465	38675	22435	29972	32182	43986	35166	27865	26958	19148	26420	145927	56259	63559	79700	66156	88654	62993	63651	68828	46480	65628	64324	53712	33646	32976	37063	40433	30503	33157	26032	28528	31021	28538	24116	27256	29955																									205501	64599	73042	93075	66610	56193	52838	59600	93367	101366	85497	35993	76403	37539	216469	369205	289153	273605	286556	298123	323645	343386	380784	360255	254213	306828	317251	320448	343117	251702	225173	451964	384740	435369	258253	398474	407134	514293	357496	396127	365976	375685	423886	291014	443226	371990																																	89497	75856	79825	94759	118581	96414	103513	99270	122305	95293	102816	95171	112041	109905	153125	107086	132690	139094	144618	146476	123080	159467	131598	150940	210306	168323	183511	197231																												
PYRIDOXINE	12749	4978	2917	13449	15620	10753	17429	13048	12104	6943	8450	12127	10129	12206	6658	11048	9118	14060	16586	16114	13756	11380	15061	12207	15885	14015	13107	21524	13907	14358	14447	10403	13570	19370	24442																																																																																						21785	25640	30934	8702	21136	13771	19734								22032	18648	18334	19713	20912	21212	23354	23461	67466	76485	89298	127922	102007	129347	106502	113054	52937	118822	88088	127024	90578	89813	112107	93222	79435	140670	101765	75454	102649	55505	115985	113757	75380	84434	62632	104500	109836	93006	131196	123552	108790	149370	121951	91765	118425	80841																																	20800	17296	14192	20444	21913	22233	13684	12871	24325	35264	25627	19705	22982	19675																																										
PYROGALLOL																																				11681	3457	14789	14121	9737	10781	13223	8071	5424	16650	11572	11086	11417	14014	15335	20898	29995	36168	35652	51976	30289	30434	37575	23202	27402	33400	49732	33379	23876	28787	53002	44097	40330	13423	51834	29016																											24094	24969	20337	33801	34908	49512	38554	29519	38465	31048	21682	29226	32334	2655	9751	2430	19339	8697	3720	3921	16969	12769	3381	5674	6129	6325	2718	48457	69939	31817	150924	127700	137154	102417	145057	123944	143368																																																																																																																																						
PYROGLUTAMIC ACID	104680	50536	55522	156329	157546	106936	360242	267498	187517	131793	109663	115688	95774	126350	133593	149065	143131	262593	286741	288378	296251	255471	348260	221463	239034	215770	250184	384994	291163	286627	280692	229542	345657	460909	515808	231743	199593	381718	372857	322849	315229	321041	205080	364888	105136	423312	414204	483014	430012	229376	436275	422445	432736	683211	931981	429688	263797	479565	460796	415041	762934	1128970	487776	566741	427755	909946	1052057	903688	810419	753114	667533	50400	54957	45408	60297	50702	77267	59246	56054	60776	45572	92809	63054	22888	121999	158022	138757	148441	95344	111307	99635	99538	82092	117761	110250	142088	107539	345027	339009	290918	377366	395581	422955	441576	321310	336364	373127	324908	339509	338719	248995	226798	181665	172425	242834	263865	287521	177883	274053	159251	570673	540769	499039	71521	162605	0	119759	376413	330029	335059	266006	315838	321227	247933	151889	190024	174627	164911	64817	82820	74790	79916	165042	172515	149854	84289	209792	138485																	369081	559202	355390	284638	369956	502529	411243	585986	451481	517526	401025	568087	610888	637698	632731	779390	357162	486104	681690	601866	847602	939272	1005343	761465	818385	688221	1056692	836246	894981	1028528	1171482	812380	478122	521819	454202	445272	462818	515248	489339	499231	416790	475871	399603	287892	297869	271809	291016	308040																													55289	86442	131942	120594	176237	196199	134568	129523	175340	117053	169384	140893	145963	176939	37568	22794	26768	32225	27903	33581	26544	28509	27598	29010	32920	26514	29498	27357
QUINIC ACID																																																																																																															8460	9331	5005	2254	7733	8213	6412	7679	1442	8021																																																													10243	17587	18038	15692	18313	16501	17476	12297	17370	15140	15736	20326	25305	13821	12196	25030																																																																								
RAC-GLYCEROL 1-MYRISTATE	716	1575	2013	978	1986	897	2830	1865	1975	2304	1586	2970	1575	1385	891	253	1792	1003	1441	2318	1194	4471	1536	3428	2236	4629	75121	1415	1047	2643	5541	9498	1236	896	5975	65730	17689	49302	75262	93697	69556	57691	95055	27719	81712	79339	84984	78812	80101	74314	79869	30353	32607	30759	20177	24422	33793	14134	15193	10039	11951	9101	10494	10272	8967	16974	11127	9414	11707	11881	9158																											10540	7822	7162	6559	1834	2664	2728	1403	1084	2440	1534	1826	2396	8095	6821	6764	4866	4898	4806	4966	4893	3881	5148																																																																																																																																																				
RESVERATROL																																																																																																																																17570	13363	11236	5429	15269	15452	1256																																																																																																																																						
RIBOFLAVIN	2519	684	277	8072	1085	14779	7152	12950	1707	559	1299	876	466	349	1222	457	1287	3958	5062	5315	6486	3787	6487	6473	6391	6102	10000	26575	12124	9478	13222	9768	28828	11823	13535	3321	1587	8482	551	405	448	5636	291	6432	297	2669	994	6086	3838	1841	4059																																															1118	717	1168	2418	1512	1564	1258	1337	11702	1394	6597	1620	0	15963	1714	2302	10149	10706	10858	17316	11282	23336	12890	101720	104026	100457	69209	299129	225183	189072	27397	25576	24528	15482	6285	6423	4029	38998	0	4248	3487	8325	5541	10745	4547	247057	415795	355997	100326	476694	131967	0	0	0	0	13268	37445	62906	56305	35376	268298	15369	276064	199142	87796	71006	34723	0	0	28203	3607	33909	108173	114421	131265	303942	305953	58038	186475	166381	107052	93810	101320	66794	206581	98164	57179	150654	122405	140866	29445	61892	29518	111890	58139	144129	61617	71423	266346																	2624	0	3362	320	26658	26954	23828	11459	18358	22464	15196	19027	19916	18923	12156	1281	1574	2178	20008	24347	28401	23920	24498	13869	25421	27038	23446	30882	42451	29645	70265	93134	102201	134207	70443	53240	92616	108086	104162	86418	72313	107590														
S-(5'-ADENOSYL)-L-HOMOCYSTEINE																																																				8286	24221	4062	14488	14147	4065	4070	7923	10674	9500	19113	46128	12830	10263	8876	17478	15897	5585	9205	7386	4522	3554	1845	2160	25273	24324	19065	29326	17875	1554	1746	376	627	2087	1118	628	2353	25725	17375	23068	13486	17113	1052	1056	1717	261	13467	4477	9348	11167	3315	39598	5533	44978	10863	12468	8980	12445	5906																		25155	26266	16878	15531	25974	21962	18186																																																															16796	13816	13523	16690	16008	10688	14557	27599	36252	62772	31337	12387	15897	35668	57120	72880																																																								
S-CARBOXYMETHYL-CYSTEINE																																																																																																																																																																																					6560	11676	12053	13006	13868	10065	15918	9722	13112	10278	13736	14984	14315	10987	9092	4463																																																																								
SACCHARIN																																																																																																																																																																																																					1737	1043	916	1531	1905	1668	521	1243	819	1526	2005	1303	630	2000	1546	1450																																																								
SALICYLHYDROXAMIC ACID																																																																																																																									48838	47969	47079	51957	32555	30146	28567																																																						37949	52448	68520	48411	64230	66847	76757	66676	64385	50546	66664	45277	59436	59007	66306	68819																																																																								
SEBACIC ACID																																																				78869	42339	99009	119794	60943	15991	31001	66747	68114	106522	86373	77113	54798	60779	85850	113076	105614	61706	45825	82534																											115800	116488	68595	136967	99845	107011	89522	79764	56426	85249	83748	84457	112445	4236	4329	5097	5781	4111	3716	6403	3028	4567	3236																																																																													73821	79961	70031	65640	61067	50159	59681	52254	50155	64098	61500	46754	46336	40303	43436	31482																																											47725	40074	44293	44332	41324	40391	43703	36429	43119	43475	46119	39541	48624	37518
SELENOMETHIONINE																																																																																																																																																																					1007	1530	0	332	1042	614	376	754	1357	892	833	36223	44701	55448	34633	44443																	68024	62559	48577	52437	54901	23286	49765	42942	48083	22725	51481	54268	15885	64122	48764	33220																																																								
SERINE	185070	208916	174921	192653	135607	229577	152936	200426	171882	195380	198891	217393	207621	191712	245592	251536	284176	126674	128269	160513	139100	151171	93549	96492	102734	88784	144281	178129	122774	148182	188046	110064	131322	111291	164335	4475	6697	3909	5518	6875	7762	3826	8263	4030	11098	4852	5868	8248	8225	6734	5922																					341944	556637	308471	454078	192134	205770	201906	183110	238582	206474	177808	137395	171272	719908	458350	462588	669638	229455	288699	208618	224082	272022	206279	309466	255843	272291														5967	7386	9352	11637	11567	8308	8642	6619	7080	6363	16542	15826	17747	22286	13725	12157	13049	19743	18098	21001	23993	11783	13683	11606	990003	620555	620241	956942	558209	779805	542440	725756	470181	432571	380911	440317	289272	253519	1956932	3442845	2557659	2765382	2923988	2960124	2687063	1815916	3331026	4184316	2726725	694501	576347	604770	734792	615205	1643758	3004556	3044311	3253114	2026662	2625624	2974040	3625828	3824412	3464125	3364203	121155	512332	278314	517203	563414	36699	51023	48796	49269	59791	69400	63311	55064	69290	88598	69038	83119	56387	69323	55885	58939	43492	46654	42653	46802	45945	40643	43815	39551	40565	46525	38567	45720	38268	37567	41121	41417	522965	363158	338051	381959	519544	464044	432210	355078	404948	64638	94070	80875	58320	84965	473040	432859	498150	513821	435682	475815	440934	468166	466978	60532	93762	64138	74639	118671	8860	10091	9771	12180	12282	13886	10948	10766	10475	10992	10685	9424	12236	7597														
SEROTONIN																																																				216031	139019	276263	236981	376965	55585	255316	147028	156389	186983	190910	163555	208072	283957	210969	219007	251963	84563	318992	214941																											123507	55996	342316	213197	291817	153394	157296	164456	73595	176178	242319	185403	65314																		88727	17008	57914	174989	108746	1378	143251																																																																																																																									196657	281104	163562	127543	273296	209015	196965	228740	236962	307769	278996	234442	258210	233162
SN-GLYCERO-3-PHOSPHOCHOLINE	179631	129656	76407	173157	130620	220634	332371	205308	89849	88088	71620	90612	81480	101581	98809	95054	114817	72962	103695	152340	96041	80897	96151	75200	126432	63223	111112	605864	160301	130880	224865	95921	129027	297339	725125	19780	21368	19423	21036	28048	26584	16724	13493	20779	8244	23771	19321	15403	24968	15480	17996	143534	99789	66224	63122	155958	69351	102275	124393	119355	46061	31709	132960	120648	123837	51118	39237	51589	54585	64290	96321	102278	82051	115901	78587	83791	214191	122747	197138	171785	125878	130173	132131	165756	225164	90018	99188	78574	145878	272329	136162	127404	139902	145435	225277	166955	158157	231055	304148	268988	178700	268217	265318	211808	198276	178813	214819	199352	227276	293367	26228	32895	209602	27555	26896	29972	35205	21931	30146	26034	68556	61561	76660	493869	40490	25149	38516	246498	302469	363298	310802	310693	315639	282701	1009024	193409	233293	148193	375870	284194	566583	344139	147276	60961	72567	547964	63605	120476	533394	619714	696898	434636	446095	491132	434257	526410	533424	508617	560899	580362	682192	484006	591375	527118	381439	526727	941274	583077	320974	740811	757537	874340	546009	702122	708224	423935	499483	311978	435253	398149	71258	104111	176484	88672	118515	250839	168813	140578	214735	262662	189194	194250	176953	198322	248809	89084	681996	472763	678287	807424	674531	742854	564832	745927	329497	620654	591439	619325	616993	351285	469499	339131	147614	193458	219741	243607	191125	152502	236875	277884	307099	206852	165028	183411	151803	192570	234710	107233	111136	100506	140774	94949	115486	160788	118841	109173	162217	104188	72364	116053	25736	19033	26270	27859	63916	54267	32679	34501	44626	40259	35395	28911	30361	25954	154394	203608	219168	183603	213731	179614	174705	162661	121395	182619	179820	226606	190206	198642
SPERMIDINE																																				4426	9254	25361	28051	13692	6783	12592	10708	80247	20109	18255	14910	19721	27036	15167	3244																					47171	45772	38949	52548	412740	268583	199647	181425	296911	103495	115512	64452	78255	46749	31078	29886	36701	208979	344512	250795	263933	245941	79159	93550	87707	92540																								168968	162083	181274	120261	58651	188916	196716	17171	17507	14549	35721	45252	14920	41978	85218	34926	36413	39851	68747	50717	26606	36634	133702	153863	160925	158245	259540	256022	153953	127508	131695	258989	376979	186909	277640	244889	179971	232851	193715	267874	155136	140687	189012	116843																	101918	155521	470907	205449	193751	425095	320760	201381	370820	180363	1256381	136780	204061	118154	239877	100412	96707	290746	77735	75111	177124	259607	177628	172662	109420	119002	103365	101556	119998	86206	107137	120039	37365	33311	15711	27113	29472	31172	39522	38490	52071	52152	19066	17151	18468	11797	36679	28551	33756	31580	35465	18580	71059	69281	49142	21226	38888	30906	29064	37123	18734	13351	25271	37119	191854	118018	74909	45884	44347	31065	26016	36837	63672	40392														
SPERMINE																																																																																																																																							26345	12855	12189	6394	4436	2167	797	856	1274	1820	970	293	1523	155																																	11842	11255	12714	13954	11418	11446	10563	10506	10582	9561	10187	9948	9092	8932	9579	9280																																																																								
SPHINGANINE	52314	54642	85430	46855	42404	48774	67372	48871	45019	78237	90606	63953	60291	48801	52808	83681	21247	48130	41600	46241	78758	47948	36960	48645	39514	43610	41780	42400	54370	44214	46823	65086	47294	47991	43600	134444	153920	146729	120059	117802	123151	107944	111673	132000	160001	116916	111771	120114	115547	156421	114526	78910	97992	75112	68599	84995	90330	90904	72798	86009	73791	65677	79965	82568	86744	70270	78026	67154	70693	80485	84106																											76883	74962	75828	70159	76193	69841	72647	71115	83499	70624	69366	80128	73209	102656	98005	97716	95776	98836	96093	95292	98027	88207	96152																																																																													763732	575767	721020	705215	617662	616285	525071	566419	415061	552096	533638	542748	521197	500695	540550	416619	136392	130926	130778	123432	131737	133506	139692	138481	124465	126947	132455	122035	133034	142398	120422	123492	114499	119741	133636	132533	137449	126773	140662	122386	118347	127426	118974	130513	161837	160842	161957	164917	177358	175882	172548	173331	177188	171487	169841	180263	170304	177454														
STEARIC ACID																																																				11421	19076	22205	35433	29983	19054	8375	11831	12584	9577	15705	15788	11161	11067	7929	11499	14497	15001	11600	9992																											34246	42645	37400	15012	9897	13228	10850	10238	6407	6989	8685	10336	7623																																																																																																																																																														
SUBERIC ACID																																				27931	21090	41973	49306	21814	27291	44870	28933	48571	16432	43969	33979	45664	30809	31296	39006	522329	242818	704800	972517	394367	96221	173092	474898	469915	823414	648293	569532	329762	420019	702556	813528	909332	475381	331672	640668	14538	16493	13020	14619	15517	16874	14779	18681	16479	22544	17744	16068	18512	20614	19198	16524	20452	20454	21290	22347	19061	23635	20658	25384	24258	20883	500082	436474	286449	508336	449173	466512	411264	367081	208758	226817	270449	383147	485034											11885	10902	7282	4687	6001	8902	3866	2428196	2185426	2295538	1666189	1767630	1887122	1130610	62224	63500	44320	48880	40425	79435	49292	47413	61341	52132	60770	38861	74988	62315	24225	30343	25567	21996	34531	30492	29044	32452	28141	35183	32088	29823	29617	27808	32675	21811	26794	28969	30395	27577	32863	33391	32437	32247	39874	36870	31693	34154	34540	34342	32688	22701																	1394760	1416513	1571851	1399845	1415180	1070644	1274027	1236462	684821	1474967	1404959	1189039	1126365	1073309	1077779	577426																																											516370	457597	508685	597293	490126	525638	575998	430576	467632	479248	606270	457242	556847	431738
SUBERYL GLYCINE																																				12951	9259	21767	11053	12855	8584	11832	5983	11804	3866	17720	14689	17532	14752	9064	13697																																																												13662	10334	9343	17293	10253	9947	10866	11622	11058	7562																																																																																																																																																				
SUCCINIC ACID																																				6378	7768	0	0	9315	9319	0	8399	0	3254	0	14188	12400	12285	6659	7734																																																																																				13272	4112	6029	4762	7448	4728	6177	5133	110334	144844	178593	28216	142134	164416																																																																																																																								
SYRINGIC ACID	3245	2373	1404	8558	8221	9888	20509	11809	4302	3793	3741	3770	2457	3745	2438	2765	3403	12085	11282	10556	11324	9568	12581	10029	10549	12048	13720	17114	15973	17698	15595	11292	13799	16685	20246	23497	26408	41567	33567	31610	36532	45188	32869	73895	16554	45308	39857	52876	56172	45444	56705																																																												31385	26756	23054	29050	27292	28262	27168	19685	33552	15027	56067	54483	44549	37008	66786	130365	82241																																																						20694	30672	28298	30781	50750	52094	68389	50207	41476	48999	44507	41326	49419	46616	48879	43929																																													6033	5131	13517	10604	10629	11789	7648	8265	11264	5431	11434	8307	8088	13911														
TAURINE	11145	9190	11353	10083	13013	33057	41922	15436	3133	7428	6331	3403	6022	9852	2917	4242	2772	10402	10880	17060	14561	14377	8602	12911	14473	19056	31141	34455	18971	15832	38209	12170	10123	16765	26046	224878	292306	212049	231872	170355	319828	177732	308357	149325	656914	265485	168586	237054	405517	279129	332298	60574	23831	36910	45247	44870	33866	24762	62402	50464	41944	37727	50937	39926	43324	21584	44636	63594	22568	34385	57905	16373	12802	19204	16265	27417	38670	36184	26083	33952	15571	15111	21471	17312	50124	11306	14133	11870	35932	44334	30962	17861	25638	28885	41441	40619	57346	79117	80267	83808	83466	106963	78465	67510	73040	85411	81537	85245	53009	74315	386086	571177	855868	453161	438235	555545	494783	398649	377620	299420	553884	504460	728598	1108486	726123	356711	891405	213974	189823	181397	194329	188834	97710	96330	43717	12167	11655	13594	12089	11305	13095	12519	77664	25182	36915	77477	11565	21064																	62840	79178	252461	133608	82724	95245	81129	70600	64555	59712	125533	128075	200316	209033	251137	140235																	672280	546945	507843	557758	655291	619656	427441	560540	573610	317630	396702	567174	478378	449943	412038	433688	5771	9951	9216	7362	7915	6893	7569	7660	5168	19944	24505	31787	36060	33306	22312	25407	21545	19507	15283	10024	16485	25913	21505	61642	54988	78973	101045	40812	643561	442069	552618	490459	365948	356608	615143	581417	539932	617518	648305	466256	474609	419303	101610	74485	62340	58093	113208	124844	94123	64469	104223	83796	118205	67996	102395	77769
THIAMINE MONOPHOSPHATE																																																																																																																																																																					4303	14380	4126	8349	3118	6704	7098	6570	2662	9308	3228	1043	1227	940	1292	1331																																																																																								
THYMIDINE	16740	10318	3903	3699	2014	7693	12584	3450	16672	14225	12448	12783	10428	10350	8354	10565	10130	10473	11243	12834	14310	11685	13080	9188	6184	3299	7911	15684	9051	11033	14406	7391	9531	12545	11390																																					40322	25474	31779	36550	10164	10549	7722	11632	10709	2721	3199	3653	2065	36859	23965	28071	31833	16570	25575	17109	15919	23482	3786	9067	5065	7647														11723	7365	9792	10590	10020	9281	15455	6214	14807	6915	24382	22424	26077	17100	19873	26439	19014								57417	22537	33517	48032	56227	34236	47613	45288	30660	42594	46519	23991	88627	105562																																																																	13831	18531	14773	18923	15535	12232	8622	8780	11308	2343	3779	922	1515	3331															2019	2309	6289	7738	13208	26621	4817	4574	12596	4543	6117	5774	3491	6054														
THYMINE	0	0	0	7115	6058	5194	6549	12083	0	0	0	0	593	242	0	0	0	10009	13273	9123	11835	9196	12301	5209	9091	7692	4054	8678	5152	8650	10122	4152	11482	9110	21235																	39301	36865	27924	58712	41440	33910	23220	38331	20059	58343	69933	42124	16277	45476	44626	59245	57261	28533	44630	24551	3552	12401	26669	21565	42815	63389	26792	37808	20779	40965	27866	28783	10021	25288	17830	2274	21419	22574	40719	20777	26211	30033	20572	23502	25567	20644																																																																																																																																																																											
THYROXINE																																																																																																																																																																																																					22621	12804	18154	19090	26596	20957	21316	18936	450	19376	19786	14173	13377	11842	15970	1467																																																								
TIGLYL GLYCINE																																				34295	26984	44769	50120	43105	38492	51261	43898	69105	22790	55633	46534	56365	63705	32366	47142																																																												48122	60280	85748	69765	44754	41136	52607	44520	98189	46701	213046	207629	224775	344690	280840	266678	238814	23075	17269	16193	13281	14841	9935	13996																																																																																																											9290	18306	39235	37703	79167	64803	10692	17822	33178	59004	46154	47063	45604	63758														
TRANEXAMIC ACID																																																																								40240	30083	30172	35728	42185	32008	40002	42991	35954	28890	33179	49337	35214	36893	31153	31814	35016	27940	29514	56161	41538	39483	28031	28979	31003	31747																								1885165	1458505	1187811	927484	947064	487832	633612																																																						217949	314828	612897	450817	817380	844719	1066373	476839	721102	644838	923917	676768	658686	695814	467107	631810																																																																								
TRIDECANOIC ACID	4204	3795	3805	6290	6521	5245	2475	5735	7744	3537	2283	6261	6763	9633	10478	1776	6478	11098	7393	11433	2666	8191	9349	3915	8895	8135	7974	8695	3718	8298	6371	3103	9807	7137	5466																	21264	23246	19185	15603	19265	29687	12979	12823	11861	10525	12024	10100	10126	10692	13704	10796	9021	9659	12680	10164	34346	35597	36579	42484	42176	37880	47513	41811	54983	56783	58182	59871	57190	58190	74353	71057	74441	66711	71744	68019	68527	71843	75876	77219	76327	74930	12060	12066	13098	11398	10556	9267	8613	6847	6391	5446	6795	7213	7032	12736	11216	18470	9435	12244	8619	11066	7476	14561	9224																													59058	54812	60016	40418	47008	55470	51085	55844	52339	39170	55489	34081	38060	37979	35805	36791	82937	70904	74106	65715	53170	66462	55399	83558	69975	63346	76770	58134	70434	80936	80236	77884	4440	7003	10213	5730	9821	17475	30579	27281	24266	41614	47704	26298	36675	41640	40650	46210	44728	52953	21000	25614	33126	32599	23612	23198	24131	18302	19738	17689	1695	16575	17179	17136	10839	13405	17203	12920	12961	13006	14678	19425	18740	7139	15502	10274	11779	10706	2454	2164	2795	2937	6592	7599	10078	11546	12164	3846	3761	4617	4071	4718															16441	13992	13420	15734	7866	8295	8250	7056	7513	13518	15793	14235	13359	11427
TRIGONELLINE	14520	12987	9513	26191	37782	14825	14524	16353	27360	23492	19577	26818	17999	16909	17295	25510	27080	45270	47412	40651	51686	31090	55310	29765	37481	34388	15817	22258	13554	9699	13634	11500	17404	21609	33127	196896	197362	261306	224113	242994	221561	242334	227010	271067	170855	259391	238569	295562	313802	246247	321042	65090	54752	48958	62005	74773	87834	42157	61329	60333	57381	70050	74167	48486	55172	60343	57836	62282	49335	49831	58429	23944	32886	29348	41497	29234	46741	90981	36338	35682	30962	32962	54998	43181	51833	35520	30680	35087	70110	104086	86159	68230	73723	33427	28928	36928	26341	80736	74827	60077	87533	69046	109048	83067	85145	75191	80000	74457	63615	66261	211385	218306	152889	249822	234249	209259	202819	232123	198336	181979	363671	346211	283046	171759	257623	749000	156939	199248	208389	197305	154731	71389	116732	87041	33962	24742	26180	34714	22495	25730	26944	24498	38218	24060	28342	26006	33478	34083	41178	138203	54426	51485	137131	60716	61346	73448	117042	83030	107415	77437	59282	121799	72133	51923																	853751	1170727	1489817	1368644	2425079	2303294	2930766	1841548	2018151	2020070	2534315	2217233	2439086	2650629	1953288	2392973	423243	382323	377020	387081	518391	498152	491698	496882	620195	675677	558704	427569	446765	455359	451630	364982	13899	18340	19377	23444	19003	16717	20303	22047	19946	9081	27033	22722	25149	22765	20677	31158	24652	21416	24629	24056	32920	24032	22003	31706	33400	30254	29129	31918	205587	161670	297220	291473	313291	367534	272832	275717	346539	280436	265483	284949	272871	323845	82485	90421	65950	57035	63511	71355	97466	98573	78714	73855	71937	68003	78979	80771
TRIMETHYLAMINE N-OXIDE																																				2938	3024	2664	62529	48371	55716	54197	37637	47738	333	3579	3226	4121	3258	3224	3607																																																												1987	2763	1866	3767	2960	2597	3493	40860	48128	43467	68858	65947	76663	56265	1838935	1480568	1729481	2817	2758	3288	2646	89770	88207	82845																																																															44774	60049	38745	52735	54309	46959	37383	48367	41567	107798	45210	28543	35486	19690	27405	30112																																																								
TRYPTOPHAN	879909	507792	232249	484306	457777	400873	430695	518729	916643	450656	356584	613457	443838	692278	575802	537114	817573	429152	597710	795517	469250	395570	503377	314845	331754	214755	375651	1021352	332693	384682	406274	226730	640449	774500	1808750	20580	18358	38264	28805	23689	18563	25043	20492	42368	17551	32346	35337	37351	40527	24988	28768	4028028	3193692	3459242	7451405	3323066	2207912	2641898	3539951	3642553	5299477	5742375	3638330	3839173	3526377	4499216	5868913	6145696	3298577	4623183	3495208	746458	936751	738664	750212	389274	846217	760195	667599	397658	701904	746847	341317	415332	4035068	1640826	2050906	2941208	2158120	3286392	2238047	2353017	2673842	1357607	2268104	1797468	1833354	5194791	5298248	4754549	5156658	4865892	5542902	6588777	5865085	3930982	3779433	3741324	4915666	4251147	23039	26013	25505	36736	29968	25191	28613	19173	32217	18347	86196	86464	89562	95260	70406	111988	62691	10497735	9639084	9886383	8720421	8713455	5796009	8794246	5335490	2219458	2638805	3760980	1894426	2155785	2276334	1980324	1769483	2091729	1647180	2231079	1110829	711898	4214376	7755751	5798258	3922742	8013592	9870947	7978956	9946177	13155484	16215237	11850866	10375076	13421049	10413571	11038726	7812847	7210149	14038903	9270943	10954881	7623810	15670296	14065490	19154376	20488314	21353896	12480120	13104674	11154849	7340950	10786296	10003866	55456	95163	156407	123788	136725	162790	234724	147764	178079	163937	257269	135319	157810	152189	158236	128103	29486856	26617684	29936918	30415170	22268286	23089140	26384260	29806984	15571949	32624164	28413116	15348501	20884704	18800216	26618628	21436106	1137030	895725	1153576	1299603	2672846	2019211	2317471	2372347	3349340	1230479	1869086	1361475	1680820	1854665	2342262	1688216	2281185	2377875	2797749	3543590	3226581	3276392	3162546	2212780	3415408	3027143	3719253	4019021	14101	11498	24069	24772	35736	46355	20611	16351	27110	17822	24393	20638	25156	22279	5480332	5779388	6225931	5005828	4990931	4736034	5503720	5463204	5482704	4820824	5195798	5553857	4960600	5045308
TRYPTOPHAN-2,4,5,6,7-D5	974645	1408138	1094007	1126390	1164607	1362659	880113	1383019	1033919	1133126	904118	1276274	1331716	1273815	1438337	963416	1434109	1444444	1370807	1412395	967632	1015194	1137017	933901	1072752	1062609	1251380	1154300	1273411	1045119	996005	945528	1219023	1144172	1193172	955750	938517	1215827	1334501	1018215	990897	1455053	1057259	1324401	939030	1452788	1078672	1139650	1036666	965464	1176615	1044143	1210884	1481511	1747269	1063252	1688170	1286000	1140439	1079400	1514986	1950030	1251083	1175762	1015821	1822176	1852582	1616601	1120204	1589697	1280266	2624155	2727454	2820193	2876084	3077260	2983848	3086776	3197648	3405229	3192251	3121604	3307222	3296104	2994738	3135965	3121413	3204326	3337714	3105367	3252172	3240717	3207055	3374772	3314913	3368733	3212439	1300006	1274840	1321368	1337971	1376111	1602368	1718629	1340037	1295354	1308757	1277092	1307060	1283859	1332500	1311858	1324758	1319081	1331439	1332352	1310728	1345031	1330818	1338059	5343869	5243159	5195809	5324401	5285566	4668601	5380808	4590378	4565829	4529692	4667202	4698002	4733096	4717122	2964929	3592499	3409660	3179816	3258990	3271404	3286816	3354056	2590797	2988764	2904771	2552334	2879394	2908284	7274786	6988386	6819284	6710787	7320208	7547120	7191329	7106316	6666567	6166912	7428156	6460650	6855503	6703328	6362028	6892725	6591582	6624499	6355525	6659274	6328817	6812755	6481602	6766420	6836376	6762665	7480894	6633594	6847978	6861206	6275861	7045161	8910253	8704526	8707722	8926323	8856987	8956104	9043870	8955993	8633978	9026310	9061242	7268384	6779010	6470563	6100764	6849486	8444408	8406848	8481192	8466625	8647243	8760155	8650683	8566552	8656231	8504873	8548207	8655251	8702947	8685332	8492351	8480198	1374098	1341406	1408093	1367545	1269856	1369228	1314304	1431681	1302565	1141360	1303477	1358359	1329808	1149463	1379945	1401868	1321646	1364478	1283292	1330314	1344320	1318536	1352056	1404684	1309542	1278984	1296972	1254397	1420118	1472772	1548754	1550786	1627041	1620744	1672506	1713332	1672798	1608283	1631438	1635340	1632751	1682795	1642150	1624115	1635834	1689022	1680633	1646650	1710091	1686986	1668059	1675500	1684236	1667980	1700598	1659470
TRYPTOPHANAMIDE																																																																																																															3275	3938	4255	3910	2569	4120	3849	2036	2940	1455																																																																																																																																																				
TYRAMINE	2686	1853	1255	3282	2832	3658	5094	3719	3038	2922	2736	3076	2227	2534	2338	2600	3214	2504	2881	2552	3144	2974	3752	2971	3263	2704	2260	3306	2192	2306	2132	2427	3313	3652	4877																																																																																						8788	7709	9955	7453	6301	6755	5512								8084	4129	4932	6651	4448	4786	3974	4962	16121	21930	23760	27068	22586	27126																																																																																																																								
TYROSINE	1350561	820844	439092	1450856	1393454	924395	1493756	1030568	1576346	988007	801526	1199166	887092	1249231	1042198	1085580	1394108	1380176	1659170	2105864	1406125	1186368	1513663	1045930	1059326	798213	960528	2831174	930021	1161084	1256754	663543	1510794	2118998	4241712	46370	45948	102158	89027	75380	58894	53524	50534	75522	106072	101013	102196	121049	134994	127228	68559	1569266	2044476	1932249	4011339	1997120	1177685	1823075	2458357	2340909	3268651	3547790	2433070	2868033	1314968	2954971	2824508	3774235	1627572	3106856	2308739	1258363	1871187	1246155	1431656	622906	1152636	1402269	1133406	629765	1043052	886173	491755	815153	768775	2650743	2737915	2374289	2541322	3168955	2190858	2263326	1139718	1749536	2978040	2417960	1900696	3453268	3134056	2985729	3791853	2676814	4016490	3958395	4332336	2868204	2827889	2355985	3023916	2585985	52195	48287	61635	56599	50200	40583	49888	35730	54172	27723	157036	155810	127504	158454	111217	212525	92577	7483235	6704962	6571955	5647002	5668688	7132682	6202560	7758193	2643104	3144008	4445362	2239364	2789951	2710944	2670266	5484173	7455012	5944616	6177276	5636108	3204539	4807590	6130658	5831616	6629824	7186895	6546918	6150976	6807318	10806899	12316881	11670518	2476456	1646806	2399268	1953790	2066183	7352930	16111583	9821621	14080705	7025608	12862907	10372205	18083074	15259473	16241350	9324009	4909440	5992672	2819926	4869078	4885630	71580	141975	177173	195715	192550	209717	307792	179978	224853	260091	335101	171873	156776	188238	223132	180158	5750900	9855128	7116852	7512906	7788750	6480707	5603438	12163529	7743229	13375950	9187771	6242958	5511422	5387445	7038364	6316640															2569398	1748360	2452989	2534312	2786636	3373959	2974632	3403474	3057363	501043	1269816	682434	813534	1145002	16808	16883	31142	30932	54006	75525	28540	18631	43809	20460	38144	24328	33630	33274	2127208	2055862	1993198	1655655	1735859	1876601	1809053	1973624	1956918	1846972	2237020	2107533	1893994	2106759
URACIL	6929	3384	6872	16678	12655	23919	51809	23131	417	1507	1740	1900	1476	3172	1303	251	518	52925	40318	45534	32035	27979	44891	34215	28308	38097	22734	69961	25537	42344	79324	22838	29542	61694	133741	35221	28838	36661	60144	54914	50566	53659	42574	78134	36546	37012	36072	35221	42493	26784	33247																					13911	12179	3742	5229	110484	45147	27135	36347	42091	6570	10699	6962	7541	20843	4975	8926	4775	70758	44890	82807	59913	65445	7109	10809	11240	20825														25355	12471	27667	14870	12013	9352	16862	22249	14309	24210								1383159	1115039	1210401	996502	882051	1044700	1193726	50524	2540	8736	5956	2904	5647	11125	10761	94664	6924	156335	273389	155753	179286																																																																	74737	136781	51977	108990	102711	99120	86084	87845	100917	28726	16162	16293	15317	16574															14489	6743	17372	27901	63640	64211	19680	14120	40693	15852	26667	23854	14549	26491														
URIDINE	32762	25249	10559	10083	8720	12466	19855	15292	27709	25598	25602	29111	23155	23347	16999	20759	18263	9210	10612	12228	15539	14408	11195	9504	10280	8004	16354	19708	13696	13421	12084	12644	18888	13758	11824	12600	11455	15208	16042	11545	9267	11805	7224	13990	4934	14783	15034	13861	13769	9147	10526	26890	43984	43201	42137	36812	20611	26156	32230	29880	30099	51674	47199	23979	29610	41694	57301	40005	36844	44969	50042	130389	90367	105103	108709	29832	31992	24833	29531	26566	9405	8057	11848	11100	48778	57490	73407	43382	24893	33331	19283	20495	23687	6643	17567	13952	11652	33093	23703	33163	32368	58824	45312	70736	56495	41860	40269	45407	33639	31142	16273	16931	12327	14789	13828	14654	17032	13313	22521	14990	45791	42986	33780	27337	21738	48945	18189	144885	137578	125819	101746	86257	63368	56796	122213	59672	72117	72277	133463	82805	105720	111747	45265	84032	73901	18329	86488	119730	120681	134849	79175	173280	116304	80889	102247	103733	64981	119778	101541	57957	24588	42432	53368	40212																	13496	28752	63979	36884	40888	34149	58616	27473	39806	24914	37125	50686	42035	61838	46037	40915																																													3672	2816	7391	7725	18168	16367	3231	4185	10848	7157	7656	5270	4034	5407														
UROCANIC ACID	7357	6117	5040	37506	25786	34224	36862	44529	7087	1500	5860	1395	5753	4407	6998	8969	1400	12389	12456	9420	48876	34069	32768	24373	23949	22028	48011	46858	34832	24444	41142	32539	48177	45573	15157	62707	54541	46067	30091	45211	62321	55440	39901	41618	50042	30147	39523	73059	73977	40661	73486																					18399	24423	20933	20100	254017	199579	187115	181782	106980	36263	49087	34391	22635	23814	33982	19807	25762	148265	192621	198025	162882	142213	54245	41566	27379	36109														33184	67797	44507	20230	59471	40185	47469	65305	17269	46219															15323	18309	13433	21870	17537	9560	16651	16729	5012	4048	5884	0	6154	0																																	587802	864692	1142431	884968	1226428	1142472	1808270	989981	1278953	800141	975941	1067748	1494465	1759857	2187662	1521932	79781	54763	57622	75226	73580	67991	92565	84115	88320	89247	67177	61483	58759	62340	80648	66822																																											15018	20076	19833	16614	11274	13153	13228	12263	10907	16202	14668	16793	12636	15624
URSOCHOLIC ACID																																																																																																																																							29685	19782	22231	24412	29481	23805	21961	24285	0	6180	2472	0	0	0																																																																																																																								
VALINE																																																				6133382	6672942	6791079	10361824	5255505	5636730	5389481	5695645	5608663	8660821	11002002	7436206	5456316	5374349	8063532	9800791	9571434	5425340	7116828	6427304																											4716920	4658057	4350450	5856874	4379556	6022182	6450082	5596680	4363031	4219038	4098452	4713546	4500502																		8744486	7634939	7884744	6537958	9213009	8862632	8713810	10272529	3774276	4115884	6878026	2898186	3275823	3292724	3065008	0	0	0	0	0	0																																																																	642036	480679	498667	605358	1171942	816580	849477	883061	1222703	514787	788323	562881	697111	722464	1144554	873919	1005847	1239777	1538675	1921073	1431217	1505688	1522230	1175825	1680151	1529021	1912810	1675774															812278	863338	779936	840228	779644	947483	784772	1013544	1028005	921846	981790	767691	772025	730310
VANILLIC ACID																																																				21293	32860	22037	20200	23190	28359	31736	21972	18702	21148	16530	25623	21050	25300	19931	18656	17713	11502	26091	23890																																																		14608	14277	14650	12860	13476	22629	16870								9600	5979	6804	5584	4988	5714	7685	4668	10105	2574	2166	3182	2762	3610																																																																																																																								
XANTHOSINE																																																																																																		4211	5733	5408	9307	14018	4059	10408	7489	4652	8099	4851	8381	2712																		52935	46853	43846	30253	7894	8907	6011	12576	7200	7914	7422	12248	8409	10744	8800	9007	13388	10154	1241	24527	18201																																	7783	14144	30755	17431	25681	26875	36329	26026	27334	21526	38585	28896	42995	39364	38900	19136	21163	29425	29885	23096	21248	27169	12052	20590	10180	15290	22545	18982	6157	20081	16324	16560																																																								
XANTHURENIC ACID	256	23	0	19774	8072	11001	9587	9616	64	218	122	315	104	0	0	205	434	4207	4825	4520	15628	12659	19820	9054	8348	8528	8275	12445	8831	6045	6312	6543	7646	8889	11130	458494	330660	726669	1388585	373787	380177	466131	272692	1096616	113254	613829	429027	425266	509175	317320	478352																					1124	680	1193	1517	27756	29090	30456	40214	46925	3514	1371	852	4011	1135	1260	983	897	24827	28921	27747	22382	45090	1241	1848	1564	1938														365098	596268	563656	783361	646401	473469	718222	375276	1127272	538076	2411430	2451246	3862696	3471176	3505512	4221353	3803750																																																																																																																																													
MS_METABOLITE_DATA_END
#METABOLITES
METABOLITES_START
metabolite_name	quantitated m/z	retention times	adduct	PubChem_CID
(2-AMINOETHYL)PHOSPHONATE	126.0314558	0.72	[M+H]+	339
1-AMINOCYCLOPROPANE-1-CARBOXYLIC ACID	102.0549545	0.755	[M+H]+	535
1-METHYL-6,7-DIHYDROXY-1,2,3,4-TETRAHYDROISOQUINOLINE	180.1019047	1.461	[M+H]+	91588
1-METHYL-HYDANTOIN	115.0502034	1.481	[M+H]+	69217
1-METHYLADENOSINE	282.11968	2.115	[M+H]+	27476
1-METHYLGUANIDINE	74.07127324	0.722	[M+H]+	10111
1-METHYLNICOTINAMIDE	137.0714879	0.72	[M]+	457
1,3-DIAMINOPROPANE	75.09167433	0.613	[M+H]+	428
1,5-ANHYDRO-GLUCITOL	165.0757495	0.816	[M+H]+	64960
1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONE	136.0756899	2.738	[M+H]+	280229
1,6-ANHYDRO-B-GLUCOSE	163.0600994	0.807	[M+H]+	2724705
2-(4-HYDROXYPHENYL)PROPIONIC ACID	189.0522122	3.693	[M+Na]+	102526
2-AMINO-2-METHYLPROPANOIC ACID, 2-AMINOBUTYRIC ACID, 3-AMINOISOBUTANOIC ACID, ALPHA-AMINOBUTYRIC ACID	104.0706045	0.793	[M+H]+	6119, 6657, 64956, 439691
2-AMINOBENZOIC ACID	138.0549545	3.439	[M+H]+	227
2-AMINOPHENOL	110.0600398	1.222	[M+H]+	5801
2-HYDROXYHEXANEDIOIC ACID, 3-HYDROXY-3-METHYLGLUTARIC ACID	185.0420414	1.678	[M+Na]+	1662, 193530
2-HYDROXYOCTANOIC ACID	161.1172204	5.024	[M+H]+	94180
2-HYDROXYPHENYLACETIC ACID	153.0546201	3.403	[M+H]+	11970
2-HYDROXYPYRIDINE	96.04438978	1.703	[M+H]+	8871
2-METHYLBUTYRYLGLYCINE	160.0968193	2.753	[M+H]+	193872
2-METHYLGLUTARIC ACID	169.0471268	2.739	[M+Na]+	12046
2-METHYLHIPPURIC ACID	194.0811692	3.377	[M+H]+	91637
2-OXINDOLE	134.0600398	3.661	[M+H]+	321710
2-QUINOLINECARBOXYLIC ACID	174.0549545	2.988	[M+H]+	7124
2,4-DIHYDROXYPYRIMIDINE-5-CARBOXYLIC ACID	157.0243826	1.399	[M+H]+	90301
2,6-DIAMINOHEPTANEDIOIC ACID	191.1026329	0.686	[M+H]+	439283
2,6-DIMETHOXYBENZOIC ACID	183.0651848	3.459	[M+H]+	15109
3-AMINOSALICYLIC ACID	154.0498691	1.399	[M+H]+	68443
3-HEXENEDIOIC ACID	167.0314767	2.486	[M+Na]+	5351896
3-HYDROXY-2-METHYL-4-PYRONE	127.0389701	2.595	[M+H]+	8369
3-HYDROXYGLUTARIC ACID	171.0263914	1.209	[M+Na]+	181976
3-HYDROXYPROPIONIC ACID	91.03897005	0.76	[M+H]+	68152
3-METHOXYTYRAMINE	168.1019047	1.688	[M+H]+	1669
3-METHYLADENINE	150.0774212	0.829	[M+H]+	135398661
3-METHYLADIPIC ACID, PIMELIC ACID	161.0808349	3.235	[M+H]+	385, 12292
3-METHYLCATECHOL	125.0597055	3.723	[M+H]+	340
3-METHYLGLUTACONIC ACID	167.0314767	2.804	[M+Na]+	1551553
3-METHYLHISTAMINE	126.1025734	0.621	[M+H]+	69520
3-METHYLHISTIDINE	170.0924026	0.676	[M+H]+	64969
3-NITRO-TYROSINE	227.0662474	2.214	[M+H]+	65124
3-SULFINO-ALANINE	154.0168547	0.77	[M+H]+	1549098
3,3',4',7-TETRAHYDROXYFLAVONE	301.0706641	3.441	[M+H]+	5378244
3,5-DIMETHOXYPHENOL	155.0702702	3.96	[M+H]+	10383
4-ACETAMIDOBUTANOIC ACID	146.0811692	1.698	[M+H]+	18189
4-ACETAMIDOPHENOL	152.0706045	2.346	[M+H]+	1983
4-AMINOBUTANOIC ACID	104.0706045	0.722	[M+H]+	119
4-AMINOPHENOL	110.0600398	0.788	[M+H]+	403
4-GUANIDINOBUTANOIC ACID	146.0924026	0.832	[M+H]+	500
4-HYDROXY-PHENYLGLYCINE	168.0655192	0.774	[M+H]+	36143
4-HYDROXYBENZALDEHYDE	123.0440554	3.171	[M+H]+	126
4-HYDROXYBENZOIC ACID	139.0389701	2.885	[M+H]+	135
4-HYDROXYPHENYL ACETIC ACID	153.0546201	2.989	[M+H]+	127
4-HYDROXYPROLINE, 5-AMINOLEVULINIC ACID	132.0655192	0.733	[M+H]+	137, 825, 5810, 69248, 440014
4-IMIDAZOLEACETIC ACID	127.0502034	0.813	[M+H]+	96215
4-METHYLCATECHOL	125.0597055	3.223	[M+H]+	9958
4-PYRIDOXIC ACID	184.0604338	1.703	[M+H]+	6723
4-QUINOLINECARBOXYLIC ACID	174.0549545	1.685	[M+H]+	10243
4-VINYL PHENOL	121.0647909	3.912	[M+H]+	62453
5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-RIBOFURANOSIDE	259.1036956	1.438	[M+H]+	17513
5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-RIBOFURANOSYL 5'-MONOPHOSPHATE	339.0700261	0.822	[M+H]+	65110
5-AMINOPENTANOIC ACID, VALINE	118.0862546	0.854	[M+H]+	138, 6287
5-HYDROXY-TRYPTOPHAN	221.0920683	1.696	[M+H]+	144
5-HYDROXYINDOLE	134.0600398	2.721	[M+H]+	16054
5-HYDROXYINDOLE-3-ACETIC ACID	192.0655192	2.734	[M+H]+	1826
5-HYDROXYLYSINE	163.1077183	0.649	[M+H]+	1029, 3032849
5-HYDROXYMETHYL-2-FURANCARBOXYLIC ACID	143.0338847	2.212	[M+H]+	80642
5-METHOXY-3-INDOLEACETIC ACID	206.0811692	3.883	[M+H]+	18986
5-METHOXYSALICYLIC ACID	169.0495347	4.275	[M+H]+	75787
5-METHYLCYTOSINE	126.0661879	0.829	[M+H]+	65040
5-METHYLURIDINE	259.0924622	1.741	[M+H]+	445408
5-PHENYLVALERIC ACID	179.1066557	5.273	[M+H]+	16757
5,6-DIHYDRO THYMINE	129.0658535	1.67	[M+H]+	93556
5,6-DIHYDROURACIL	115.0502034	1.115	[M+H]+	649
5'-METHYLTHIOADENOSINE	298.0968364	2.6	[M+H]+	439176
6-HYDROXYNICOTINIC ACID	140.034219	1.71	[M+H]+	72924
8-HYDROXYQUINOLINE	146.0600398	2.705	[M+H]+	1923
ACETYL-CARNITINE	204.123034	0.82	[M+H]+	7045767
ACETYLCHOLINE	146.1181038	0.83	[M]+	187
ACONITIC ACID	197.0056559	1.664	[M+Na]+	444212
ADENINE	136.0617712	0.825	[M+H]+	190
ADENOSINE	268.1040299	1.62	[M+H]+	60961
ADENOSINE 3',5'-CYCLIC MONOPHOSPHATE	330.0597958	1.673	[M+H]+	6076
ADIPIC ACID	169.0471268	2.598	[M+Na]+	196
AGMATINE	131.1291225	0.628	[M+H]+	199
ALANINE, BETA-ALANINE, SARCOSINE	90.05495447	0.72	[M+H]+	239, 1088, 5950, 71080
ALLANTOIC ACID	177.0618308	0.765	[M+H]+	203
ALLANTOIN	159.0512661	0.779	[M+H]+	204
ALLO-ISOLEUCINE, ISOLEUCINE	132.1019047	1.594	[M+H]+	6306, 99288
ALLOTHREONINE, HOMOSERINE, THREONINE	120.0655192	0.732	[M+H]+	6288, 12647, 99289
ALPHA-AMINOADIPIC ACID	162.0760838	0.814	[M+H]+	92136
ALPHA-GALACTOSE 1-PHOSPHATE, ALPHA-GLUCOSE 1-PHOSPHATE, GLUCOSE-6-PHOSPHATE, MANNOSE 6-PHOSPHATE	261.0369946	0.783	[M+H]+	65127, 65533, 123912, 439958
ALPHA-N-ACETYL-GLUTAMINE	189.0869829	1.135	[M+H]+	25561
ALPHA-RHAMNOSE, FUCOSE	165.0757495	0.75	[M+H]+	25310, 3034656
AMINO(4-HYDROXYCYCLOHEXYL)ACETIC ACID	174.1124693	0.777	[M+H]+	4250253
AMINOMALONIC ACID	120.0291336	0.761	[M+H]+	100714
ARABITOL, XYLITOL	153.0757495	0.766	[M+H]+	827, 6912, 439255
ARGININE	175.1189517	0.679	[M+H]+	6322
ASP-PHE	281.1131976	2.632	[M+H]+	93078
ASPARAGINE	133.0607681	0.712	[M+H]+	6267
ASPARTIC ACID	134.0447837	0.726	[M+H]+	5960, 83887
AZELAIC ACID	189.112135	4.354	[M+H]+	2266
BECLOMETASONE DIPROPIONATE	521.2300572	5.555	[M+H]+	21700
BETA-LACTOSE, LACTULOSE, MALTOSE, MELIBIOSE, SUCROSE	343.1234875	0.767	[M+H]+	5988, 6134, 11333, 439186, 440658
BETAINE	118.0862546	0.755	[M+H]+	247
BICINE	164.0917339	0.747	[M+H]+	8761
CADAVERINE	103.1229745	0.613	[M+H]+	273
CAFFEINE	195.0876516	3.201	[M+H]+	2519
CAPRYLOYL GLYCINE	202.1437695	5.05	[M+H]+	84290
CARNITINE	162.1124693	0.723	[M+H]+	10917
CARNOSINE	227.1138663	0.673	[M+H]+	439224
CATECHOL	111.0440554	2.714	[M+H]+	289
CHLOROQUINE	320.1888015	2.445	[M+H]+	2719
CHOLINE	104.1075391	0.705	[M]+	305
CIS-CAFFEIC ACID	181.0495347	2.946	[M+H]+	689043
CITRIC ACID	193.0342786	1.32	[M+H]+	311
CITRULLINE	176.1029673	0.752	[M+H]+	9750
COPROPORPHYRIN III	655.2762402	5.334	[M+H]+	114935
CORTICOSTERONE, REICHSTEIN'S SUBSTANCE S	347.2216854	5.111	[M+H]+	5753, 440707
COTININE	177.102239	1.52	[M+H]+	408
CREATINE	132.0767525	0.787	[M+H]+	586
CREATINE PHOSPHATE	212.0430831	0.83	[M+H]+	9548602
CREATININE	114.0661879	0.74	[M+H]+	588
CYSTATHIONINE	223.0747039	0.702	[M+H]+	439258
CYSTINE	241.0311249	0.717	[M+H]+	67678
CYTIDINE	244.0927965	0.83	[M+H]+	6175
CYTIDINE 2',3'-CYCLIC MONOPHOSPHATE	306.0485624	0.829	[M+H]+	53481030
CYTOSINE	112.0505378	0.739	[M+H]+	597
DAMP	332.0754458	1.42	[M+H]+	12599
DECANOYLCARNITINE	316.2482345	5.002	[M+H]+	10245190
DEOXYCARNITINE	146.1175547	0.776	[M+H]+	725
DEOXYCYTIDINE	228.0978819	0.836	[M+H]+	13711
DEOXYURIDINE	229.0818975	1.648	[M+H]+	13712
DEXCHLORPHENIRAMINE	275.1309523	3.821	[M+H]+	33036
DOPAMINE	154.0862546	1.179	[M+H]+	681
ELAIDIC ACID, OLEIC ACID, PETROSELINIC ACID	283.2631563	5.729	[M+H]+	445639, 637517, 5281125
EPINEPHRINE, NORMETANEPHRINE	184.0968193	0.839	[M+H]+	1237, 5816
ERYTHRITOL, THREITOL	123.0651848	0.775	[M+H]+	169019, 222285
ESTRIOL	599.3343072	4.456	[2M+Na]+	5756
ETHOSUXIMIDE	142.0862546	3.183	[M+H]+	3291
FERULIC ACID	195.0651848	3.666	[M+H]+	445858
FRUCTOSE, GULOSE, MANNOSE, MYO-INOSITOL, SORBOSE	181.0706641	0.74	[M+H]+	892, 18950, 439192, 2723872, 10130220
FUMARIC ACID	117.0182346	1.429	[M+H]+	444972
GALACTITOL, MANNITOL	183.0863142	0.756	[M+H]+	6251, 11850
GALACTOSAMINE, GLUCOSAMINE, MANNOSAMINE	180.0866485	0.676	[M+H]+	24154, 439213, 440049
GALLIC ACID	171.0287993	1.685	[M+H]+	370
GAMMA-CAPROLACTONE	115.0753556	3.141	[M+H]+	12756
GLUCONO-1,5-LACTONE, GULONIC ACID GAMMA-LACTONE	179.055014	0.772	[M+H]+	7027, 439373
GLUCOSAMINE 6-PHOSPHATE	260.052979	0.703	[M+H]+	440997
GLUCOSAMINIC ACID	196.0815631	0.718	[M+H]+	73563
GLUTAMIC ACID, N-METHYL-ASPARTIC ACID	148.0604338	0.745	[M+H]+	22880, 33032
GLUTAMINE	147.0764182	0.724	[M+H]+	5961
GLYCEROL 2-PHOSPHATE	173.0209506	0.813	[M+H]+	2526
GLYCYL-GLYCINE	133.0607681	0.687	[M+H]+	11163
GUANIDINEACETIC ACID	118.0611025	0.732	[M+H]+	763
GUANOSINE	284.0989445	1.657	[M+H]+	135398635
GUANOSINE 3',5'-CYCLIC MONOPHOSPHATE	346.0547104	1.697	[M+H]+	135398570
HEPTADECANOIC ACID	271.2631563	6.094	[M+H]+	10465
HEXANOYLGLYCINE	174.1124693	3.845	[M+H]+	99463
HIPPURIC ACID	180.0655192	2.994	[M+H]+	464
HISTIDINE	156.0767525	0.668	[M+H]+	6274
HOMOCITRULLINE	190.1186174	0.813	[M+H]+	65072
HOMOCYSTEINE	136.0426755	0.825	[M+H]+	778
HOMOVANILLIC ACID	183.0651848	3.233	[M+H]+	1738
HYDROQUINONE	111.0440554	2.604	[M+H]+	785
HYDROXYPHENYLLACTIC ACID	183.0651848	2.635	[M+H]+	9378
HYPOTAURINE	110.0270255	0.735	[M+H]+	107812
HYPOXANTHINE	137.0457868	1.265	[M+H]+	790
INDOLE-3-BUTYRIC ACID	204.1019047	4.707	[M+H]+	8617
INDOLEACETIC ACID	176.0706045	4.019	[M+H]+	802
INDOLEACRYLIC ACID	188.0706045	4.399	[M+H]+	5355219
INDOLELACTIC ACID	206.0811692	3.71	[M+H]+	92904
INDOLEPROPIONIC ACID	190.0862546	4.399	[M+H]+	3744
INDOLEPYRUVIC ACID	221.0920662	3.447	[M+NH4]+	803
INDOXYL-BETA-GLUCURONIDE	332.0740698	2.772	[M+Na]+	2733785
INOSINE	269.0880455	1.647	[M+H]+	135398641
2-FLUROPHENYLGLYCINE	170.061176	1.105222222	[M+H]+	5171030
4-BROMO-PHENYLALANINE	243.996776	3.309333333	[M+H]+	671214
4-CHLORO-PHENYLALANINE	200.047276	3.084333333	[M+H]+	736190
CARNITINE-TRIMETHYL-D9	171.169276	0.705888889	[M]+	129316446
D15-OCTANOIC ACID	160.216476	5.352777778	[M+H]+	13011402
D19-DECANOIC ACID	192.272876	5.571333333	[M+H]+	16213405
D27-TETRADECANOIC ACID	256.385676	6.015888889	[M+H]+	16212357
DI-N-OCTYL PHTHALATE-3,4,5,6-D4	395.309376	5.682666667	[M+H]+	16212237
GLUCOSE-1,2,3,4,5,6,6-D7	210.096518	0.750444444	[M+Na]+	92043367
INDOLE-2,4,5,6,7-D5-3-ACETIC ACID	181.101976	3.979777778	[M+H]+	54301591
LEUCINE-5,5,5-D3	135.120776	1.634666667	[M+H]+	11073472
METHIONINE-METHYL-D3	153.077176	1.131888889	[M+H]+	15556503
N-BENZOYL-D5-GLYCINE	185.096876	2.971555556	[M+H]+	101624378
PHENYLALANINE-2,3,4,5,6-D5	171.117676	1.928111111	[M+H]+	13000992
PROGESTERONE-D9	324.288376	5.482444444	[M+H]+	71309321
TRIDECANOIC ACID	215.200576	5.907666667	[M+H]+	12530
TRYPTOPHAN-2,4,5,6,7-D5	210.128576	2.505111111	[M+H]+	12209747
ISOVALERYLGLYCINE	160.0968193	2.842	[M+H]+	546304
KYNURENIC ACID	190.0498691	3.047	[M+H]+	3845
LAUROYLCARNITINE	344.2795347	5.245	[M+H]+	168381
LEUCINE, NORLEUCINE	132.1019047	1.666	[M+H]+	857, 6106, 21236
LEVULINIC ACID	139.0365621	1.774	[M+Na]+	11579
LUMICHROME	243.0876516	4.338	[M+H]+	5326566
LYSINE	147.1128037	0.65	[M+H]+	5962
MALIC ACID	135.0287993	1.657	[M+H]+	92824, 222656
MALTOTRIOSE, RAFFINOSE	505.1763109	0.818	[M+H]+	10542, 439586
METHIONINE	150.0583256	1.157	[M+H]+	6137
METHYL INDOLE-3-ACETATE	190.0862546	4.644	[M+H]+	74706
METHYL NICOTINIC ACID	138.0549545	2.972	[M+H]+	7151
METHYLMALONIC ACID	119.0338847	1.742	[M+H]+	487
METHYLSUCCINIC ACID	133.0495347	2.297	[M+H]+	10349
MEVALONOLACTONE	131.0702702	1.721	[M+H]+	5325923
N-(3-INDOLYLACETYL)-ALANINE	247.1077183	3.792	[M+H]+	644225
N-(3-PHENYLPROPIONYL)GLYCINE	225.1233663	2.112	[M+NH4]+	152323
N-(CINNAMOYL)GLYCINE	206.0811692	3.981	[M+H]+	709625
N-ACETYL-ASPARTIC ACID	176.0553484	1.165	[M+H]+	65065
N-ACETYL-GALACTOSAMINE, N-ACETYL-GLUCOSAMINE, N-ACETYL-MANNOSAMINE	222.0972132	0.823	[M+H]+	84265, 439174, 439281
N-ACETYL-GLUTAMIC ACID	190.0709985	1.485	[M+H]+	185
N-ACETYL-LEUCINE	174.1124693	3.685	[M+H]+	70912
N-ACETYL-METHIONINE	192.0688903	2.772	[M+H]+	6180
N-ACETYL-PHENYLALANINE	208.0968193	3.805	[M+H]+	74839
N-ACETYL-TYROSINE	224.0917339	2.716	[M+H]+	68310
N-ACETYLMURAMIC ACID	294.1183426	1.418	[M+H]+	5462244
N-ACETYLNEURAMINATE	310.1132572	0.818	[M+H]+	439197
N-ACETYLPUTRESCINE	131.1178891	0.843	[M+H]+	122356
N-ACETYLTRYPTOPHAN	247.1077183	3.7425	[M+H]+	2002, 439917
N-ALPHA-ACETYL-ASPARAGINE	175.0713328	0.825	[M+H]+	99715
N-ALPHA-ACETYL-LYSINE	189.1233684	0.831	[M+H]+	192590
N-AMIDINO-ASPARTIC ACID	176.0665818	0.771	[M+H]+	439918
N-BUTYRYLGLYCINE	146.0811692	2.205	[M+H]+	88412
N-FORMYL-METHIONINE	178.0532402	2.597	[M+H]+	6995182
N-METHYL-GLUTAMATE	162.0760838	0.783	[M+H]+	439377
N-OMEGA-METHYLTRYPTAMINE	175.1229745	2.582	[M+H]+	6088
N,N-DIMETHYLGLYCINE	104.0706045	0.743	[M+H]+	673
N6-(DELTA2-ISOPENTENYL)-ADENINE	204.1243714	3.655	[M+H]+	92180
NEPSILON,NEPSILON,NEPSILON-TRIMETHYLLYSINE	189.1597539	0.662	[M+H]+	440120
NICOTINAMIDE	123.0552888	1.206	[M+H]+	936
NICOTINAMIDE MONONUCLEOTIDE	335.0638781	0.828	[M+H]+	14180
NICOTINE	163.1229745	0.826	[M+H]+	89594
NICOTINIC ACID, PICOLINIC ACID	124.0393044	1.13	[M+H]+	938, 1018
NICOTINURIC ACID	181.0607681	1.556	[M+H]+	68499
NORADRENALINE	170.0811692	0.761	[M+H]+	439260
O-ACETYL-SERINE	148.0604338	0.815	[M+H]+	99478
OCTANOYLCARNITINE	288.2169344	4.387	[M+H]+	11953814
OPHTHALMIC ACID	290.1346613	1.447	[M+H]+	7018721
ORNITHINE	133.0971536	0.653	[M+H]+	6262, 71082
P-ANISALDEHYDE	137.0597055	1.18	[M+H]+	31244
P-COUMARIC ACID	165.0546201	3.605	[M+H]+	637542
PALMITIC ACID	257.2475063	6.46	[M+H]+	985
PANTOTHENIC ACID	220.1179486	2.37	[M+H]+	988, 6613
PENTANEDECANOIC ACID	243.2318562	6.224	[M+H]+	13849
PHENOLSULFONIC ACID	175.0059557	1.114	[M+H]+	4765
PHENYLACETIC ACID	137.0597055	2.679	[M+H]+	999
PHENYLACETYL-GLUTAMINE	265.118283	3.064	[M+H]+	92258
PHENYLACETYLGLYCINE	194.0811692	3.305	[M+H]+	68144
PHENYLALANINE	166.0862546	1.981	[M+H]+	6140
PHENYLPROPIOLIC ACID	147.0440554	4.35	[M+H]+	69475
PHOSPHOCHOLINE	184.07387	0.735	[M]+	1014
PIPECOLIC ACID	130.0862546	0.849	[M+H]+	439227
PROLINE	116.0706045	0.811	[M+H]+	8988, 145742
PROPIONYLCARNITINE	218.1386841	1.587	[M+H]+	107738
PROPIONYLGLYCINE	132.0655192	1.534	[M+H]+	98681
PROPYL GALLIC ACID	213.0757495	4.139	[M+H]+	4947
PROPYLPARABEN	181.0859202	5.083	[M+H]+	7175
PUTRESCINE	89.10732439	0.606	[M+H]+	1045
PYRIDOXAL	168.0655192	0.837	[M+H]+	1050
PYRIDOXAMINE	169.0971536	0.695	[M+H]+	1052
PYRIDOXINE	170.0811692	1.387	[M+H]+	1054
PYROGALLOL	127.0389701	1.741	[M+H]+	1057
PYROGLUTAMIC ACID	130.0498691	1.422	[M+H]+	499, 7405, 439685
QUINIC ACID	193.0706641	0.84	[M+H]+	6508
RAC-GLYCEROL 1-MYRISTATE	303.2529856	5.898	[M+H]+	79050
RESVERATROL	229.0859202	4	[M+H]+	445154
RIBOFLAVIN	377.1455604	3.255	[M+H]+	493570
S-(5'-ADENOSYL)-L-HOMOCYSTEINE	385.1288648	1.522	[M+H]+	439155
S-CARBOXYMETHYL-CYSTEINE	180.0325048	0.834	[M+H]+	193653
SACCHARIN	184.00629	2.67	[M+H]+	5143
SALICYLHYDROXAMIC ACID	154.0498691	2.815	[M+H]+	66644
SEBACIC ACID	220.1543321	4.748	[M+NH4]+	5192
SELENOMETHIONINE	198.0027759	1.437	[M+H]+	105024
SERINE	106.0498691	0.705	[M+H]+	5951
SEROTONIN	177.102239	1.617	[M+H]+	5202
SN-GLYCERO-3-PHOSPHOCHOLINE	258.1101	0.747	[M+H]+	657272
SPERMIDINE	146.1651736	0.588	[M+H]+	1102
SPERMINE	203.2230229	0.581	[M+H]+	1103
SPHINGANINE	302.3053555	5.302	[M+H]+	91486
STEARIC ACID	285.2788064	5.99	[M+H]+	5281
SUBERIC ACID	197.0784269	3.833	[M+Na]+	10457
SUBERYL GLYCINE	232.1179486	3.163	[M+H]+	6453952
SUCCINIC ACID	119.0338847	1.24	[M+H]+	1110
SYRINGIC ACID	199.0600994	3.218	[M+H]+	10742
TAURINE	126.0219401	0.718	[M+H]+	1123
THIAMINE MONOPHOSPHATE	345.0786383	0.74	[M]+	1131
THYMIDINE	243.0975476	2.108	[M+H]+	5789
THYMINE	127.0502034	1.673	[M+H]+	1135
THYROXINE	777.6939758	5.17	[M+H]+	5819
TIGLYL GLYCINE	158.0811692	2.668	[M+H]+	6441567
TRANEXAMIC ACID	158.1175547	1.19	[M+H]+	5526
TRIGONELLINE	138.0549545	0.797	[M+H]+	5570
TRIMETHYLAMINE N-OXIDE	76.07568991	0.707	[M+H]+	1145
TRYPTOPHAN	205.0971536	2.581	[M+H]+	6305
TRYPTOPHANAMIDE	204.1131381	2.211	[M+H]+	439356
TYRAMINE	138.09134	1.51	[M+H]+	5610
TYROSINE	182.0811692	1.489	[M+H]+	6057
URACIL	113.0345534	1.115	[M+H]+	1174
URIDINE	245.0768121	1.515	[M+H]+	6029
UROCANIC ACID	139.0502034	0.856	[M+H]+	736715
URSOCHOLIC ACID	426.3213974	5.223	[M+NH4]+	122340
VALINE	118.0862546	1.042	[M+H]+	6287
VANILLIC ACID	169.0495347	3.155	[M+H]+	8468
XANTHOSINE	285.0829601	1.75	[M+H]+	64959
XANTHURENIC ACID	206.0447837	2.943	[M+H]+	5699
METABOLITES_END
#END