#METABOLOMICS WORKBENCH wpathmasiri_20210526_064245 DATATRACK_ID:2655 STUDY_ID:ST001813 ANALYSIS_ID:AN002939 PROJECT_ID:PR001146 VERSION 1 CREATED_ON June 3, 2021, 9:48 am #PROJECT PR:PROJECT_TYPE Metabolomics Analysis PR:PROJECT_SUMMARY Broad spectrum NMR metabolomics data was acquired from feces collected from PR:PROJECT_SUMMARY infants at age 6 weeks (n=158) and 1 year (n=282) of life who are enrolled in PR:PROJECT_SUMMARY the New Hampshire Birth Cohort. NMR binned data (untargeted) and relative PR:PROJECT_SUMMARY concentration data (semi-targeted) were integrated with these subject’s PR:PROJECT_SUMMARY microbiome data using statistical and machine learning-based methods to PR:PROJECT_SUMMARY characterize the taxa-function relationship in early life. PR:INSTITUTE Dartmouth College PR:DEPARTMENT Department of Epidemiology PR:FIRST_NAME Margaret PR:ADDRESS One Medical Center Road, 7927 HB, Rubin Building, Lebanon, NH 03756, USA PR:EMAIL Margaret.Karagas@Dartmouth.edu PR:PHONE 603-653-9010 PR:FUNDING_SOURCE National Institutes of Health (grants NLM R01LM012723, NIGMS P20GM104416, NCI PR:FUNDING_SOURCE P30CA023108, NCI R21CA253408, NLM K01LM012426, NIH UG3 OD023275, NIEHS PR:FUNDING_SOURCE P01ES022832 and EPA RD-83544201) PR:PROJECT_COMMENTS For further details, contact Margaret Karagass for information on the New PR:PROJECT_COMMENTS Hampshire Birth Cohort Study PR:PROJECT_TITLE Associations between the gut microbiome and metabolome in early life PR:LAST_NAME Karagas #STUDY ST:STUDY_TITLE Associations between the gut microbiome and metabolome in early life ST:STUDY_SUMMARY The infant intestinal microbiome plays an important role in metabolism and ST:STUDY_SUMMARY immune development with impacts on lifelong health. The linkage between the ST:STUDY_SUMMARY taxonomic composition of the microbiome and its metabolic phenotype is undefined ST:STUDY_SUMMARY and complicated by redundancies in the taxon-function relationship within ST:STUDY_SUMMARY microbial communities. To inform a more mechanistic understanding of the ST:STUDY_SUMMARY relationship between the microbiome and health, we performed an integrative ST:STUDY_SUMMARY statistical and machine learning-based analysis of microbe taxonomic structure ST:STUDY_SUMMARY and metabolic function (using untargeted (binned) NMR and relative concentration ST:STUDY_SUMMARY data) in order to characterize the taxa-function relationship in early life. ST:INSTITUTE University of North Carolina at Chapel Hill ST:DEPARTMENT Nutrition ST:LABORATORY Metabolomics and Exposome Laboratory at UNC CH Nutrition Research Institute ST:LAST_NAME Sumner ST:FIRST_NAME Susan ST:ADDRESS 500 Laureate Way, Kannapolis, NC, 28081, USA ST:EMAIL susan_sumner@unc.edu ST:TOTAL_SUBJECTS 440 ST:STUDY_TYPE Untargeted and semi-targeted metabolomics analysis ST:PHONE 919-541-6861 #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 #FACTORS #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 - BD1_P1 Timepoint:NA | Sample Type:QC RAW_FILE_NAME=BD1_P1 SUBJECT_SAMPLE_FACTORS - BD1_P2 Timepoint:NA | Sample Type:QC RAW_FILE_NAME=BD1_P2 SUBJECT_SAMPLE_FACTORS - BD1_P3 Timepoint:NA | Sample Type:QC RAW_FILE_NAME=BD1_P3 SUBJECT_SAMPLE_FACTORS - BD1_P4 Timepoint:NA | Sample Type:QC RAW_FILE_NAME=BD1_P4 SUBJECT_SAMPLE_FACTORS - 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S_149_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_149_1Y SUBJECT_SAMPLE_FACTORS - S_15_R_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_15_R_1Y SUBJECT_SAMPLE_FACTORS - S_150 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_150 SUBJECT_SAMPLE_FACTORS - S_150_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_150_1Y SUBJECT_SAMPLE_FACTORS - S_151_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_151_6W SUBJECT_SAMPLE_FACTORS - S_152_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_152_6W SUBJECT_SAMPLE_FACTORS - S_153_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_153_1Y SUBJECT_SAMPLE_FACTORS - S_154_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_154_1Y SUBJECT_SAMPLE_FACTORS - S_155 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_155 SUBJECT_SAMPLE_FACTORS - S_155_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_155_1Y SUBJECT_SAMPLE_FACTORS - S_156 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_156 SUBJECT_SAMPLE_FACTORS - S_156_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_156_1Y SUBJECT_SAMPLE_FACTORS - 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S_165_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_165_6W SUBJECT_SAMPLE_FACTORS - S_166_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_166_1Y SUBJECT_SAMPLE_FACTORS - S_167_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_167_6W SUBJECT_SAMPLE_FACTORS - S_168 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_168 SUBJECT_SAMPLE_FACTORS - S_168_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_168_1Y SUBJECT_SAMPLE_FACTORS - S_169_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_169_1Y SUBJECT_SAMPLE_FACTORS - S_17_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_17_1Y SUBJECT_SAMPLE_FACTORS - S_170_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_170_6W SUBJECT_SAMPLE_FACTORS - S_171_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_171_1Y SUBJECT_SAMPLE_FACTORS - S_172_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_172_6W SUBJECT_SAMPLE_FACTORS - S_173_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_173_1Y SUBJECT_SAMPLE_FACTORS - S_174_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_174_1Y SUBJECT_SAMPLE_FACTORS - S_175_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_175_6W SUBJECT_SAMPLE_FACTORS - S_176 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_176 SUBJECT_SAMPLE_FACTORS - S_176_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_176_6W SUBJECT_SAMPLE_FACTORS - S_177_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_177_1Y SUBJECT_SAMPLE_FACTORS - S_178_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_178_1Y SUBJECT_SAMPLE_FACTORS - S_179 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_179 SUBJECT_SAMPLE_FACTORS - S_179_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_179_6W SUBJECT_SAMPLE_FACTORS - S_18 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_18 SUBJECT_SAMPLE_FACTORS - S_18_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_18_1Y SUBJECT_SAMPLE_FACTORS - S_180_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_180_6W SUBJECT_SAMPLE_FACTORS - S_181_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_181_1Y SUBJECT_SAMPLE_FACTORS - S_182_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_182_1Y SUBJECT_SAMPLE_FACTORS - S_183_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_183_6W SUBJECT_SAMPLE_FACTORS - S_184_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_184_1Y SUBJECT_SAMPLE_FACTORS - S_186_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_186_1Y SUBJECT_SAMPLE_FACTORS - S_187 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_187 SUBJECT_SAMPLE_FACTORS - S_187_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_187_6W SUBJECT_SAMPLE_FACTORS - S_188_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_188_1Y SUBJECT_SAMPLE_FACTORS - S_189_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_189_6W SUBJECT_SAMPLE_FACTORS - S_19_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_19_6W SUBJECT_SAMPLE_FACTORS - S_190_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_190_1Y SUBJECT_SAMPLE_FACTORS - S_191 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_191 SUBJECT_SAMPLE_FACTORS - S_191_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_191_1Y SUBJECT_SAMPLE_FACTORS - S_192_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_192_6W SUBJECT_SAMPLE_FACTORS - S_193_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_193_6W SUBJECT_SAMPLE_FACTORS - S_194_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_194_1Y SUBJECT_SAMPLE_FACTORS - S_195_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_195_1Y SUBJECT_SAMPLE_FACTORS - S_196_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_196_1Y SUBJECT_SAMPLE_FACTORS - S_197 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_197 SUBJECT_SAMPLE_FACTORS - S_197_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_197_6W SUBJECT_SAMPLE_FACTORS - S_198_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_198_1Y SUBJECT_SAMPLE_FACTORS - S_199_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_199_1Y SUBJECT_SAMPLE_FACTORS - S_2_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_2_1Y SUBJECT_SAMPLE_FACTORS - S_20 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_20 SUBJECT_SAMPLE_FACTORS - S_20_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_20_1Y SUBJECT_SAMPLE_FACTORS - S_200 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_200 SUBJECT_SAMPLE_FACTORS - S_200_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_200_6W SUBJECT_SAMPLE_FACTORS - S_201_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_201_1Y SUBJECT_SAMPLE_FACTORS - S_202_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_202_6W SUBJECT_SAMPLE_FACTORS - S_203 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_203 SUBJECT_SAMPLE_FACTORS - S_203_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_203_1Y SUBJECT_SAMPLE_FACTORS - S_204_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_204_1Y SUBJECT_SAMPLE_FACTORS - S_205_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_205_1Y SUBJECT_SAMPLE_FACTORS - S_206_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_206_6W SUBJECT_SAMPLE_FACTORS - S_207 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_207 SUBJECT_SAMPLE_FACTORS - S_207_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_207_1Y SUBJECT_SAMPLE_FACTORS - S_208 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_208 SUBJECT_SAMPLE_FACTORS - S_208_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_208_1Y SUBJECT_SAMPLE_FACTORS - S_209_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_209_1Y SUBJECT_SAMPLE_FACTORS - S_21_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_21_6W SUBJECT_SAMPLE_FACTORS - S_210_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_210_1Y SUBJECT_SAMPLE_FACTORS - S_211_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_211_6W SUBJECT_SAMPLE_FACTORS - S_212_R_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_212_R_1Y SUBJECT_SAMPLE_FACTORS - S_213_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_213_1Y SUBJECT_SAMPLE_FACTORS - S_214 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_214 SUBJECT_SAMPLE_FACTORS - S_214_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_214_1Y SUBJECT_SAMPLE_FACTORS - S_215 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_215 SUBJECT_SAMPLE_FACTORS - S_215_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_215_6W SUBJECT_SAMPLE_FACTORS - S_216 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_216 SUBJECT_SAMPLE_FACTORS - S_216_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_216_1Y SUBJECT_SAMPLE_FACTORS - S_217_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_217_1Y SUBJECT_SAMPLE_FACTORS - S_218_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_218_1Y SUBJECT_SAMPLE_FACTORS - S_219 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_219 SUBJECT_SAMPLE_FACTORS - S_22_R_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_22_R_1Y SUBJECT_SAMPLE_FACTORS - S_220 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_220 SUBJECT_SAMPLE_FACTORS - S_220_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_220_6W SUBJECT_SAMPLE_FACTORS - S_221_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_221_1Y SUBJECT_SAMPLE_FACTORS - S_222_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_222_1Y SUBJECT_SAMPLE_FACTORS - S_223_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_223_1Y SUBJECT_SAMPLE_FACTORS - S_224_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_224_1Y SUBJECT_SAMPLE_FACTORS - S_225 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_225 SUBJECT_SAMPLE_FACTORS - S_225_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_225_6W SUBJECT_SAMPLE_FACTORS - S_226_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_226_1Y SUBJECT_SAMPLE_FACTORS - S_227_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_227_1Y SUBJECT_SAMPLE_FACTORS - S_229 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_229 SUBJECT_SAMPLE_FACTORS - S_229_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_229_6W SUBJECT_SAMPLE_FACTORS - S_23_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_23_6W SUBJECT_SAMPLE_FACTORS - S_230_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_230_1Y SUBJECT_SAMPLE_FACTORS - S_231_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_231_1Y SUBJECT_SAMPLE_FACTORS - S_232 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_232 SUBJECT_SAMPLE_FACTORS - S_232_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_232_1Y SUBJECT_SAMPLE_FACTORS - S_233 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_233 SUBJECT_SAMPLE_FACTORS - S_233_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_233_6W SUBJECT_SAMPLE_FACTORS - S_234_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_234_1Y SUBJECT_SAMPLE_FACTORS - S_235 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_235 SUBJECT_SAMPLE_FACTORS - S_235_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_235_1Y SUBJECT_SAMPLE_FACTORS - S_236_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_236_1Y SUBJECT_SAMPLE_FACTORS - S_237_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_237_1Y SUBJECT_SAMPLE_FACTORS - S_238 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_238 SUBJECT_SAMPLE_FACTORS - S_238_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_238_6W SUBJECT_SAMPLE_FACTORS - S_239 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_239 SUBJECT_SAMPLE_FACTORS - S_239_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_239_1Y SUBJECT_SAMPLE_FACTORS - S_24_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_24_1Y SUBJECT_SAMPLE_FACTORS - S_240 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_240 SUBJECT_SAMPLE_FACTORS - S_240_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_240_1Y SUBJECT_SAMPLE_FACTORS - S_241_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_241_1Y SUBJECT_SAMPLE_FACTORS - S_242_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_242_1Y SUBJECT_SAMPLE_FACTORS - S_243_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_243_6W SUBJECT_SAMPLE_FACTORS - S_244 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_244 SUBJECT_SAMPLE_FACTORS - S_244_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_244_1Y SUBJECT_SAMPLE_FACTORS - S_245_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_245_1Y SUBJECT_SAMPLE_FACTORS - S_246_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_246_1Y SUBJECT_SAMPLE_FACTORS - S_247_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_247_6W SUBJECT_SAMPLE_FACTORS - S_248_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_248_6W SUBJECT_SAMPLE_FACTORS - S_249_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_249_1Y SUBJECT_SAMPLE_FACTORS - S_25_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_25_6W SUBJECT_SAMPLE_FACTORS - S_251_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_251_1Y SUBJECT_SAMPLE_FACTORS - S_252 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_252 SUBJECT_SAMPLE_FACTORS - S_252_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_252_1Y SUBJECT_SAMPLE_FACTORS - S_253_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_253_6W SUBJECT_SAMPLE_FACTORS - S_254 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_254 SUBJECT_SAMPLE_FACTORS - S_254_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_254_1Y SUBJECT_SAMPLE_FACTORS - S_255_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_255_1Y SUBJECT_SAMPLE_FACTORS - S_256_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_256_1Y SUBJECT_SAMPLE_FACTORS - S_257_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_257_6W SUBJECT_SAMPLE_FACTORS - S_258_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_258_1Y SUBJECT_SAMPLE_FACTORS - S_259_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_259_1Y SUBJECT_SAMPLE_FACTORS - S_26 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_26 SUBJECT_SAMPLE_FACTORS - S_26_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_26_1Y SUBJECT_SAMPLE_FACTORS - S_260 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_260 SUBJECT_SAMPLE_FACTORS - S_260_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_260_1Y SUBJECT_SAMPLE_FACTORS - S_262_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_262_6W SUBJECT_SAMPLE_FACTORS - S_263_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_263_1Y SUBJECT_SAMPLE_FACTORS - S_264 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_264 SUBJECT_SAMPLE_FACTORS - S_264_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_264_1Y SUBJECT_SAMPLE_FACTORS - S_265 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_265 SUBJECT_SAMPLE_FACTORS - S_265_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_265_6W SUBJECT_SAMPLE_FACTORS - S_266 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_266 SUBJECT_SAMPLE_FACTORS - S_266_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_266_6W SUBJECT_SAMPLE_FACTORS - S_267_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_267_1Y SUBJECT_SAMPLE_FACTORS - S_268_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_268_1Y SUBJECT_SAMPLE_FACTORS - S_269_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_269_6W SUBJECT_SAMPLE_FACTORS - S_27_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_27_6W SUBJECT_SAMPLE_FACTORS - S_270_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_270_6W SUBJECT_SAMPLE_FACTORS - S_271_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_271_1Y SUBJECT_SAMPLE_FACTORS - S_272_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_272_1Y SUBJECT_SAMPLE_FACTORS - S_273_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_273_1Y SUBJECT_SAMPLE_FACTORS - S_274 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_274 SUBJECT_SAMPLE_FACTORS - S_274_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_274_1Y SUBJECT_SAMPLE_FACTORS - S_275_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_275_1Y SUBJECT_SAMPLE_FACTORS - S_276 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_276 SUBJECT_SAMPLE_FACTORS - S_276_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_276_6W SUBJECT_SAMPLE_FACTORS - S_277_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_277_6W SUBJECT_SAMPLE_FACTORS - S_278_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_278_1Y SUBJECT_SAMPLE_FACTORS - S_279 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_279 SUBJECT_SAMPLE_FACTORS - S_28_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_28_1Y SUBJECT_SAMPLE_FACTORS - S_281 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_281 SUBJECT_SAMPLE_FACTORS - S_281_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_281_6W SUBJECT_SAMPLE_FACTORS - S_282_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_282_1Y SUBJECT_SAMPLE_FACTORS - S_283_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_283_1Y SUBJECT_SAMPLE_FACTORS - S_284_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_284_1Y SUBJECT_SAMPLE_FACTORS - S_285 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_285 SUBJECT_SAMPLE_FACTORS - S_285_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_285_1Y SUBJECT_SAMPLE_FACTORS - S_286_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_286_6W SUBJECT_SAMPLE_FACTORS - S_288_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_288_1Y SUBJECT_SAMPLE_FACTORS - S_289 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_289 SUBJECT_SAMPLE_FACTORS - S_29 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_29 SUBJECT_SAMPLE_FACTORS - S_290_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_290_1Y SUBJECT_SAMPLE_FACTORS - S_291_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_291_6W SUBJECT_SAMPLE_FACTORS - S_292 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_292 SUBJECT_SAMPLE_FACTORS - S_292_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_292_1Y SUBJECT_SAMPLE_FACTORS - S_293_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_293_1Y SUBJECT_SAMPLE_FACTORS - S_295_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_295_6W SUBJECT_SAMPLE_FACTORS - S_296_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_296_6W SUBJECT_SAMPLE_FACTORS - S_297_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_297_1Y SUBJECT_SAMPLE_FACTORS - S_298_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_298_1Y SUBJECT_SAMPLE_FACTORS - S_299_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_299_1Y SUBJECT_SAMPLE_FACTORS - S_3_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_3_1Y SUBJECT_SAMPLE_FACTORS - S_30_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_30_1Y SUBJECT_SAMPLE_FACTORS - S_300_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_300_1Y SUBJECT_SAMPLE_FACTORS - S_301 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_301 SUBJECT_SAMPLE_FACTORS - S_301_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_301_6W SUBJECT_SAMPLE_FACTORS - S_302_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_302_1Y SUBJECT_SAMPLE_FACTORS - S_303 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_303 SUBJECT_SAMPLE_FACTORS - S_303_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_303_1Y SUBJECT_SAMPLE_FACTORS - S_304_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_304_1Y SUBJECT_SAMPLE_FACTORS - S_305_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_305_6W SUBJECT_SAMPLE_FACTORS - S_306_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_306_1Y SUBJECT_SAMPLE_FACTORS - S_307 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_307 SUBJECT_SAMPLE_FACTORS - S_307_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_307_1Y SUBJECT_SAMPLE_FACTORS - S_308_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_308_1Y SUBJECT_SAMPLE_FACTORS - S_31_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_31_1Y SUBJECT_SAMPLE_FACTORS - S_311 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_311 SUBJECT_SAMPLE_FACTORS - S_312 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_312 SUBJECT_SAMPLE_FACTORS - S_313 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_313 SUBJECT_SAMPLE_FACTORS - S_314 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_314 SUBJECT_SAMPLE_FACTORS - S_317 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_317 SUBJECT_SAMPLE_FACTORS - S_318 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_318 SUBJECT_SAMPLE_FACTORS - S_319 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_319 SUBJECT_SAMPLE_FACTORS - S_32_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_32_6W SUBJECT_SAMPLE_FACTORS - S_320 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_320 SUBJECT_SAMPLE_FACTORS - S_332 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_332 SUBJECT_SAMPLE_FACTORS - S_335 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_335 SUBJECT_SAMPLE_FACTORS - S_337 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_337 SUBJECT_SAMPLE_FACTORS - S_339 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_339 SUBJECT_SAMPLE_FACTORS - S_34 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_34 SUBJECT_SAMPLE_FACTORS - S_34_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_34_6W SUBJECT_SAMPLE_FACTORS - S_340 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_340 SUBJECT_SAMPLE_FACTORS - S_348 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_348 SUBJECT_SAMPLE_FACTORS - S_349 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_349 SUBJECT_SAMPLE_FACTORS - S_35_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_35_1Y SUBJECT_SAMPLE_FACTORS - S_351 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_351 SUBJECT_SAMPLE_FACTORS - S_354 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_354 SUBJECT_SAMPLE_FACTORS - S_355 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_355 SUBJECT_SAMPLE_FACTORS - S_36_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_36_1Y SUBJECT_SAMPLE_FACTORS - S_368 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_368 SUBJECT_SAMPLE_FACTORS - S_37 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_37 SUBJECT_SAMPLE_FACTORS - S_37_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_37_1Y SUBJECT_SAMPLE_FACTORS - S_371 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_371 SUBJECT_SAMPLE_FACTORS - S_375 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_375 SUBJECT_SAMPLE_FACTORS - S_376 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_376 SUBJECT_SAMPLE_FACTORS - S_38 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_38 SUBJECT_SAMPLE_FACTORS - S_38_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_38_1Y SUBJECT_SAMPLE_FACTORS - S_381 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_381 SUBJECT_SAMPLE_FACTORS - S_383 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_383 SUBJECT_SAMPLE_FACTORS - S_386 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_386 SUBJECT_SAMPLE_FACTORS - S_39_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_39_1Y SUBJECT_SAMPLE_FACTORS - S_391 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_391 SUBJECT_SAMPLE_FACTORS - S_393 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_393 SUBJECT_SAMPLE_FACTORS - S_4 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_4 SUBJECT_SAMPLE_FACTORS - S_4_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_4_6W SUBJECT_SAMPLE_FACTORS - S_40_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_40_6W SUBJECT_SAMPLE_FACTORS - S_406 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_406 SUBJECT_SAMPLE_FACTORS - S_409 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_409 SUBJECT_SAMPLE_FACTORS - S_41_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_41_1Y SUBJECT_SAMPLE_FACTORS - S_410 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_410 SUBJECT_SAMPLE_FACTORS - S_411 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_411 SUBJECT_SAMPLE_FACTORS - S_412 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_412 SUBJECT_SAMPLE_FACTORS - S_413 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_413 SUBJECT_SAMPLE_FACTORS - S_418 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_418 SUBJECT_SAMPLE_FACTORS - S_42 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_42 SUBJECT_SAMPLE_FACTORS - S_42_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_42_6W SUBJECT_SAMPLE_FACTORS - S_420 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_420 SUBJECT_SAMPLE_FACTORS - S_422 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_422 SUBJECT_SAMPLE_FACTORS - S_426 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_426 SUBJECT_SAMPLE_FACTORS - S_43_R_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_43_R_1Y SUBJECT_SAMPLE_FACTORS - S_435 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_435 SUBJECT_SAMPLE_FACTORS - S_437 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_437 SUBJECT_SAMPLE_FACTORS - S_44_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_44_1Y SUBJECT_SAMPLE_FACTORS - S_440 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_440 SUBJECT_SAMPLE_FACTORS - S_444 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_444 SUBJECT_SAMPLE_FACTORS - S_445 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_445 SUBJECT_SAMPLE_FACTORS - S_45_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_45_6W SUBJECT_SAMPLE_FACTORS - S_455 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_455 SUBJECT_SAMPLE_FACTORS - S_457 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_457 SUBJECT_SAMPLE_FACTORS - S_46 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_46 SUBJECT_SAMPLE_FACTORS - S_46_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_46_1Y SUBJECT_SAMPLE_FACTORS - S_463 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_463 SUBJECT_SAMPLE_FACTORS - S_468 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_468 SUBJECT_SAMPLE_FACTORS - S_47_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_47_6W SUBJECT_SAMPLE_FACTORS - S_471 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_471 SUBJECT_SAMPLE_FACTORS - S_476 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_476 SUBJECT_SAMPLE_FACTORS - S_479 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_479 SUBJECT_SAMPLE_FACTORS - S_48_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_48_1Y SUBJECT_SAMPLE_FACTORS - S_480 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_480 SUBJECT_SAMPLE_FACTORS - S_481 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_481 SUBJECT_SAMPLE_FACTORS - S_485 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_485 SUBJECT_SAMPLE_FACTORS - S_486 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_486 SUBJECT_SAMPLE_FACTORS - S_488 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_488 SUBJECT_SAMPLE_FACTORS - S_489 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_489 SUBJECT_SAMPLE_FACTORS - S_49_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_49_6W SUBJECT_SAMPLE_FACTORS - S_495 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_495 SUBJECT_SAMPLE_FACTORS - S_498 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_498 SUBJECT_SAMPLE_FACTORS - S_5_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_5_1Y SUBJECT_SAMPLE_FACTORS - S_50_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_50_1Y SUBJECT_SAMPLE_FACTORS - S_503 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_503 SUBJECT_SAMPLE_FACTORS - S_506 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_506 SUBJECT_SAMPLE_FACTORS - S_507 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_507 SUBJECT_SAMPLE_FACTORS - S_509 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_509 SUBJECT_SAMPLE_FACTORS - S_51 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_51 SUBJECT_SAMPLE_FACTORS - S_51_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_51_6W SUBJECT_SAMPLE_FACTORS - S_511 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_511 SUBJECT_SAMPLE_FACTORS - S_515 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_515 SUBJECT_SAMPLE_FACTORS - S_517 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_517 SUBJECT_SAMPLE_FACTORS - S_519 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_519 SUBJECT_SAMPLE_FACTORS - S_52 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_52 SUBJECT_SAMPLE_FACTORS - S_52_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_52_1Y SUBJECT_SAMPLE_FACTORS - S_520 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_520 SUBJECT_SAMPLE_FACTORS - S_523 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_523 SUBJECT_SAMPLE_FACTORS - S_53_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_53_1Y SUBJECT_SAMPLE_FACTORS - S_530 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_530 SUBJECT_SAMPLE_FACTORS - S_534 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_534 SUBJECT_SAMPLE_FACTORS - S_539 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_539 SUBJECT_SAMPLE_FACTORS - S_54_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_54_6W SUBJECT_SAMPLE_FACTORS - S_540 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_540 SUBJECT_SAMPLE_FACTORS - S_541 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_541 SUBJECT_SAMPLE_FACTORS - S_55_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_55_1Y SUBJECT_SAMPLE_FACTORS - S_550 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_550 SUBJECT_SAMPLE_FACTORS - S_56 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_56 SUBJECT_SAMPLE_FACTORS - S_57_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_57_1Y SUBJECT_SAMPLE_FACTORS - S_59 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_59 SUBJECT_SAMPLE_FACTORS - S_59_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_59_6W SUBJECT_SAMPLE_FACTORS - S_6_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_6_6W SUBJECT_SAMPLE_FACTORS - S_60_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_60_1Y SUBJECT_SAMPLE_FACTORS - S_61_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_61_1Y SUBJECT_SAMPLE_FACTORS - S_62_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_62_6W SUBJECT_SAMPLE_FACTORS - S_63 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_63 SUBJECT_SAMPLE_FACTORS - S_64_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_64_6W SUBJECT_SAMPLE_FACTORS - S_65_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_65_1Y SUBJECT_SAMPLE_FACTORS - S_66 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_66 SUBJECT_SAMPLE_FACTORS - S_66_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_66_6W SUBJECT_SAMPLE_FACTORS - S_67 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_67 SUBJECT_SAMPLE_FACTORS - S_68 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_68 SUBJECT_SAMPLE_FACTORS - S_69 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_69 SUBJECT_SAMPLE_FACTORS - S_7_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_7_1Y SUBJECT_SAMPLE_FACTORS - S_71 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_71 SUBJECT_SAMPLE_FACTORS - S_71_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_71_1Y SUBJECT_SAMPLE_FACTORS - S_72 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_72 SUBJECT_SAMPLE_FACTORS - S_72_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_72_6W SUBJECT_SAMPLE_FACTORS - S_73_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_73_1Y SUBJECT_SAMPLE_FACTORS - S_74 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_74 SUBJECT_SAMPLE_FACTORS - S_74_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_74_1Y SUBJECT_SAMPLE_FACTORS - S_75_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_75_6W SUBJECT_SAMPLE_FACTORS - S_76_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_76_1Y SUBJECT_SAMPLE_FACTORS - S_77_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_77_6W SUBJECT_SAMPLE_FACTORS - S_78_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_78_1Y SUBJECT_SAMPLE_FACTORS - S_79 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_79 SUBJECT_SAMPLE_FACTORS - S_79_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_79_1Y SUBJECT_SAMPLE_FACTORS - S_8 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_8 SUBJECT_SAMPLE_FACTORS - S_80_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_80_6W SUBJECT_SAMPLE_FACTORS - S_81_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_81_1Y SUBJECT_SAMPLE_FACTORS - S_83_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_83_1Y SUBJECT_SAMPLE_FACTORS - S_84_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_84_1Y SUBJECT_SAMPLE_FACTORS - S_85 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_85 SUBJECT_SAMPLE_FACTORS - S_85_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_85_6W SUBJECT_SAMPLE_FACTORS - S_86 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_86 SUBJECT_SAMPLE_FACTORS - S_86_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_86_1Y SUBJECT_SAMPLE_FACTORS - S_87_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_87_6W SUBJECT_SAMPLE_FACTORS - S_88_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_88_1Y SUBJECT_SAMPLE_FACTORS - S_89_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_89_6W SUBJECT_SAMPLE_FACTORS - S_90_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_90_1Y SUBJECT_SAMPLE_FACTORS - S_91_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_91_6W SUBJECT_SAMPLE_FACTORS - S_92_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_92_1Y SUBJECT_SAMPLE_FACTORS - S_94_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_94_1Y SUBJECT_SAMPLE_FACTORS - S_95 Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_95 SUBJECT_SAMPLE_FACTORS - S_95_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_95_6W SUBJECT_SAMPLE_FACTORS - S_96 Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_96 SUBJECT_SAMPLE_FACTORS - S_96_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_96_1Y SUBJECT_SAMPLE_FACTORS - S_97_6W Timepoint:6W | Sample Type:Sample RAW_FILE_NAME=S_97_6W SUBJECT_SAMPLE_FACTORS - S_98_1Y Timepoint:12M | Sample Type:Sample RAW_FILE_NAME=S_98_1Y #COLLECTION CO:COLLECTION_SUMMARY Feces collected from 6W and 1Y infants in the New Hampshire Birth Cohort CO:SAMPLE_TYPE Feces #TREATMENT TR:TREATMENT_SUMMARY None #SAMPLEPREP SP:SAMPLEPREP_SUMMARY De-identified stool aliquots were shipped on dry ice and immediately stored at SP:SAMPLEPREP_SUMMARY -80 °C for metabolomics analysis. Samples were randomized into batches. For SP:SAMPLEPREP_SUMMARY each batch, samples were thawed and ~150mg of stool was transferred to MagNA SP:SAMPLEPREP_SUMMARY Lyser tubes after recording the weight, Samples were then homogenized with 50% SP:SAMPLEPREP_SUMMARY acetonitrile in water by using the Omni Bead Disruptor (Omni International, GA, SP:SAMPLEPREP_SUMMARY USA). Homogenized samples were centrifuged at 16000 rcf and the supernatant was SP:SAMPLEPREP_SUMMARY separated into another tube. An aliquot (1000 uL, 100 mg equivalent of fecal SP:SAMPLEPREP_SUMMARY mass) was transferred into Eppendorf tube and lyophilized overnight. The dried SP:SAMPLEPREP_SUMMARY extract was reconstituted in 700 uL of NMR master mix (containing 0.2M SP:SAMPLEPREP_SUMMARY phosphate, 0.5 mM DSS-d6, and 0.2% sodium azide), vortexed on a multitube SP:SAMPLEPREP_SUMMARY vortexer at speed 5 for 2 min and centrifuged at 16000 rcf for 5 min. A 600 µl SP:SAMPLEPREP_SUMMARY aliquot of the supernatant was transferred into a pre-labeled 5mm NMR tube for SP:SAMPLEPREP_SUMMARY data acquisition on a 700 MHz spectrometer. Additionally, study pooled samples SP:SAMPLEPREP_SUMMARY (created from randomly selected study samples) and batch pooled quality control SP:SAMPLEPREP_SUMMARY (QC) samples were generated from supernatants of study samples and aliquots of SP:SAMPLEPREP_SUMMARY supernatants were dried and reconstituted similar to study samples described SP:SAMPLEPREP_SUMMARY above, and used for QC purposes. SP:SAMPLEPREP_PROTOCOL_FILENAME 1.Fecal_Metabolomics_Microbiome_Study_Procedures SP:PROCESSING_STORAGE_CONDITIONS 4℃ SP:EXTRACT_STORAGE -80℃ SP:SAMPLE_RESUSPENSION In phosphate buffer containing D2O #ANALYSIS AN:DATA_FORMAT fid, 1r #NMR NM:INSTRUMENT_NAME Avance III 700 MHz NMR Spectrometer NM:INSTRUMENT_TYPE FT-NMR NM:NMR_EXPERIMENT_TYPE 1D-1H NM:FIELD_FREQUENCY_LOCK 3015 Hz, D2O NM:STANDARD_CONCENTRATION 0.5 mM NM:SPECTROMETER_FREQUENCY 700 MHz NM:NMR_PROBE CP QCI/HPCN NM:NMR_SOLVENT 90% H2O, 10% D2O NM:NMR_TUBE_SIZE 5 mm NM:SHIMMING_METHOD topshim NM:PULSE_SEQUENCE noesygppr1d NM:WATER_SUPPRESSION pre-saturation NM:PULSE_WIDTH 14.59 us NM:POWER_LEVEL 12.3 Watts NM:RECEIVER_GAIN 36 NM:OFFSET_FREQUENCY 3290.61 Hz NM:PRESATURATION_POWER_LEVEL 0.0000964 Watts NM:CHEMICAL_SHIFT_REF_CPD DSS-d6 NM:TEMPERATURE 25 C NM:NUMBER_OF_SCANS 64 NM:DUMMY_SCANS 4 NM:ACQUISITION_TIME 3.9 seconds NM:RELAXATION_DELAY 2 seconds NM:SPECTRAL_WIDTH 12 ppm NM:NUM_DATA_POINTS_ACQUIRED 65536 NM:REAL_DATA_POINTS 32768 NM:LINE_BROADENING 0.5 Hz NM:ZERO_FILLING Yes NM:APODIZATION Lorentzian NM:BASELINE_CORRECTION_METHOD Polynomial NM:CHEMICAL_SHIFT_REF_STD DSS-d6 NM:BINNED_INCREMENT 0.04ppm NM:BINNED_DATA_EXCLUDED_RANGE 4.79 - 4.85 ppm (Water region) #NMR_METABOLITE_DATA NMR_METABOLITE_DATA:UNITS uM NMR_METABOLITE_DATA_START Samples BD1_P1 BD1_P2 BD1_P3 BD1_P4 BD2_P1 BD2_P2 BD2_P3 BD2_P4 BD3_P1 BD3_P2 BD3_P3 BD3_P4 BD4_P1 BD4_P2 BD4_P3 BD4_P4 BD5_P1 BD5_P2 BD5_P3 BD5_P4 BD6_P1 BD6_P2 BD6_P3 BD6_P4 D1_SP1 D1_SP2 D1_SP3 D1_SP4 D2_SP1 D2_SP2 D2_SP3 D2_SP4 D3_SP1 D3_SP2 D3_SP3 D3_SP4 D4_SP1 D4_SP2 D4_SP3 D4_SP4 D5_SP1 D5_SP2 D5_SP3 D5_SP4 D6_SP1 D6_SP2 D6_SP3 D6_SP4 P_1 P_10 P_11_R P_12 P_13 P_14 P_15 P_16 P_17 P_18 P_19 P_2 P_20 P_21 P_22 P_23 P_24 P_25 P_26 P_27 P_28 P_29 P_3 P_30 P_4 P_5 P_6 P_7 P_9 S_1_6W S_10_R_1Y S_101_1Y S_102_6W S_103 S_104 S_104_1Y S_105_1Y S_106_6W S_107_1Y S_108 S_108_6W S_109 S_110_1Y S_111_6W S_112 S_112_1Y S_113_6W S_114 S_114_1Y S_115_1Y S_116 S_116_R_6W S_117 S_118 S_118_6W S_119_1Y S_120 S_120_1Y S_121_6W S_122_1Y S_123_6W S_124_1Y S_125_1Y S_126_6W S_127_1Y S_128_6W S_129_1Y S_13 S_13_1Y S_130 S_130_1Y S_131 S_131_1Y S_132_1Y S_133_6W S_134 S_134_1Y S_135_1Y S_136_6W S_137_6W S_138 S_139_1Y S_140 S_140_6W S_141_1Y S_142_1Y S_143_6W S_144_R_6W S_145 S_145_1Y S_146 S_146_R_1Y S_147_1Y S_148_6W S_149_1Y S_15_R_1Y S_150 S_150_1Y S_151_6W S_152_6W S_153_1Y S_154_1Y S_155 S_155_1Y S_156 S_156_1Y S_157_6W S_158 S_158_R_1Y S_159_R_1Y S_16 S_16_R_6W S_160_6W S_161_R_1Y S_162_6W S_163_1Y S_164_1Y S_165_6W S_166_1Y S_167_6W S_168 S_168_1Y S_169_1Y S_17_1Y S_170_6W S_171_1Y S_172_6W S_173_1Y S_174_1Y S_175_6W S_176 S_176_6W S_177_1Y S_178_1Y S_179 S_179_6W S_18 S_18_1Y S_180_6W S_181_1Y S_182_1Y S_183_6W S_184_1Y S_186_1Y S_187 S_187_6W S_188_1Y S_189_6W S_19_6W S_190_1Y S_191 S_191_1Y S_192_6W S_193_6W S_194_1Y S_195_1Y S_196_1Y S_197 S_197_6W S_198_1Y S_199_1Y S_2_1Y S_20 S_20_1Y S_200 S_200_6W S_201_1Y S_202_6W S_203 S_203_1Y S_204_1Y S_205_1Y S_206_6W S_207 S_207_1Y S_208 S_208_1Y S_209_1Y S_21_6W S_210_1Y S_211_6W S_212_R_1Y S_213_1Y S_214 S_214_1Y S_215 S_215_6W S_216 S_216_1Y S_217_1Y S_218_1Y S_219 S_22_R_1Y S_220 S_220_6W S_221_1Y S_222_1Y S_223_1Y S_224_1Y S_225 S_225_6W S_226_1Y S_227_1Y S_229 S_229_6W S_23_6W S_230_1Y S_231_1Y S_232 S_232_1Y S_233 S_233_6W S_234_1Y S_235 S_235_1Y S_236_1Y S_237_1Y S_238 S_238_6W S_239 S_239_1Y S_24_1Y S_240 S_240_1Y S_241_1Y S_242_1Y S_243_6W S_244 S_244_1Y S_245_1Y S_246_1Y S_247_6W S_248_6W S_249_1Y S_25_6W S_251_1Y S_252 S_252_1Y S_253_6W S_254 S_254_1Y S_255_1Y S_256_1Y S_257_6W S_258_1Y S_259_1Y S_26 S_26_1Y S_260 S_260_1Y S_262_6W S_263_1Y S_264 S_264_1Y S_265 S_265_6W S_266 S_266_6W S_267_1Y S_268_1Y S_269_6W S_27_6W S_270_6W S_271_1Y S_272_1Y S_273_1Y S_274 S_274_1Y S_275_1Y S_276 S_276_6W S_277_6W S_278_1Y S_279 S_28_1Y S_281 S_281_6W S_282_1Y S_283_1Y S_284_1Y S_285 S_285_1Y S_286_6W S_288_1Y S_289 S_29 S_290_1Y S_291_6W S_292 S_292_1Y S_293_1Y S_295_6W 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Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:NA | Sample Type:QC Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample 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Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Timepoint:6W | Sample Type:Sample Timepoint:12M | Sample Type:Sample Acetate 6058.4 6228.9 6470 6357.6 6116 6352.3 6222.3 6899 6643.4 6638.7 6848.3 7023.8 6159.6 6720.2 6539.7 6324.9 5537.9 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196.6 235.9 593.9 57.7 473.8 584.8 165.8 660.7 459.4 117.5 343.6 339.4 599.8 263.3 268.1 195.3 101.4 263.5 313.7 293.3 492 540.7 212.1 200.4 9.4 178.7 76.3 189.9 409.4 14.5 98.2 408.8 498.6 262.5 258.9 311.8 721.4 551.6 613.2 453.4 122.2 58.2 317.9 70.8 122.6 37.9 355.6 393.5 130.8 136.3 192.8 325.8 885.5 232.5 297.8 227.9 191.7 423.3 441.9 290.2 52.8 216.8 312.9 166.1 129.6 221.2 211 433.1 150.1 611.2 421.8 16.6 229.2 Butyrate 1206.4 1200.2 1242.5 1220.4 1207.4 1231.6 1225.5 1309.5 1370.4 1432.1 1461.6 1474.7 1341 1352.6 1251.2 1223.5 1131.5 1192.9 1176.9 1151.9 1333.4 1270.1 1280.7 1479 1120.3 1152.2 1209.8 1190.1 1127.6 1149.4 1188.4 1135.6 1146.1 1115.3 1212 1153.5 1079 1166.7 1117.5 1136 1064.7 1128.5 1134.8 1254.2 1125.4 1146.4 1118.6 1132.5 1011.3 1347.5 1752.3 735.5 1754.5 411.8 1474.7 998.6 1379.5 1678.9 691.3 627.7 630.5 1393 795.3 1389.7 1726.5 1262.2 638.7 735.4 1779.4 389 361.1 1065.4 753.4 772 1706.3 1341.5 1679.2 371.8 1652.4 1982.4 1448.7 860.9 133 148.3 1338.8 114.2 2368 332.4 1603.1 5266.4 1903.3 102.7 991.7 1264.3 1123.7 2630.3 989.2 1494.7 1029.6 92 505 65.5 195.9 3632.3 2165.5 1233.4 270.4 853.6 649 1631 408.8 221.6 2006.3 46.1 3079.9 241.3 1279 462.3 505.9 509.2 3332.4 3929.1 131.1 187.8 425.6 2225.1 51.9 34.3 274.1 4786.8 285.5 52.4 2938.4 568.2 51 723.7 539.9 2022 172 1756 2708.7 155 1896 1776.6 148.9 578 76.7 223.9 960 1953.7 506.7 1037.2 481.9 1575.4 106.9 186 4743 1307.8 697.6 55.3 206.1 949.5 612.9 902.4 116.5 223.2 8946.9 41.1 827.6 4031.7 1147 1419.8 462.4 2858.4 629.1 746.4 4557 73.6 2536.7 684.2 2043.6 1992.1 1283.9 20.8 88.1 1280.5 225.1 1176.4 385 51.2 1001.5 519.7 314.6 359.5 272.1 1270.7 675.2 2954.2 1506.8 1798.8 1836.2 148.9 350.8 1372.2 8154.7 146.8 214.3 1890.7 1594.6 546 70 223.3 73.5 96.5 1083.2 53.7 626.8 1750.8 1035.4 1622.5 4159 407.9 1993.4 2515.8 3491.7 10044.4 88.6 2287.6 108.2 152.6 938.4 2527.4 1111.9 488.7 63 1051.6 515.9 2068.8 2013.4 57 735.3 1444.6 252.5 834.3 1968.6 177.8 537.9 429.4 312.1 2040.3 44 87.7 914.8 36.8 739.1 4678.1 1244.3 1502.9 405.7 2049.2 660.3 1136.5 7225.4 680.1 923.6 1246.2 370.7 56.4 1779.1 2496.2 944.8 2632.8 3318.5 395 68.6 1889.8 1228 1985.9 2589.3 77.5 412.3 1660.6 65.1 1602.7 1324 1099.9 12 191 2541.3 520.4 6009.2 256.8 2420.7 5978.8 261.3 3647.4 1667 4970.7 3234.2 6506.9 1171.6 500.9 1548.2 4827.8 270.5 432.6 2172.4 1490.9 2332.5 316.3 1090.3 727.9 3242.8 2949.9 1457.2 1242.2 1386.7 138.2 113.3 1800.6 877.4 2434.7 2529.7 89.3 247.8 579.9 6070.2 1171.6 486.5 1208.2 52 2017.4 3680.6 583.6 3285.3 27.6 412.8 1898.8 364.5 1523.2 190.7 3080.9 2869.2 2095.3 1269.7 1492.8 1280.6 1238.1 196 3323.5 156.1 888.2 1178.1 226.1 1655.7 778.7 1644.5 7255.7 681.3 49 1485.4 939.3 1446.9 133.9 1749 125.9 721.8 256.4 806 182.9 2936.5 378.2 204.8 21 1665.1 1356.9 1265.2 1494.5 717.8 1572.2 431.3 2393.2 633.3 210 1714.7 55.4 318.2 971.1 2391.4 1095.1 86.2 281.9 205.1 1276.3 1362 1090.9 909.4 554.5 63.1 1776.1 2010.1 602.6 1344.8 3089.3 260.9 81.7 1431.3 1213 45.5 781.6 1443.4 652.2 1424 383.7 7408.2 497.1 270.2 93.2 789 32.1 1492.5 1288.9 691.8 1247.8 88.3 1359.4 64 2043.8 1003.9 1557 1336 2155.3 397.4 487.7 1955.4 2081.6 666.9 294 171.2 2349.6 4189 2140.4 423.6 405.8 251.4 903.8 1723.7 135.4 823.8 1838.5 445.3 754.7 1508.7 1218.4 1472.9 217.8 1762 850.7 696.7 1197.8 427.2 190.1 998.8 640.6 205.9 1204.3 2826 156.5 27.2 693.5 376.4 12732.3 75.9 42.7 184.3 1600.8 65.5 198 2682.1 408 1313.5 3797.6 1900 3066.1 220.8 27.9 1866.3 73.5 2543.7 80.4 2121.8 3223.7 1663.9 341.5 66.5 945.3 157.9 667.7 565.5 1739.4 269 91.4 966 2538.4 35 1458.5 1266.2 2896.5 1451.4 2597.9 1381.9 756.3 321 455 2592 16.4 1068.7 Cholate 19.4 18.6 22 21.7 16.2 16 15.3 15.5 12.2 10.9 15.7 14.8 14.6 17.8 13.2 16.2 16.2 14.1 10.2 13.5 19.1 13.1 12.5 597.2 18.3 20.5 20.8 20 13.2 12.1 15 11.7 10.6 14.5 12.4 16.1 14.6 11.7 10.6 12.5 14.6 14.4 13.5 13.5 10.4 10.8 9.5 12.5 7.2 14.5 13 10.2 15.8 7 6.5 9.4 13 25.5 7.2 9.1 8.3 9.3 8.7 14.5 15.9 9.6 8.5 9.3 16.3 7.8 3.7 12.2 5.1 5.9 22.5 7.2 14.1 11.7 16 1.8 10.2 7.5 8.6 38.8 19.6 3.3 16.7 76.5 18.7 19.6 39.8 2 10.1 13.4 19.1 7.9 8.8 30.5 9 11.4 15.3 12.6 4.8 29.3 13.6 8.7 23.8 7.9 64.3 3.8 7.6 4.4 60 4.1 13.6 16.9 2.5 83.1 107.6 27.7 3.5 6.9 5 152.6 0.9 2.9 6.7 3.2 9.1 8.8 6.2 3.7 17.8 26.5 3.4 8.4 25.7 6.7 8.7 31.7 10.2 7.3 5.2 84.8 8.7 50.8 15.8 3.6 3.3 25.3 29.9 16.2 10.2 11.1 49.2 24.3 76.3 2.6 5.8 5.9 9.7 9.8 2.3 1.6 6.7 20 6.7 26.8 175.8 12.4 81.8 48.2 10.7 82.2 22.5 201.9 59 8.9 17 4.3 41.3 220.5 13.8 8 5 3.2 8.2 31 17.8 2.6 3.2 197.7 20.4 12.7 8 9.6 7.4 15.2 11.1 30.3 14.8 5.3 51.8 22.3 7.7 4 14.6 6.4 68.8 8 6.2 8.8 3 20.8 9.6 2.1 34.9 20.6 124.6 16.8 87.5 24.2 22.2 60.8 5.6 6.5 1.7 9.4 3.7 28.7 42.6 11.7 42.8 26.3 28.3 133.9 38.3 108.2 23.4 1.9 12.9 51.8 36.1 4.4 5.7 4.1 37.6 39.4 9 7.4 51 6.7 34.6 26.5 6.9 42.6 15.5 65.4 26.6 93.2 4.7 8.8 10 7.2 4.9 14.6 14.3 4.3 2.8 18.6 37.5 13.6 74.3 0.8 3.3 7 17.1 71.4 23.8 7.1 9.4 21.7 27 14.4 15 31.8 5.6 12.6 28.9 91.4 16.4 17.8 50.9 6.9 8.2 68.4 14.9 14.5 14.4 70.8 21.1 7.1 15.6 156.6 8.9 9.3 3 4.7 29.6 9.6 6.2 9.3 8.4 32.6 17.2 22.2 8.6 13.1 27.9 11.4 84.1 28.8 10.7 12.9 26.2 5.4 44 20.6 15.1 65.5 46.2 13.6 12.5 23.6 55.8 9.3 6.4 8.3 12.3 42.3 9.3 10.8 14.5 132.5 57.4 10.8 42.7 9.6 9.7 8.8 11 6.8 3 36.9 3.3 21.7 53.8 3.9 18 16.4 13.3 64.8 18.1 3.9 137.1 6.6 60.8 16.3 3.7 7.8 33.1 12.1 11 11.4 13.3 6.9 12.9 7.1 41.9 12.3 35.2 4 20.6 25.3 6.1 11 24.7 16.4 21.4 10.9 6.2 10.4 45.3 4.5 38.5 8.8 22.4 63.3 63.6 10.6 34.3 64.5 60.6 9.6 33.2 7.7 16 26.9 8.4 25.3 23.6 18.2 30.5 31 9.6 11.4 66.2 3.1 24 1.7 51.1 7.8 17 2.1 76.8 63.9 6.2 13.7 46 6 11.2 37.8 7 6.1 28.8 19.1 14.8 20.5 9.7 57 6.8 8.2 15.1 101 4.6 74.4 85.1 1.6 25.2 8.9 65.3 19.7 11.8 3.7 6.2 13.5 10.5 8.3 12 53.8 21.4 71.4 51.2 5.9 6.5 26.4 10.4 19.5 4.5 15.2 16.6 7.3 9.2 5.9 8.7 18 3.4 43 11.1 7.7 24.7 28.9 45.1 2.8 9.3 0.9 2 12.7 77.2 24.8 52.5 25.8 7.1 12.8 7.7 35.7 28.5 2.9 10.6 6.3 14.9 13.2 16.3 46.5 9.4 2.8 35.3 18.4 16.6 4.2 41.5 23.6 11.2 20 2.4 3.7 52.8 Formate 22 34.7 33.1 38.3 24.4 24.9 25.5 41.6 29.9 27.5 24.9 25.2 32.7 41.7 40.4 37.7 60.1 66.4 62.1 64.4 58.3 50.1 53 54 15.7 24.2 20.2 27.2 14.7 16.1 17.2 28.9 21.7 52 24.2 30.5 29.7 31.7 31.7 22.7 32.4 31.1 30.6 54.6 31.7 32.3 30.4 31.5 45.8 274.1 59.4 106 75.9 9.8 59.7 46.9 267 56.6 14.5 23.1 25.2 58.7 102.9 214.6 66.2 41.2 24.8 18 54.1 8.8 12.3 41 110.3 19.8 63.4 54.4 73.8 38.9 30.9 14.7 23.2 20.3 4.5 62.3 18.7 12.1 27.4 2 11.5 7.4 24.4 110.5 5.7 8.6 28.4 6.7 1716.1 115.4 10.8 24.8 14.4 214.3 11.6 15.5 8.9 28.9 927 16.1 10.6 21.3 207.5 675.9 26.2 16.8 51.2 12.7 32.1 5.1 37.2 14.8 30.9 21 19.3 204 6.3 66 505.3 52.8 6.9 30.1 15.3 27.4 64.1 16.3 14.4 12.5 14.9 19.9 16.1 22 19.5 46.4 22.8 13.9 30.4 33.3 20 11 28.2 18.9 7 19 18.6 128.7 96.7 13 23.2 26.5 12.3 10.7 24.5 60.9 7.8 19.6 378.2 1158 35.6 6.7 23.8 31.5 38.3 34.1 8.7 38.5 41.6 38 28.6 19.2 9.9 13.4 7.2 43 22.4 8.1 11.6 25.9 17.2 25.8 38.8 11.3 10.1 41.1 410.3 20.1 205.8 45.7 16.5 18.5 9.2 57.1 13.2 14 427.1 1211.2 151.1 11.1 32.6 35.1 63.7 23.9 23 13.7 33.4 634.6 63.3 15.8 21.7 381.3 46.9 126.8 5.9 200 38.6 9 39.1 28.7 16.7 27.5 14.9 19.9 15.8 12.1 30.4 8.1 20.4 10.8 110.3 29.2 9.6 6.4 16.7 17.8 28.3 8.2 54.5 20.9 142.5 12.3 250.2 17.7 85.4 15.8 22.7 4.3 147.4 59.2 282.1 17.5 25.8 19.8 25.4 18.1 56.8 39.9 67.9 8 65.3 14.3 14.2 17.4 14.3 9.1 19.8 13.1 5.9 16.3 16.6 25.7 28.3 216.2 18.6 22.4 144.4 8.8 18.2 38.3 12.8 34.1 12.2 26.3 17.7 11.7 23 14.2 10.9 41.1 33.9 46.5 38.8 21.4 10.9 14.3 9.9 27 10.4 9.8 31.4 11.1 98.4 62.1 69.1 33.1 28.2 45.3 26.6 16.8 31.8 13 11.9 47.8 27.1 8.7 47.6 33.3 13.3 23.2 38.4 153.6 9 27.7 102.9 19.8 9.9 19.9 39.7 136.9 207.5 32.6 48.3 30.8 450.1 30.8 16.3 30.5 27.5 25 100 16.9 19.1 197.9 54.8 61.3 22.9 54.2 27.8 21.6 25.6 56.5 24.5 16 7.1 22.3 9.7 5.7 11.5 9.8 25 18.5 15.7 15.6 11.8 4.3 169.1 7.2 10.4 8.4 18 14.6 14.1 11.9 13.1 30.1 15.6 47.2 30.1 493.7 4.3 78.9 13.5 28.7 819.3 8.7 111.8 27 13.7 16 6.2 17.1 698.7 1014.3 15.1 28.8 21.8 307.1 29.1 153.2 7.7 26.8 17.4 14.5 18.9 9.4 13.6 13.8 19.8 14.8 15.4 10.2 24.8 42.6 11.4 11.9 7.9 16.7 3.8 25.8 19.5 19.2 15.7 12.7 18 9 12.5 23.5 11.8 14.8 15.9 24.3 27.5 8 33.5 52.7 20.2 1740.2 2.3 16.6 21.4 26.8 7.6 47.1 10 23.4 8.4 22.1 10.5 10.5 29.9 4.6 3.9 8.1 12.7 11.2 10 22.5 2.6 40.8 29.7 381.9 8.2 24.8 31.3 26.3 1597.7 7.4 10.9 49.4 4.3 25.9 12.2 22.6 12.1 60.2 69.8 74.5 26.7 6.9 21.6 19.2 23.9 18.8 25.5 27.6 30.7 216.2 103.9 8.5 71.2 36 53.3 413.6 29.6 46.8 39 37.1 12.9 25.9 35.5 45.2 20.2 40.5 21.2 25.4 24.3 8 32.9 32.3 29.7 Fucose 625.6 606.1 642.2 626.1 242.5 257.9 249.7 251.1 319.5 314.7 337.9 331.6 472.1 455.1 462.9 459.7 178.3 187 174.7 172.4 135.4 127.4 127.2 25110.1 222.4 235.2 231.4 230.9 228.4 227.8 236.9 225.8 235.6 215.6 241.4 226.2 203.9 220 215.9 219.4 206.4 202.4 208 119.9 206.3 211.6 208.5 211.6 509.8 182.1 468.6 433 304.5 21.7 111 474 196.3 367.6 206.1 141.2 125.2 138.5 680.6 206.6 426 546.1 140.4 253 627.8 80.2 75.2 583.1 615.1 248.9 507.8 162.5 259 1691.2 121.5 60.8 502.1 154.6 217.3 146.8 105.3 707.5 107.6 331.8 1145.1 308.2 69.9 59.2 154.1 88 230.2 168.6 700.3 37.8 170.3 278.6 167.4 1716.9 876 155.4 140.4 245.3 747.2 398.4 275.4 315.8 73.7 130 302.8 535.4 185.3 68.6 123.1 685.2 129.7 139.9 155.9 120.9 1111.2 30.5 18.3 138.8 561.3 169.7 1233.1 87.3 106.3 583.8 162.9 38.4 601.3 202.6 74.8 60.7 2641.3 259.9 48.2 96.6 66.2 112.2 226.4 106.2 69.6 256.7 47.8 29.5 377.3 119 711.7 69.7 1784 669.3 138.3 91.7 153.5 1210.8 76.8 228.1 666.5 87.4 257.7 441.6 346.1 437.2 242.2 183.7 164.7 195.9 217.4 188.9 121 134.1 16.6 1035.6 118 47.2 140.5 176.1 95.6 747 3271.7 86.2 101.9 126.6 45 1145.8 58.7 93 371.6 63.4 5190.4 78.8 22.2 259.6 31.6 604.4 251.7 85.1 1299.8 60.7 263.1 161.4 43 34 363 131.2 1084.1 124.6 75.2 574.1 142.6 1094.4 1347.6 407.9 369 214 668.1 513.7 177.7 278.6 88.5 208.4 665.5 177.4 681.1 48.2 189.2 19.5 171.5 94.7 3234.1 311.2 30.4 145.2 317.5 253.5 11 314.2 67 65.8 57.4 123.9 427.3 81.4 365 28.7 104.7 2570.6 312.3 263.5 17.5 278.6 166.5 169.6 114.2 446.5 88 79.9 201.9 159.2 71 141.6 315.5 428.1 63.7 151.3 254.9 120.1 106.2 45.4 1671.1 151.2 146.1 52.7 108.3 328.4 148.1 227.3 74.9 311.3 295 143 171.4 6151.3 396.5 207.1 170 116.5 182.5 156.3 2700.6 163.9 71 236 285.2 42 105.7 69.7 97.9 283.3 122.8 434.7 156.8 184 549.8 202 230.4 143.7 209.5 240.2 93.6 73.3 160 600.7 67.5 649.9 225.8 37 157.4 254.2 156.9 132.3 356.9 128.9 130.9 272.2 2245.8 140.3 41.4 153.6 652.2 1064 47.8 44.7 131 361.7 956.8 198.7 192.7 329.4 62.1 110.3 365.3 150.9 1950.7 1006.2 13427.9 155.7 54.4 236.3 73.1 137.2 335.2 177.5 93.4 73 103.9 181.9 109.6 734 94 272.9 687.6 472.9 65.5 276.5 145.7 94.9 941.1 556.4 197.4 117.1 91.1 101.6 208 122.2 136.5 161.4 139.5 492.4 660 945.5 188.7 1115.6 297.5 46.1 93.7 358.1 144.3 89 43.8 78.3 86.2 347.2 582.9 231.6 58.7 100.5 63.2 189.3 128.8 518.2 411.6 311 1858.2 217.6 190.9 134.9 201.3 572.3 71.1 21.9 80.9 428.7 2396.6 550.8 94.1 100.6 69.2 45.2 554.6 104 686.5 73.1 38.8 105.1 112 124.5 154.9 16.5 58.7 95.9 49.2 202.8 269.5 143.5 220.7 95.7 552.8 670.7 378.1 65 210.1 533.8 309.7 92 78.4 64.7 28.8 92.8 70.5 382.8 164.9 82.9 520.7 105.6 249.7 35.7 71.6 94.9 211.6 137.1 53.8 978.6 687.2 98.5 70 120.7 847.2 636 1559.3 264.7 12266.2 335.9 56.2 375.7 122.8 101.4 170.2 173.1 335.7 277.8 99.2 1102 97.7 3540.9 246.8 471.8 132.7 110.6 318.8 36.2 1375.4 115.5 449.3 1102.6 253.7 637 219.7 190.9 594 147.4 130 157.8 309.1 156.3 102.1 64 111.2 293.5 99.4 85.7 100.8 Fumarate 5.6 6.6 6.2 6.4 4.2 4.5 5.1 5.8 4.4 4.7 4.6 4.3 5.2 8 7.5 7.7 5.7 6.3 6.2 5.8 7.3 6.4 7.1 6.4 4.4 5.5 5.4 5.3 4.4 3.5 4.5 5 4.2 6.9 5.2 4.7 6.3 7.4 6.4 4.5 7.7 6.9 6.7 6.3 6.6 6.6 6.9 6.4 5.4 8.4 11.4 6.5 7.1 2.7 5.9 3.4 9.3 11.4 5.4 5.7 5.3 5.5 6.2 7.8 5.6 9.2 4.6 5.4 10.9 2.3 1.2 5.5 7.1 7.4 12.4 5.5 7.4 17.8 2.1 4.9 24 3.2 3.6 17 5 13.8 3.6 16.7 95.3 1.9 14.4 1.8 7 3.2 8.3 3.9 29.4 8 5.7 40.5 16 9.3 11.2 12.2 2.4 2.9 34.4 16.9 1.6 6.4 7.8 5.4 9.9 3.6 12.1 5.8 4 6.4 10 6.3 16.2 2.7 4.5 4 2.9 9.8 7.8 0.8 2.9 12.5 6.3 14 5.8 2.2 7.6 81.1 3.2 1.3 4.4 9.4 9 19.7 11.2 8.4 4.1 10.1 0.9 3.3 17.3 9 4.4 2.3 6.1 6.4 12.4 2.3 22.1 3 4.2 11.4 0.6 2.9 17.3 1.1 17.8 5.6 17.3 6.1 11.5 24.6 9.3 11.5 5.5 33.9 11.8 1.4 15.3 42 4.7 0.7 6.5 16.3 9.6 11.2 4.6 7.7 21 38.8 6 6.7 11.3 22.6 38.9 60.6 0.7 2 12.8 4.5 2.4 4.9 0.4 7.1 16.5 5.2 38 2.3 9.2 22 14.8 11.3 2.4 4.1 7.2 2.1 9.7 9.3 3.7 49.3 28.6 6.7 10.2 4 12 2.4 10.1 15.3 2.6 8.5 1.5 8.7 11.9 2.5 9.8 5.4 64.4 7.8 3.3 13.9 10.8 1.7 3.1 7.8 13.3 1.5 11.5 7 6.6 15.1 0.4 0.8 9.8 9.2 8.1 6.5 1.3 46.3 11.3 17 8.2 21.5 11.7 4 25.8 8 6.8 2.6 20.5 1.4 16 9.8 2.2 7.6 15.8 7 7.2 7.1 2.8 7.4 5.3 5 27.3 16.8 13.5 3.6 12.8 4.5 7.2 1.5 6.4 6 4.5 2.2 11.6 9.3 4.5 24.1 18.8 14.5 8.6 6.9 4.1 2.9 2.6 5 1.7 20.8 1.2 5.4 10.3 28.8 0.4 3.7 8.5 8.8 3.4 6.1 5.4 6 41.5 21.1 45.7 4.1 6.3 2.8 20.1 2.8 7.2 15.9 17.7 12.5 0.5 20.1 6.8 10.3 37.9 7 18.1 2.3 1.5 11.9 7.7 12.4 16.2 10.1 5.9 6.7 2.2 3.2 20.8 8.7 20.8 7.6 10.5 32.8 1.5 4.5 12.4 14.8 18.3 8 6.1 4.7 5.2 5.3 5.9 1.5 21.5 3.8 14.3 14.2 8.8 12.8 5.1 5.5 6.9 4.1 10.6 19 15.1 7.2 10.6 3.8 4 3.3 8.1 4.2 6.4 3.4 3.6 2.2 6.2 24.2 30.3 12.3 7.9 3.9 6.7 12.9 22.4 4.8 3.9 3.6 14.8 6.6 6.8 3.5 14.4 13.3 9.6 7 10.1 3 4 3.8 9.8 8.9 14.8 9.9 12.8 6.6 11.3 8.6 15.4 1.2 11.6 6.5 7.9 19.1 2.6 5.4 6.9 5.4 13.6 4.1 5.5 10.2 17.6 86.8 6.3 8.1 1.9 8.1 4.8 16.5 3.4 2.6 2.7 4.2 10.4 3.5 3.1 3.6 5.4 14 6.5 17.7 10.8 4.3 6.7 6.3 29.6 16.4 2.2 15.6 21.4 14.6 14.1 2 26.1 17.9 1.6 11.6 6.6 1.9 37 1.3 6.6 19.6 5.6 4 7.3 28.2 6.7 3.2 1.7 1.3 16.9 9.7 12.6 56.1 10.4 5.2 0.9 3.4 5.3 9.1 9.1 9.8 8.6 14.7 4.5 26.5 11.4 11.2 5 11.8 21.1 13 5.6 5.4 5.3 3 37.2 12.4 1.7 3.4 2.8 Glucose 1269.9 1226.5 1309.5 1314.2 1484.2 1506.5 1530.3 1622 1346.9 1360.1 1410.4 1394.8 1368.1 1375 1379.2 1352 970.3 1013.3 1001.9 965.2 1275.2 1222.1 1195 1617.7 1158.5 1206.2 1214.9 1220.9 1188.9 1197.7 1228 1256.6 1223.4 1236.2 1277.6 1249.7 1123.3 1186.7 1134.8 1130.8 1110.2 1132.7 1154.5 1193.5 1123.2 1142.8 1110 1126.5 1952 2259.5 1048.6 3213.3 3782.6 380.1 760.4 1711.3 2388.1 3157.6 1326.5 1069.6 1047.4 1561.8 3575.1 2522.5 5815.8 971.9 1044.9 1445.3 2297.9 299.7 413.7 2229.1 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170 1002.5 148.2 148.7 277.7 316.1 117.1 273.5 311.8 552.7 201.8 92.8 287.3 93.3 278.5 205.9 322.3 51.4 305.7 84.7 57.5 58.7 Glycine 623 633.1 637.6 632.9 677.4 695.3 682.7 739.1 702.6 699.5 711.6 719.8 670.7 697.5 703.8 695.3 552.7 574.9 572.8 551.5 654.9 614.4 611.4 708.9 574.9 584.4 614.6 589.1 571.7 579.7 594.2 580.8 598.2 590.4 622.4 608.3 575.1 608.2 593.4 559.4 553.3 567.1 570.5 602.4 568.2 571 564 574.3 448.7 661.8 903.2 403.3 699.8 285.1 466.7 433.3 666.1 768.8 336.6 427.5 410.3 471.9 472.9 671.6 722.5 718.5 411.3 370.8 862.2 350.2 280.3 525.2 408.2 377.1 817.3 456.9 674.8 931.6 465.7 319.3 1098.3 425.5 147.8 786.4 540.5 278 709.2 1073.9 1008.6 205.2 765.4 264 557 359.7 1634.8 664.4 901.9 378.5 655 915.8 1200.5 805.3 372.6 1028.2 394.8 324.3 1402.7 652.5 340.8 402.9 1031.2 276.6 1004.9 466.5 1716.8 267 1092.8 350.5 1147.4 438 658.1 364.8 604.9 532.4 257.1 1187 726 207 192.7 960.7 118.3 961.4 1046.6 374.5 614.5 1302.6 381.1 423.9 682.8 1052 207 572.2 1095.6 308.3 1005 786.4 526.7 251.4 1033.8 857.9 296.9 312.4 382.7 610.6 776.3 836 590.2 438.4 678.2 244.2 218 1524.3 429.2 330.5 729.6 430.9 1698.1 363.1 1092.6 879 711.1 609 725.9 1079.8 951.9 643.7 691.6 277.8 591.9 427.3 396.3 985.4 415.7 201.6 255.8 615.8 587.1 942.9 808.1 159.9 798.3 793.1 846.9 329.5 1532 1231.5 322.8 905.8 768.1 458.3 374.6 255.3 609.3 1074.2 572 671.9 353.2 1186.1 1060 804.4 345.7 945.2 266.1 393.3 1106.2 164.5 508.7 2463.8 1575.8 616.3 840.4 926 864 580.2 1055 1165.6 490.5 951.6 456 628.8 342.1 631.4 656.9 443.3 671.8 631.8 1483.7 999.4 698 98.1 346.7 566.4 943 245.9 1370.2 372.5 549.8 935.1 428 760.5 1305.9 457.7 1226.3 207.6 1041.9 2011.6 493.5 923.5 1345.9 745.5 913.3 643.4 1571.1 1178.4 874.1 182.3 1152.5 282.9 607.3 1499.4 685.3 418.1 1141.7 346.6 756.5 196.6 786.7 766.7 883 221.3 513 1322.6 390.6 581.3 605 1179.5 96.2 952.3 528.4 1750.2 777.4 422.5 678.6 1114.2 744.9 1020 695.5 1980.2 1520.4 1727.9 621.8 192.9 442.2 1325 873.3 565.8 655.7 439.8 3117.1 1095.7 300.9 595.1 1822.1 1364.1 959.6 72.9 729.7 1451.5 352 2081.7 1453.7 351.5 720.4 868.5 772.5 300.2 1011.8 1094.8 1126.3 992.4 133 723.9 797.2 607.3 1047.4 488.4 911.7 721.2 866.1 953.1 1256.1 1494.6 1515.4 1489.2 711.1 714.6 726.8 2496.6 547.7 2070.9 598.5 1333.2 228.6 1275.4 429.1 1144.6 1123 1134.7 586.3 1509.4 377.4 661.9 362.2 306.5 354.2 516.4 910.9 416.2 820.6 597 447.2 388.2 433 217.6 503.4 650.1 518.2 595.6 498.7 334.9 831.6 870.8 533.2 1148.7 903.5 757.4 424.2 773.5 944.8 536.2 533.2 940.5 1093.5 204.1 808.4 349 291.2 758.1 1368.3 1543.7 902 491 660.2 1956.8 806.5 210.6 554.2 1577.6 339.3 516.4 515.8 812.4 723.4 326 436.2 1245.1 646.2 694.4 1154.5 358.9 866 362.7 1302.1 234 358.5 442.1 490.9 835.2 287.5 459 680.8 696 408.5 558.9 497.7 780.9 735.4 881.6 761.1 351 433 1298.8 801.3 569.3 340.8 657.7 968.9 533.5 250.4 719 170.5 764.2 870 592.5 487.4 575.2 817.1 219.5 423.6 324.7 491.4 372.4 692 705.7 535.5 751.2 1162.1 251.5 291.6 718.9 562.1 1130 917.2 130.3 975.9 1495.2 180.5 1027.4 290.8 279.1 608.6 2394.2 490.9 1702.6 539.4 127.7 1057.8 356.6 546.5 611.1 1394.4 606.6 531 914.6 934.6 666.8 1315 794.8 352.4 996.7 222.1 492.5 905.2 1130.8 280.5 1191.5 716.4 1009.8 617.8 1279.6 700.8 373.2 438.9 634.6 1145.3 60.9 867.1 Histidine 85.3 83.8 18.6 35 54.5 45.6 55.4 56.7 50.1 49.1 46.5 53 35.9 48.4 51.1 65.2 40.8 93.4 35.1 18.2 39.5 50.6 38 74.8 49.6 32.8 37.3 61.3 25.6 37.6 32.7 46.5 27.8 43.2 51.4 44.7 19.6 16.5 28 76.7 82.9 82.1 31.2 51.1 55.2 33 41.6 47.4 40.7 63.8 101.9 43.5 94.6 34.2 47.7 39.9 36.8 71.5 32.8 42.7 21.6 40.4 72 63.8 85.4 88.1 34.8 42.7 98.3 39.3 32.7 54.2 42.9 37.3 78.7 58.3 82.3 95.6 23.8 46.6 234.9 54.2 33.4 50 52.4 29.3 43.6 56.2 153.5 60 102.3 55.8 65.7 44.4 60.2 58 133.7 50.1 58.3 118.2 72.4 36.3 43.9 137.8 35.1 51.5 174.7 78.8 19.8 67.8 70.9 23.4 76.4 52.4 194.2 41 117.2 35.5 86 58.5 82.7 43.6 82.4 62.8 22.8 152.1 62.2 35.1 27.4 127.9 23.5 93.4 60.9 30.3 76.5 291.9 49.9 41.3 35.5 147.9 32.7 78.6 81.7 57 45.6 79.8 43.5 32.1 112.4 46.2 25.3 43.4 53.2 71.6 42.1 30.4 96.5 39.9 35.7 5.6 17.7 124.7 37.8 36.6 75.6 30.7 232.8 69.9 66.3 111.4 74.1 48.5 56.3 169.4 179.8 79.9 138.5 50.7 38.3 68.4 69.7 80.2 56.3 32.9 21.3 37.9 127.8 58.3 53.7 31.1 92.2 67.8 155.8 99 80.6 175.6 57.1 77.8 28.3 53 60.2 41.6 91.4 67.5 147.7 35 50.6 120 103.9 77.4 6.3 78.6 17.8 53.1 36.5 35.1 32.3 811.6 28.6 48.2 204.8 30.8 115.5 40.1 112.2 236.5 74.2 133.5 77.4 45.8 45.8 69.4 153.4 47.9 74.3 53 76.2 159.1 224.1 4.7 44.2 145.2 152.1 72.3 108.1 54.8 83.9 80.6 92.7 83.4 57.3 24.8 171.6 34.5 75.3 157.5 56.9 48.3 33.2 99 80.2 11.1 220.6 74.8 67.7 18.3 149.7 7.1 83.9 138.3 35.2 82.1 107.8 40 79.8 42.4 88 74.9 144.9 46 83.9 178.8 48.2 56.2 78.8 97.3 22.2 64 101.9 90.2 115.9 59.5 146.2 46.3 38.7 51.1 39.1 340.1 107.2 329.6 62.5 36.4 55.6 177.6 15.1 112.1 53.5 85.6 115.1 133 119.7 64.4 220 86 24.4 44.1 61.1 26.9 109.2 334 217.8 66.2 40.3 36.3 146.8 44.7 154.5 55.9 27.5 114.7 131 113.4 46.8 42.4 62.4 56.2 42.4 38.7 49.1 220.2 128.4 166.3 95.8 212.7 43.5 42.7 111.4 48.9 30.5 224.8 40.6 97.5 49.2 50.1 63.1 39.5 250.9 110.2 55.5 57.2 29 64.1 15.1 22.8 46.6 38.3 40.3 48.7 40.4 63.2 101.5 50.2 43.7 12.8 55.1 118.2 36.4 69.5 82.7 90.5 89.4 78.8 90 101.6 71.1 90.7 11.8 9 48.5 33.2 64.2 28.1 33.8 8.7 46 38.7 49.3 32.2 119.5 82.4 37.9 31.4 52.4 60.3 49.6 22.6 41.7 72.6 34.8 47.1 38.9 40.4 94.1 71 51.4 65.3 36.4 21.2 18 53 52.3 50 77.2 31.2 55 50.6 61.6 29.9 43.9 35.4 61.5 41.1 33.3 43.1 38.9 74.7 39.6 85.7 37.5 74.3 60 74.3 81.2 39.1 51.2 49.1 39 74.9 60.5 93.1 27 41.6 45.5 93.8 49.3 23 57.9 29.8 65.5 51.7 69.6 31.9 43.9 93.8 30.7 23.4 99.2 27.9 28 64.3 23.1 124.9 54.9 7.7 104.8 88.7 9.2 100.6 36.6 66.5 59.2 62 38 108.3 58.8 19.5 133.8 24.1 82.5 48.6 154.1 105.2 28.5 60.1 49.1 46.7 99.4 42.6 53.4 102 51.6 89.7 53.4 86 28.4 32.1 85.1 88.7 50.4 103.5 80.1 16.9 29.3 45.6 79 12.3 22.9 Inosine 4.7 4.8 3.6 4.6 4.2 5.8 4.7 4 5.3 4.2 5.1 4.4 6.3 7.2 6.5 8 4.3 3.9 3.8 3.4 5.4 3 3.3 3.7 4.7 4.7 4.7 5.5 3.9 4.5 5.7 4.7 4.7 7 6.6 7 5.3 6.4 4.9 6.1 4.1 3.5 3.5 3.5 4 4 4.3 4.3 1.4 3.4 6.5 3.1 6.6 1.9 3.6 2.8 6.3 4.4 1.8 6.8 6.5 3.3 2.6 5.7 9.8 3 5.5 4 4.2 2.9 2 5 2.4 2.7 2.3 2.6 2.7 3.6 6.5 1.6 35.8 1.8 1.9 13.9 6.7 2.4 8.8 1.9 23.7 3.5 4 2.2 3 3.6 14.7 3 7.2 15.3 4.1 3.9 7.7 1.7 7.7 24.7 3.3 2.7 4.6 6.8 2.2 9.5 4 5.9 44.2 7.7 32.4 7.3 7 1.5 15.3 6.5 2.5 26.9 2.1 1.5 1.7 7.7 29.8 5 5.6 14.6 4.7 13 2.2 5.5 1.8 14.1 3.3 1.8 7.7 27.9 3.1 5.9 8 4.4 6.1 7.3 2.6 3.3 9 6.9 5.2 2.8 9.2 9.3 4.1 1.7 5.4 10.6 3.2 0.9 17.6 23 8.4 3.4 2.9 5.5 30.9 3.9 2 6.8 5.6 17.3 7.3 14.4 71.3 2.9 9.2 5.3 3.5 2.7 3.4 18.4 6.1 3.3 2.2 7.7 7.2 30.1 25.5 7.2 10.1 22.2 4 16.6 11.5 8.7 3.2 6.5 4.5 3 25.1 6.5 2.9 3.9 6.7 2.8 6.7 11.6 1 6.6 1.4 3.9 0.9 3.4 7 3 7.5 6.3 2.2 4.2 13.8 7.8 6.7 4.7 5.5 14.8 3.7 5.7 3 19.5 19.1 5.4 5.4 3.4 2.8 8 6.3 6.3 22 0.4 4.9 8.3 76.9 8.5 6 13.8 7.8 16.1 4.9 18 7.3 2.3 29.1 4.2 5.5 5.3 6.6 7.2 45 3.3 10.2 1.8 13.1 4.2 8.1 1.7 9.2 0.5 6.6 6.9 1.8 5 17.1 2.6 8.2 1.5 6 13.6 6.1 7.3 7.4 7.1 6.8 28.9 12.4 7.9 2.8 44.3 9.7 5.1 10.5 19.1 4.1 5.1 2.1 11.7 12.6 14.1 72.9 20.5 10.5 13.6 7.2 2.8 1.3 5.6 5.2 3 2.9 9.8 8.7 11.4 9.9 3.5 19.3 5.3 6.4 9.3 6.9 5.1 8.9 5.2 6.3 3.1 29.2 7.5 6.2 6.8 11.5 9.4 1.8 39.9 4.1 1.7 8.5 2.1 4.8 6.9 6.9 3.1 10.7 6 6.7 27.9 10.7 3.3 27.5 9.7 2 3.3 3.7 10.3 8.3 11.5 4.2 8.5 21 5.8 5.2 3.7 3.8 2.8 2.1 4.1 3.8 1.7 6.6 1.6 2.1 3.7 3.4 1.5 3 3 2.6 3.3 1.2 18.6 1.4 3.8 2.3 42.6 13.1 4.1 6.9 1.2 1.7 1.8 7.9 4.4 2 12.3 2.7 1.7 1.3 1.1 1.5 5.9 11.3 1.8 1.8 9.1 2.5 2.1 1.7 1.3 4.4 3.1 8 2.3 1.5 2.8 3.5 3.8 2.9 8.3 3.6 1.4 7.9 6.3 3.5 2.5 1.8 3.2 0.8 2.9 3.3 2.7 2.1 1.3 5.9 2.9 8.9 3 1.1 9 2.2 16.3 4.7 2.7 3.2 11 2.9 3 1.8 3.1 1.8 5.2 2.3 2.3 5.2 1.9 4.6 6 2 1.9 31.5 1.2 2.9 1.9 4.9 4.7 2.1 3.5 1.2 3.3 43.8 1.2 2.3 4.6 3.3 21.9 31.1 0.8 4.2 14.3 2.1 2.3 2.2 3.3 3.3 4.9 1 11.7 3.2 1.6 5.5 2.7 5.5 3.1 5.6 4.8 13 3.4 2.4 2.6 4.1 2.9 2.9 2.2 2.1 1.9 13.3 9.1 2.1 25.9 6 6.7 7.4 8.6 5.5 2 5.3 13.3 6.5 2.7 2.5 Isobutyrate 26.8 25.4 27.4 25.4 22.9 30.6 26.9 25.5 18.7 18.8 18.3 20.3 19.9 23.3 21.7 23.8 24.2 23.5 18.8 17.3 42.7 35.3 37.2 38.6 24.1 26.5 29.4 23.9 22.9 23.5 24.2 19.1 22.4 15.3 21 17.3 23 23.3 22.9 21.8 24.1 21.4 21.1 34.2 24.8 24.4 26.8 27.6 17.3 16.9 21.4 7.9 9.8 7.2 10.8 14.1 16.6 13.6 8 13.3 12.4 14.9 9.9 16.6 9.4 14.4 13.7 9.2 12.5 5.8 7.3 16.6 9.8 11.6 17.8 12.9 10.1 16.2 9.1 46.7 17.8 109.8 8.3 14.9 4.8 3.4 18.1 20.8 10.7 63 55.6 3.3 284.3 4.5 23.6 12.3 9.5 7.9 31.5 5.8 63.6 6.4 7.4 9.8 32.2 101.5 18.1 9.2 13.1 11.4 36.3 1.3 31.7 3.7 11.6 19.6 12.2 34.3 23.9 10.5 13.9 3.4 4 14.4 4.9 14 1.8 1.3 13.3 9.4 27 22.2 7.3 7.4 4.6 9.7 31.7 5.1 8.8 12.2 2.5 10.8 24 7.6 9.9 8.2 10.8 3.4 20.3 14.3 9.9 5 23 16.9 5.7 8.4 9.9 4.1 6 1.5 1.1 27.4 13 7.6 5.2 2.9 35 5.5 70.6 11.6 24.8 15.8 6.6 19.4 32.8 20.4 37.4 6.5 25.9 87.3 5.5 15.1 15.6 0.9 8.5 19.9 9.1 19.8 26.9 1.4 13.2 16.3 11.3 3.6 4.5 34.7 3.7 176.6 21.3 5.1 5.9 8.6 6.8 5.9 6.5 11.4 7.6 32.8 48.9 9.7 12.4 6.6 6.4 4.3 24.2 1.8 13.9 9.1 11.9 15.9 60.2 23.8 29.5 21.6 8.3 34.2 8.3 18.4 4 20.9 5 18.8 9.9 109.3 73.2 37 10.7 17.7 11.1 4.4 4.8 16.7 17.9 3.8 24.2 2.8 13.4 42.1 11.9 11.8 8.1 39 32.4 3 17.3 204.8 29.6 15.5 31.2 13.7 6.5 19.8 17.8 38 138.8 13.7 13.8 6.3 7.9 130.6 16.6 10 29 4.4 1.8 5.8 16.5 16.1 10.9 5.1 6.2 26.8 14.1 16.6 10.6 43.4 0.8 14 13.4 73.6 20.6 4.8 109.6 9.9 10 11.5 14.6 45.9 24.3 20.1 44.2 2.8 13.8 22.1 11.7 10.2 2.8 7.7 13.8 18.5 11.7 14.5 43.1 19.1 12 9.6 22.2 14 7.8 7.4 26.5 23 12.9 7.8 40.6 9.2 28.1 19.1 27.3 15.1 4.5 10.2 34.8 16 22.7 0.8 17.6 20.1 14.3 27.8 6.9 25.9 32.5 24.7 7.9 13.1 12.2 33 5.3 42.2 15.4 23.2 113.9 88.2 9.1 24.8 21.5 21.6 10.9 11.5 25 20.1 220.9 14.5 19.4 12.3 11.4 12.6 10.1 12.2 15.4 11.6 13.1 1 54.8 20.7 13.6 8.4 20.5 74.8 18.8 20.6 10.4 10.3 20.2 7.6 24.4 31.2 42.6 32.6 14.2 20.1 99.5 3.8 12.1 14.3 12 25.8 4.7 23.1 95.5 8.7 23.7 13.7 12.5 5.5 23.9 43.1 5.6 14.4 25.9 21.8 8.4 20.3 51.9 5.7 15.2 11.1 27.1 4.3 52.9 305.3 120.3 3.9 14.1 162.7 4.8 26.7 29.8 13.7 7.1 19.3 58.4 16.5 34.7 15.8 33.4 12.7 23.1 18.5 127.3 15.9 21.8 28.6 8.2 18.7 20.4 6.5 24.3 19.1 10.8 571.1 29.6 14.5 18.8 5 17.8 12.5 19.3 40.2 4.6 11.8 12.5 11.9 6.6 13 14.6 14.5 2.6 5.9 33.8 180.8 7.1 5.3 4.9 34.2 3.7 8 16.5 12.4 28.5 30.5 17.7 52.1 22.1 1.1 23.6 14.1 17.2 7.8 18.6 11.6 13.9 17.5 5.7 29.3 5.8 14.8 32.2 16.1 15 4.2 44.1 24.2 2 22.5 18.6 9.2 21 21.1 11.9 9.1 9.7 19.6 13.3 1.2 7.8 Isoleucine 480 457.1 487.6 483.1 498.3 512 513.4 534.3 513.3 513.8 534.5 536.1 477.8 477.2 482.2 476.4 407.3 426.3 409.7 400.9 463.1 451.4 446.1 469.7 427.6 437.4 447.5 446.3 438.1 438.3 447.8 442.1 445.5 415.3 459.5 438.6 402.2 426.2 412 420 401.8 408.8 410.2 440.7 412.7 417.7 408.9 410.2 362.6 430.5 605 248 474.4 204.6 289.6 305.5 436.2 532.7 222.2 338.6 226.5 294.1 290.3 448.6 483 486.7 259.6 245.4 592.4 204.2 213.9 363.8 301.2 273.7 720.5 285.7 463.9 553.5 351.5 239.3 1023.7 221.5 123.7 335.6 369.2 127.6 426.2 378.8 689.1 411 580.6 195.9 479.3 205.9 738.1 591.2 282.2 344.6 515.1 376.9 868.2 173.7 301.5 831.5 350.8 224.6 881.5 251.6 233 285.3 738.5 119.7 876.9 209.6 698.9 241 794.6 264.5 836.9 306.3 534.1 180.7 294.3 266.8 113 1016.2 268 144.4 211.4 718.8 140.6 547.3 632.5 235.7 382.7 1047.9 280.7 317.7 150.1 638.6 154.5 416.7 684.3 232.1 257.4 629.5 367.9 195.2 715.1 494 283.9 230.5 352.9 432 253.3 230 522.7 334.9 531.8 160.6 80.9 1297.2 292.9 245.6 270.2 253.8 1389.8 261.2 799.8 660.7 501.8 366.2 503.2 747 966.7 618.1 601.1 166.3 563.8 372.2 212.8 819.1 269.2 94.6 125.1 411.1 399.7 740.4 662.8 71.5 569 621.1 577.2 396.6 597.2 810.4 191.8 527.3 566.3 141.3 200.4 201.9 266.7 516.2 454 227.8 247 865.5 672.3 595.9 99.3 268.7 111.4 222.3 748.5 92.5 423.6 1256.4 402.4 293.1 548.4 705.5 518.6 220.5 759.2 1242.5 367.5 773.6 148.5 358.4 224 473.8 441.8 315.1 388.8 518.2 373.1 725.7 441.9 42.8 263.6 413.2 412.6 180.5 900 174.5 352.1 815.8 222.9 672.4 175.9 166.5 1001.2 134 646.4 925.7 453.6 555 966.8 499.5 611.4 484.2 1417.4 906.8 268.5 120.4 812.2 66 338.7 392.9 565 362.8 962.7 205 392.5 220.4 501.3 540.7 623 163.2 342.2 894.3 216.6 539.9 529 908.3 44.9 372.8 542.9 976.9 661.8 154.1 520.2 868.2 87.6 733.6 516.3 1646.4 880.5 1309.8 189.2 166.3 457.7 1254.5 162.6 345.3 212.6 329.7 797.1 774.1 304.4 421.5 1456.9 1020.4 826.3 392.9 557.7 689.7 203.1 1213.1 935.4 289.7 523.8 255.6 565.6 242.7 690.1 434.3 688.9 495 152.7 624.6 1367.1 558.1 599.8 184.2 399 454.9 590.9 796 490.5 991.7 1230.5 1011.9 533.4 502.1 569.5 1133.3 272.6 1188.2 212.8 884.7 190.5 692.2 349.2 948.8 903.2 840.8 418.7 158.2 339.7 654.4 261.3 97.3 297.4 107.1 458.1 77.1 500.8 240.1 387.4 165.7 420.4 116.5 391.3 511.2 450.9 490.2 400.9 289.6 170.6 689.1 461.2 389.9 506.8 327.5 232.7 329.9 545.8 312.3 224.8 204.5 749.5 90.1 154.1 292.5 261.8 329 501.4 895.8 701.5 383.8 597.7 968.9 296.5 127.7 454.9 1083.7 194.2 463.5 368.7 305.2 517 207.3 595.3 232.6 436.9 151.6 291.3 248.3 604 209 488.9 152.3 162.4 283.8 315.3 611.2 318.1 383.6 426 539.3 405.4 479.6 441.4 618.8 236 754.9 218.5 290 299.3 654.9 322.4 237.3 187.7 536 788.1 387.5 254.1 498.3 200.3 519.3 636.8 460.8 390.1 113.7 642.7 211.9 295.2 131.8 420.8 292.8 346.6 580.9 277 621.9 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50.8 215.2 46.8 32.8 14.7 393.2 9 30.6 55 7.1 108.4 23.3 24.7 10.2 270.8 11.6 19.3 69.9 146.7 38.5 28 76.3 39.6 21.6 49.2 77.7 33.5 11.6 25.7 20.4 74 17.4 23.2 10.4 29.1 9.8 138.5 103.3 40.1 295.6 44.6 18.2 27.5 9.3 144 14.1 101.1 16 51 9.4 26.1 28.6 61 196.4 346.2 124.1 360.3 93.4 43.1 54.8 40.3 129.9 14.3 658.1 23.1 38.2 21.4 494.5 18.7 29.8 65.8 40.5 75.2 35.6 40.2 1503.6 13.7 36.5 26.4 30.1 11 18.5 918.1 15.2 525.1 34.6 71.9 31 20.8 11.4 30.2 23.6 10 159.6 189.3 424.8 85.9 53.1 23.1 321.4 19.4 17.3 19.2 22 66.6 40 189 27.5 30.8 72.1 775.2 50.2 87.9 35.1 14.4 30.9 13.2 321.9 29.4 21 13.7 8 96.8 16.5 12.6 296.5 25.7 63.4 8.1 694.6 51.8 21.2 20.6 24.3 26 26.8 69 22.7 185.1 73 23.1 11 43.3 11.5 44.9 31.8 27.9 21.7 160.6 14.3 129.8 32.2 59.2 13.2 51.5 5.4 88.5 17.5 25 170.7 9.2 11.9 193.6 62 42.5 46.8 444.9 6.7 23.4 16 59.5 155.4 259.2 168.1 752.7 49.4 224.6 101.2 274.3 22 309 24.4 302 112.2 15.6 36 15.9 30.3 17.9 10.9 32.3 29.9 11.5 230.2 20.1 105.1 16.6 25.7 186.6 39.2 33.8 7 86.7 14.9 24.4 8.8 5.6 24.1 Methionine 210.9 205.5 212.7 212.4 218.7 230.4 223.4 219.1 215.8 220.5 226.9 229.7 222.1 232.5 234.9 233.8 184.2 198.5 184.2 184.8 209.5 203 197.7 238.5 182.8 185.7 194.5 188 192.5 188.5 190.3 173.9 189.7 175.7 197.1 183.8 180.4 192.2 183.2 177.1 182 177.2 181.1 193.5 182.3 185.8 178.7 182 128.9 193.6 256.1 106.7 226.6 108.7 127.9 137.9 192.4 250.6 103.8 112.5 124 133.4 113.2 196.5 208.8 158.4 120.5 120.2 250.2 112.2 89.6 185.1 109.1 107.9 227.1 124.4 210.7 164.8 129.3 109.9 373.6 99.7 73.9 136.7 137.7 68.9 218.9 194.4 425 192.1 257.3 82.2 192.7 98.3 406.3 265.6 148 141.4 278.3 205.3 453.2 71.3 137 263 131.7 91.2 354.4 120.1 47.5 150.4 338.8 66.1 343.5 86.9 460.8 154.6 301.3 149.2 324.1 144.8 215.5 86.6 151.8 162.9 71.2 403 75.7 63.8 173.6 303.4 89.9 243 290.6 96.6 171.5 433.9 130.4 113.7 185.9 238.2 48.6 134.8 264.1 134.9 168.8 264.3 171.2 66.4 214 238.6 146.7 106.5 179.4 184.6 114.2 94.3 265.3 130.9 225.3 65.7 69.3 547.5 130 125.4 145.6 72.1 487.2 117 316.8 353.2 238.6 193.2 181.8 423.9 399.7 291.1 319.4 74.6 260.9 177.4 155 455.9 104.4 51.6 66.1 195.1 213.8 368.4 313.6 34.1 304.8 301.9 235.8 201.7 168.2 432.1 90.7 230.1 215.8 77.9 127.4 90.9 144.6 220 266.6 173.7 104.9 457.9 356.5 242.5 48.9 100.6 47.6 41.4 283.8 49.9 168.8 775.7 235.2 154.6 425 255.4 267 107.6 197.4 456.7 117.5 329.4 94 220.3 129.1 172.3 181.9 150 149.4 261.5 111.7 308.2 204.5 21.9 115.1 319.5 318.3 80.7 376.7 130 138.7 434.3 87.3 314.8 80.3 112.8 345.1 57.7 243.6 361.7 193 299.1 463.3 295.7 277.9 199.1 604.2 371.6 198.4 73.7 311.7 39.9 211.4 170.6 222.9 159.2 392.5 118.8 259.5 101.7 238.5 243.2 302.6 41.5 212.7 351.2 64.6 224 317.8 342.5 22.6 161 220.1 407.4 333.5 148.5 263 364.5 63.2 319.8 246.2 779.8 591.2 567.8 152.8 80.6 203.2 460.7 69.9 136.9 109.2 135.7 502.4 270.1 160.7 186 572.7 407.3 314 194.9 235 286.3 85.7 448 496.9 153.2 226.9 81.8 243.4 116.4 313.9 269.6 327.4 288.4 79.9 283 589.8 240.4 284.3 68.4 195.8 219.1 230.7 293.2 188.5 412.7 450.6 519.8 254.2 203.6 258.4 591.1 89 387.7 84.7 475.4 89 320.5 132 417.1 417 318.8 235.5 123.6 161.9 270.2 146.9 102.4 167.6 91 199.1 99.1 257.2 161.5 192 113.6 113.9 55.3 226.1 232 204.6 233.7 223.3 148.3 158.4 254 212.4 254.5 210.9 96.2 82.4 126.8 285.4 139.2 105.7 91.5 454.7 62.8 77.2 139.9 163 157.3 208 380 320.9 167.6 216 435.7 45.2 54 277.5 465.4 79.6 235.2 159.8 169.3 196.9 108.3 206.5 88.7 209.3 112.3 165.4 71.8 413 135.2 232.4 70.7 195.1 159 146 292.4 172.9 203.1 146.4 246.7 186.8 236.6 183.5 287.1 126.7 243 147.3 133.5 118.9 286.7 136.9 124.1 98.3 258.3 378.6 145.6 222.3 214 113.1 314.2 282.4 163.4 195.3 111.8 313.5 98.9 171.5 107.9 178.9 148.6 161 221 186.4 257.5 296.4 94 69.1 203.2 140.4 217.6 216.1 24 245.5 455.1 58.5 181.3 140.3 110 255.1 625 182.5 636.9 159.7 30.8 303.8 128.8 140.1 115.1 443.9 232.7 155.2 197.1 117.7 234.7 322.8 189.2 90.3 165.5 116.7 142.6 332.1 357.6 62.3 229.3 262.9 316.9 131 265.1 202.9 123.2 273.1 341.1 302 23.8 162.8 Nicotinate 15.7 17.9 17.1 15.8 14.6 15 14.9 16.6 16.1 14.9 14.8 14.8 17.8 22.7 20.2 20.8 17.7 20.7 19.7 19.1 19.1 18.3 19.1 23.9 15.8 14.1 14.6 14.6 10.8 13.2 14.4 14.6 14.1 19.5 15 14.9 20.1 19 18.2 15.7 18.4 19.5 19.2 19.7 18.1 18.8 18.5 19 8.2 12.2 12.5 6 6.3 5.3 11.7 5.6 11.4 15.4 5.9 11.1 8 9 6.8 12.2 9.2 7.5 5.2 8.3 12.1 5 10.1 7.2 5.2 8.1 15.2 6.4 11.5 5.1 12.3 4.1 29.3 12.5 8.3 8 10.8 3.1 19.1 14.7 10.7 17.1 5.4 5.7 17.6 8.9 36.2 14 7.2 5.9 15.8 4.8 21.9 13.2 3 29.6 15 8.9 28.3 6.2 3.3 13.3 14.3 4.7 12.7 6.4 17.8 9.9 17.2 6.9 7 12.7 17 7.1 4.7 13 4 8.9 8 2.6 3.7 16.9 12.2 5.4 15.4 6.8 5.3 8.9 7.7 5.8 7.2 9.7 9 4.1 9.7 7.1 6.5 9.7 5.4 3.8 12.5 18.5 13.4 6 21.1 21.9 4.8 4.5 27.3 11.2 16 3.7 5.2 8.8 5 10.5 7.1 3.1 50.6 3.8 18.8 32.9 15.4 9.9 6.8 39.4 34.7 2.9 10 6 5.5 10 9.1 7.2 18.3 3.2 14.3 25.4 12.7 8.6 33.9 4.9 5.7 9.2 7.1 3.1 5.1 34.6 5.3 28.2 3.6 3.8 5.8 6.5 8.3 15.5 28.6 1.6 5.4 15.9 44.9 8.2 2.3 8.9 1.4 8.5 30.3 6.3 18.9 8.3 23.9 15.6 39.8 4.4 44.5 9.1 32.6 45.4 8.4 15.1 4.9 6 8.2 14.7 10.3 15.6 10.5 20.5 11.2 12.3 21.5 0.9 8.6 1.3 5.4 7.9 27.7 7.8 11 20.7 3.5 23.3 4 5.3 16.1 6.1 16.9 47.6 14.5 14.2 12 11.9 9.2 4.6 24.2 26.4 19.9 8.6 12.4 1.8 10.8 19 9.7 9.1 24.9 8.8 7.3 15.3 6.3 15 15.6 6.1 6.6 32.5 9.3 10.6 12.5 11.5 2.5 9.6 16.8 9.6 29.2 6.3 35.4 30.4 5.8 14.1 25.3 39.1 56.3 31.1 16.8 6.8 16.5 32.4 3.9 4.1 12.9 16.2 6.9 8.5 6.2 7.7 25.2 33.4 8.8 10.7 20 9 3.3 22.4 36.9 13.3 10.2 5.3 12.7 15.2 14.1 18.8 17.8 25.7 2.6 14.5 30.2 21.3 40.3 2.1 17.1 6.5 6.5 31.7 14.5 13 16.6 22.4 8.4 9.4 15.3 18.2 6.3 29.9 8.9 7.5 13.7 16.1 12 21.7 29 19.6 9 17.5 5.2 5 20.7 4.9 16.8 2.6 10 16.3 17.7 10.3 27.7 5.8 15.2 3.9 22.6 22.3 16.2 16.3 18 32.3 40.2 21 13.8 17.5 10.3 8.8 4.8 16.4 26.6 11.4 3.2 7.6 26.3 3.9 19.9 15.9 17.4 7.8 10.6 16.1 21.5 15.4 19.6 36.3 13 5 13.8 27.7 3.1 20.7 21.8 22.6 5.7 38.8 15.6 5.9 33.8 3 18 3.6 48.6 16.8 14.6 3.8 14.1 11.9 6 31 12.6 6.9 7.2 37.2 16.7 5.5 15.2 18.6 12.9 11.7 6.9 24 9.1 12.9 23.1 14.8 3.4 26.7 8.5 6.6 13.6 13.7 12.2 12.7 22.2 7.4 8.9 5.3 18.3 14.9 21.4 5.9 3.3 17 18.6 10 11.8 12.7 24.8 3.7 3.4 7 6.9 35.2 6.7 2.8 6.4 16.1 7.1 5.8 6.3 16.8 15.4 51.1 21.4 55.2 3.5 4.5 4.5 9.3 12.4 7.7 26.3 17.5 7.4 18.3 7.1 23.5 19.3 7.9 8.7 15.1 17.5 8.1 20.8 21.3 2.5 16.4 9.3 20.9 5.4 17 2.1 7 4.5 18.7 8.8 2.6 3.5 Phenylalanine 232 225.5 238.2 239.5 242 249.1 249.5 273 260 265.6 270.4 271.2 235.6 235.2 235.9 239.4 201.6 217.9 203.7 206 255.8 249.5 242.8 237 211.3 217.7 226.6 222.5 224 217.7 222.3 228.3 224.4 206 231.5 201.7 207.7 222.6 208 202 211 207.1 211.4 238.3 209.3 214.5 202.7 207.8 160.5 230.5 268 139.6 283 136.8 161.8 201.4 234.7 297.2 132.8 144.3 150.3 171.1 147.3 241.2 288.5 248.9 149.4 145.5 267.1 155.9 108.5 232.9 133 125.1 250.2 154.6 240.9 288.4 150.3 120.1 487 116.9 85.9 174 137 72.9 217.8 180.9 454.9 222.8 277 99.6 336.9 93.7 431.9 271.2 212.1 158.4 259.9 299.4 410.3 99.2 179.5 215.3 164.8 110.4 589.4 140 99.7 150.8 423.2 59.1 222.4 110.3 530.1 157.7 235.4 156.6 239.1 185.1 220.1 118.2 261 197.4 83.5 422.2 195.4 109.9 170.9 319.4 95.1 403.1 293.5 133.1 289.2 656.9 133.5 135.3 189.4 268.3 77.2 173.4 307 172.8 239.9 308.8 232.8 105.9 260.4 276 165.1 122.4 240.3 212.3 200.3 98.5 285.6 171.2 239.3 90 61.8 596.2 187 108.7 61.8 124.9 741.9 160.9 349.8 433.6 343.7 154.5 376.5 419.4 450.9 401.1 390.9 117.6 244.5 203.9 170.5 374.9 134.5 72.7 64.1 183.2 230.9 421.4 279.4 52.5 377.4 416.1 308.8 256.9 392.9 527.3 131.2 233.6 277 67.4 117.4 97.3 161.8 344.3 279.5 127.3 129.6 446.8 373.2 281.8 58.2 115 71.2 102.7 337.6 62.7 194.8 853.1 274.1 130.6 385 273.9 294.4 120.9 267.9 537.7 193.3 359.5 151.8 248.3 73 208 292.1 176.9 187.6 250.5 212.6 386.5 289.9 24.3 124.1 279.8 416.2 100.7 465.4 180.1 82.1 426.2 183.5 368.7 120.7 91.3 472.3 80.6 300.2 433.8 193.5 299.1 459.4 315.8 343.6 204.8 499.7 442.4 240.2 80.7 451.7 42.2 239.1 165.2 264 198.5 412.2 126.8 279.6 132.7 241.1 320.2 278.6 83.8 246.8 371.5 184.9 307 314.3 485.9 38.7 242.6 338.3 364.3 328.5 178.2 271.8 451.1 75.6 317.4 285.8 773.3 614.1 808.4 159.8 87.7 229.6 527.2 142.3 240.9 150.2 87 573 443.3 171.1 177.2 652.1 448.9 325.9 204 214 414.7 137.6 669.4 826.3 156.4 249.5 131.4 276.7 141 316.4 285.3 360.1 290.3 135.5 285.1 592.2 281.8 228.7 95.1 226.9 275.3 305.2 381.7 253.2 437.7 515.9 591.5 203.6 239.8 301.1 518.9 159.1 475.4 119.8 386.9 86.1 334 174.5 473.3 381.9 352.9 171.1 130.1 159.4 295.1 146.1 76.4 168.2 91.8 215.6 58.1 277.2 144.8 190.2 105.7 268.8 79.3 212.5 249.5 203.7 241.3 208.1 143.8 202 187.8 228.8 266.5 173.7 70.6 133.9 148.3 253.7 128.5 159.3 92.3 523.3 56.2 101.4 165.2 119.9 183.2 312.6 393.1 351.1 206.2 258.5 442.7 111.4 75.2 243.3 528 109.7 228.9 187 206.4 203.1 122.2 306.9 135.8 212.1 92.1 164.4 146.1 324.4 117.5 233.6 87.1 146 186.7 235.7 321.3 190 204.3 117.3 258.5 192 237.6 214.2 298.2 148.7 360.9 136 158 135.5 356.5 164.4 157.8 125.7 258.8 358.6 188.9 129.2 224.2 111 256.2 258.4 150.7 193.4 89.5 170.2 108.8 167.8 117.4 238.5 178.3 172.6 243 147.2 287.7 385.5 87.2 100.3 218 175.3 326.8 285.1 26.4 355.7 606.1 33.7 225.4 161.9 141.5 268.6 603.1 208.1 435.7 157.4 51.6 357.1 103.5 181.7 170.2 494.6 239.3 180.6 222.5 144.5 243.7 187.3 247.6 111.7 187.6 127.8 230.3 317.9 324.4 93.2 236.4 308.1 382.3 250.6 369.1 239.2 130.5 384.7 341.8 344 36.1 163.3 Proline 314.7 293.2 359.3 348.7 283.6 306.5 353.5 358.8 285.2 289.1 277.3 265.8 252 268.3 248.3 318.8 248.2 310.1 254.6 269.3 336.1 307.4 298.2 1487.3 285 301.1 281.7 320.7 262.3 245.8 283.8 287.6 306 287.1 296.5 294.6 234 250.8 301.5 199.3 244.4 272.1 261.6 308.9 247.5 265.3 306 256.2 225 346.5 437.9 183.5 344.3 143.1 211.9 262.2 317.3 401.9 145.4 191.7 163.4 214 233.4 326.4 320.9 309.3 168.7 147.8 408.3 139.2 123.6 218.2 166.8 168.8 472 194 328.1 444.2 172.9 185.1 444.8 495.7 346.6 448.8 240.5 91.8 337.6 420.8 446.1 237.8 499.4 154.3 276.3 186.6 571.3 298.9 524.4 494.6 350 405.2 807.6 477.5 163.7 604.2 193 218.5 1143.9 276 140.9 314.5 583.3 108.3 460 165.8 614.1 297.5 345 242.1 519.2 214.3 409.8 158.1 251.2 149.2 76.1 439.8 501.8 80.7 59.5 464.5 132.3 250.9 391.1 130.2 185.7 566 279.5 163.5 364.1 335.2 192.2 198.5 239.2 268.5 231.5 744.8 169.5 117.6 438.1 342.1 211.8 159 211.8 363.3 194.5 181.3 343 203.2 152.6 77.7 122 695.9 168.8 183.8 585.1 175.5 769.5 234.7 1188.8 533.3 484.1 271.5 353.4 598.4 571.7 420.9 487.5 101.6 169.3 579.2 480.5 494.6 175.6 71.2 176.9 343.3 308.8 558.9 467.8 62 1069.4 385.1 525 280.1 649.6 480.4 131.9 441.7 246.2 461.5 216.6 106.6 610.5 357.6 311.6 156.3 379 642.4 606.8 435.2 42.5 177.4 92.1 117.7 456.3 226 356.2 888.8 666.7 962.5 618.2 393.4 547.2 168.1 433.1 540.1 176.3 374.6 143.5 299.4 191.4 332.9 377 303 409.1 374.2 334.7 456.5 417.3 43.8 177.6 248.3 918.2 140.6 632.7 168 471.9 831 210.8 399.2 238.8 242.8 379 78.5 153 1312.7 897.2 445.3 595.4 348.7 384.8 289.4 769.6 598 186.2 124.8 293.2 63.1 244.6 958 307.4 153.6 650.4 119.6 150.7 354.9 354.5 408 339.5 179.9 176.4 361.3 127.9 571.5 810.5 477.4 33.5 387.8 380.1 307.2 393.5 133.3 1080.6 479 612.1 770.8 303.5 796.4 528.6 767.7 204.3 141.6 235.4 564.3 123.9 133.1 377.5 146.4 561.8 553 200.7 374.8 676.2 481.4 288 193.9 402 666.6 137 1244.4 579.5 225.8 301.7 198 188.2 227.4 510.6 632 178.1 1106.3 68.1 356.7 144.5 277.6 723.4 280.3 122.1 330 364.8 611.5 792.1 644.3 332.2 756.7 246.6 412.1 387.2 649.7 194.6 1025.1 267.5 707.1 133.6 791.5 225.8 341 428.1 490.9 277.3 228.6 105.1 237.9 169.9 114.8 211.6 94.8 258.4 120.1 260.1 143.5 218.1 166.1 224.7 66.7 227.8 186.6 408 324.3 180.6 249.8 174.2 452.5 239.9 602.5 460.5 210.2 70.1 347.9 391.2 171.5 207 208.5 961.4 149.4 130.7 201.1 151.1 239.2 403.6 293.1 284.4 272.2 327.5 203 203.7 139.2 274.6 567.8 136.3 262.5 1654.3 195.4 391 367.8 168.1 150.2 332.4 136.4 190.1 190.4 485.3 217.6 674.7 114.1 178.9 169.9 243.8 436.3 184.7 242.5 354.1 310.8 256.2 239.1 153.8 259.9 164.2 343.3 151.5 207.6 216.9 611.6 486.4 568.5 165 339.5 422.6 218.9 352.5 246.1 76.7 427.3 429.7 333.2 214.4 272.1 285 198.7 223.9 187.9 360.9 230.6 731.7 332.9 233.9 322.7 552.5 271.7 77.2 235.5 319.6 512.2 621.1 31.6 443.3 930.4 181.7 580.8 220.6 346.5 337.4 1233 276.8 1004.7 96.5 28.9 449.7 127.7 324.4 430.1 606.2 384.3 326.4 116.3 418.7 212.4 232.5 342.9 209.6 654.9 270.1 218.8 387.5 584.3 100 441.9 275.7 370.5 599.1 567.4 351.1 195.6 133.8 246.7 338.9 10.8 169.2 Propionate 1242.4 1301.6 1339.3 1320.5 1241.8 1312.9 1275.5 1384 1559.6 1623.9 1579.3 1643.8 1444 1536 1479 1447.4 1282.2 1358.3 1314.3 1290.7 1709.6 1573.5 1608.5 1562.4 1217 1334 1379.2 1324.4 1201.1 1225.4 1310.6 1256.6 1292.9 1363.7 1350.6 1327.5 1295.7 1391.3 1320 1267.4 1297.1 1313 1303.8 1567.6 1317.7 1319.1 1329.2 1347.5 1757.9 1743.9 2233.2 741.8 1564.1 951.9 1395.9 1862.3 1744.6 1846.1 954.9 1062 1024.9 1339.1 765.2 1712.5 1504.6 1583.9 1027.1 983.5 1864.5 913.9 896.5 1830.4 371.2 1027.1 1841.7 1303.2 1587.3 568.2 1238 3412.3 861.4 755.1 30.1 794.9 1006.2 270.1 1179.6 88.7 1922 5233.6 3770.4 175.1 914.1 999.7 2003.1 1593.2 1560.4 1593.5 2294.8 98.7 3884.7 22.7 205.7 2291.1 468 856.2 6094.2 1729.8 1862 2008.6 1494.9 604.7 2671.2 148.9 2818 397.3 3138.9 761 3725.1 706.6 2047.9 374.6 126.2 481.3 786.1 2899.1 126.6 15.9 195.9 2921.9 106.2 94.8 2060.9 1390.1 168.7 114.4 1934.3 3598.1 553.4 1771.3 192.8 701.9 2487.5 854.9 205.6 1637.3 107.7 131.6 1133.6 1273.8 513.4 1291.1 372.2 2483.7 117.5 25.6 1920.8 1710.6 366 41 135.5 2951 234.1 1606.2 1301.8 107.6 3765.5 706.4 1113.4 2186.3 1534 2601.8 129.3 6154.3 3326.5 1287.6 4170.3 234.1 3273.7 2096.3 1186.9 4193 1694.9 14.8 24.2 1218.9 934.6 3195.1 2279.5 36.4 1010.2 2620.2 718.1 450.7 184.5 2411.5 2084.6 1123.1 2547.8 1161.5 897.2 135.3 1104.4 1074.8 901.8 50.8 316.8 4856.5 3841.5 1322.5 25.6 2034.1 65.4 65.6 3200.5 155.2 1220.8 607.1 962.5 1696.7 2464.4 510.5 3472.2 370.2 1219.5 6998.9 299.4 3031.1 48.6 1819.5 1447 1235.3 2308.5 2096.1 101.8 2913.2 899.3 4935.4 2514.7 114.7 955.1 994.8 4163 680.4 3026.1 198.8 1138.4 5008.8 241.1 1998.8 446.5 41.5 3086.1 399.5 928.4 1323.8 1357.9 2969.2 2014.5 4012 2478.4 661.6 13775.7 2618.9 1774.1 979.8 964.1 23.2 2408.8 3475.7 2801.3 1907.5 2759.7 700.1 70 488.3 2685.6 2571 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654.9 1165.9 2330.8 1029.5 76.6 1661.3 482 4960.7 434 1205.4 60.7 2606.2 3125.2 57.6 486.5 1247.5 599.4 1402 1353.8 2372.8 3005.6 511.2 2073.4 309.2 1469.8 1307.1 555.6 1708.3 1052.5 3393.9 158.4 1601.1 2130 41.2 167.8 902.6 370.7 1216.9 95.1 20.8 315.1 1732.6 10.1 2826.9 1233.5 437.5 1489 4066.5 707.5 6676.9 66.1 25 4094.2 24.4 2178.6 297.9 2852.9 1073.2 710.9 722.6 296.7 4546.3 485.4 1157.3 171.4 2067 259.5 311 4490 2063.5 33.4 1612.3 3592.5 2717.9 977.1 2834.6 2639.7 1633.1 397.7 767.7 3719.9 34.6 788.8 Propylene glycol 90 82.2 81.2 76.7 146.7 157.7 149.3 156.3 68.1 84.7 85.7 91 83.6 89.4 82.4 81.1 69.1 73.2 60.5 63 71.3 61.4 55.1 64.8 74.8 80.7 77.2 70.1 62.3 57.8 76 55.9 71.6 58.3 72.3 73.6 56.6 55.2 66.6 54.8 63.8 64.2 63.6 56.6 60.5 66.2 63.5 72.8 62.1 60.6 53.7 138.4 83.2 15.2 58.9 64.4 60.2 46.8 46.4 33.2 33.4 50 139.5 61.8 84.9 34.5 33.8 50.6 47.8 10.5 9.8 65.8 131.2 63.9 49.2 55.6 80.1 1498.1 48.8 15.5 88.6 62.6 16 96.9 13.7 405 77.9 606.2 82.4 41.3 61.1 253.6 71.3 11 145.7 20.7 294.3 36.9 25.4 215.5 152.5 1547 43.7 39.9 10.2 31.7 268.7 66.9 144.9 172.5 164 47 206 327.4 32.1 73 17.2 677.4 82 34.4 263.5 16.6 690.4 239.4 8.6 61.8 425.2 190.7 102 32.5 70.4 316.7 19.9 14 303.2 456.1 48 16.9 141.1 71.8 8.9 155.6 33.4 11.7 1213.1 22.5 33.6 30.9 81.4 49.7 22 7.7 27 69.4 753.7 22.8 26.7 16.1 37.4 190.6 4.9 118.6 77.9 18.3 305.2 1744 94.5 260.3 47.4 22.5 64.9 13.7 213.3 50.7 76.7 65.4 322 259.4 47.3 43 32.8 50.3 65.2 75.3 53.3 18.1 31.7 64.6 72 57.7 109.3 109.1 220.3 21.8 685.6 29.5 19.8 159.6 21.8 396.1 19.4 36.4 1535.1 491.8 31.7 129.2 39 158.7 124.6 16.7 311.9 155.3 183.9 1516.7 133.7 115.8 33.8 378 43.9 385 258.8 34 89.2 26 60.1 58.6 587.7 42.8 193.4 29.2 87 31.5 41 77.6 844 51.1 19.2 50.6 42.6 66.5 8.9 76.5 71.8 14.2 55.1 9.5 138.4 39.4 815.9 37.2 199 829.5 136.1 458.8 245 40.5 36.5 53.2 39.8 29.7 33.2 27.6 57.3 38.9 62.8 13.7 127.8 206.9 46.3 46 33.9 33.9 60.8 9.9 384.7 49 72 41.4 30.1 510.2 146.4 90.6 248.9 32.7 108.7 135.6 152.7 920.5 26.6 260.9 45.6 16.9 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264.2 53.8 585.8 29.9 672.6 63.3 39.7 42.9 44.6 745.2 71.5 21.4 28.7 13.2 274.6 49.4 420.9 66.1 71.9 45.6 105.8 36.5 50.4 81.2 83 100.8 16.2 43 45.7 51.6 54.1 103.4 Succinate 1561.1 1524.6 1597.7 1596.1 1996.1 2088.1 2092 2146.1 1563.2 1578.8 1597.4 1617.1 1938.8 1987.1 2050.2 1961.6 1297.4 1346.1 1309.9 1279.1 1752.1 1633.5 1626.4 1631.1 1762.4 1836.6 1864.8 1871.1 1777.6 1780.1 1861.6 1825.7 1822.6 1759.2 1897.8 1831.6 1722.9 1814.4 1768 1756.6 1709.9 1731.2 1739.2 1572.7 1733.1 1778.7 1721.4 1752.2 705.8 1873.1 1807.7 1942.9 1914.4 903.8 1725.1 742.7 1893.7 2466 770.6 1170.3 1194.4 1616.5 2011.5 1907.8 1880.8 1317.5 1177 808.2 2497 860.4 864.8 757.6 1859.3 827.6 2427.6 1517.5 1829 388.4 72.4 11.7 5438.6 1363.4 8526.6 45.7 2194.5 1468.1 97.5 3425.6 11474.2 1972.4 4731 860 6859.2 1793.5 356.3 5295.6 90 14.7 277 3969.4 217.2 736.6 1019.4 13438.3 5425.6 361.2 221.7 220.9 46.1 970.5 148.5 510.3 7852.6 169.6 4345.7 1192.4 30.6 674.1 73.2 6856 119.3 3483.6 116.7 3983.5 63.4 33.5 1844.1 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152.4 71.8 6337.5 9358.4 257.9 160 4790.9 7719.1 5044.4 7219.9 2886 3617.2 7140.5 1120.9 4254.1 3172.9 94.3 5959.3 3862 402.8 7190.6 192.7 360.2 125.2 179.3 526.8 210.1 25847.2 81 198.8 61.1 150.2 76 2115.7 52.5 4428.5 16886.1 30.6 24.1 3019.5 20.7 1882.6 130.7 4222.7 4780.8 921.9 75 5319.3 82.3 260.1 84.9 208.8 5641.4 7658.5 128.9 215.8 85.4 2231.6 1233.2 6024.3 394.9 306.1 488 Threonine 404 375.6 392.9 378.9 471.9 431 443.5 516.7 535.2 414.7 552.6 568.4 388.1 344.5 358.9 364.6 431.9 344.6 438.9 426.2 410.3 336.9 371.3 401.6 333.6 337.6 350.4 332.7 345.8 333.3 391.7 326.8 327.3 304.7 321.5 331.6 300.2 300.3 297.2 323.8 323.3 321.8 314.4 328.7 313.2 317 330.2 329.8 235.7 367.1 462.3 245 360.9 176.2 217.3 213.7 381.2 433.7 190.2 226.5 210.2 218.9 319.1 406 382 423.9 203.3 221.9 486.8 221.5 170.7 295.3 259.3 219.5 402.4 220.1 369.4 632.5 311 190.8 934.1 292.6 191.5 363.9 273 39.9 314.7 520.6 721.3 352.3 544.5 214 166.5 228.1 902.8 100.3 527.7 278.6 153.9 200.1 289.7 904.1 156.6 606.3 156.7 248.3 627.5 353.8 198.5 310.2 524.8 218.6 635.2 67.4 751.6 152.2 690.9 506.9 834.6 227.6 463.6 242.1 406.3 239 104.4 718 718.1 200.1 80.1 572.1 169 633 524.4 219.4 101.2 1076.9 155.9 237.7 427 532.8 138.7 131.9 474.9 265.8 330.8 387.7 73 129.4 615.2 452.1 249.4 224 302.1 340.5 457.9 2415.9 448.7 227 427 243.4 144.2 646.6 962.1 230.6 356.1 792.6 976.5 112.7 250.9 615.7 487.7 332.3 560.3 722.6 415 493.7 588.5 215.1 156 773.8 302.4 671.6 164.2 351.8 360.4 419.5 459.1 589.7 563.7 143.8 521.6 545.8 272.3 614.9 1023.4 476.8 78.8 282.7 157 547.1 128.9 308.7 509.3 444.8 456.1 183.4 224.2 828.2 797.8 531.7 164.6 300.9 91.8 410.6 493.1 111.5 151.9 1520.8 310.8 105 455.3 450.3 645.7 151 627.2 967.8 209.5 579.6 263.9 363.4 244.5 115 490.5 334.9 445.4 258.7 347.4 666.9 397.2 22.8 208.6 445.4 453.8 149.4 805.8 235.7 5943.8 478.8 372.5 508.1 203.4 184.4 621.8 62.5 386.6 910.1 139.7 634.2 305.7 276.2 490.5 192 1037.8 561 986.3 74.4 721.8 193.4 328.1 450.8 98.3 360.9 884.6 188.4 652.9 124.7 431.8 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282.2 436 339 96.3 245.6 479.5 52.8 139.8 154 220 151.8 87.5 554.1 192.6 352.6 792.5 2081.4 41.2 353.8 358.6 608 1175.4 53.6 126 952.8 144 330.3 279.4 322.5 336.4 629.5 357.7 1132.8 59.3 58.2 562.4 297.7 317.3 191.8 812 114.7 310.4 1746 297.1 179.7 351.2 406.1 170.6 815.5 384.4 418.8 193.6 593.5 258.4 395.8 173.4 635.7 293.4 602.6 431.1 207.9 311.1 261.5 389.9 22.5 93.6 Tryptophan 46.6 46.8 47.8 49.1 45.7 39.6 49.2 49.5 51.3 48.7 51.5 53.9 53.2 49.9 38.8 43.5 46.7 51 44.3 44.3 46.3 48.2 46.3 54 44.5 44.8 43.5 35.6 46 44 38.1 45.2 44.9 44.4 45.6 45.5 43 45.5 43 43.7 44.1 41.4 42.3 43.3 43 45 41.3 36.2 23.5 57.3 64.6 40.3 71.7 35.1 57.3 57.4 77.9 92.2 60.2 31.5 42.1 65.1 57.2 60.8 86.1 82.2 57 51.1 83.5 51.6 31.5 82.5 22.1 19.8 71.3 30.2 67.5 70.2 56.6 47.2 230.1 27.9 30.9 88.2 41.6 31 70.1 38.9 125 37 85.5 68.5 53.9 47.8 122.3 64.7 123.1 57.1 59.3 84.4 58.5 29 51.5 155.3 37.8 28.9 261.1 54.3 31.7 99.9 143.7 26.4 129.2 49.5 213.8 29 146.1 40.3 118.3 44.4 117.7 42.6 136.1 50 19.1 152.9 66 63.7 30.6 136.4 17.3 109.7 99.8 25.9 81.8 166.1 22.4 46.5 49.9 98.9 20.1 40.8 111.5 51.5 30.7 117 68.4 24.1 119.8 103 44.6 23.3 45.5 57.3 76.1 41.5 141.3 42.2 46.5 24.3 43.1 221 61.3 44.4 121.4 60.6 231.5 45.4 46.2 176.1 98.8 94 68.2 175.6 154.2 110.5 124.6 34.4 49.5 49.9 46.3 163.5 44 22.9 16.7 64.8 56.7 144.3 129.3 25.4 106 132.7 39.6 160.6 108.3 168.3 30.1 72.1 27.1 67.8 149.9 30.2 78.6 102.1 107.6 22.6 42.7 173.1 124.4 73.4 14.3 59.2 18.3 68.4 113.1 24.3 42.7 246.7 82.6 53.6 77.9 73.5 119.7 84.7 69 154.5 55.3 67.5 33.3 89.7 56.7 41.8 119.9 51.7 45.2 44.8 66.1 180.7 79.6 3.2 45.2 95.6 96.2 28.6 118 60.8 93.6 85.6 50.6 105.3 35.7 24.9 222.1 28.1 85.3 130 26.4 98.5 63.2 109 91.8 32.4 203.6 93.6 56.6 24.7 78 13.8 48.4 104.3 53.3 54.8 148.2 23.7 62.7 38.5 80.5 99 87.1 35.4 54.6 110.2 41.8 82.5 45.1 153.4 11.7 30.8 99.7 122.2 126.9 66.3 91.7 113.4 43.2 128 59 248.2 227 195.8 36.7 41.8 48.5 261.5 23.3 54.1 56.3 60.2 274.5 94.9 126.7 71.7 171.1 90.2 33.5 32.8 61.2 98.5 42.5 142.8 179 30.3 82.9 39.6 66.5 70.2 87.8 72 77.7 126.6 49.6 80.1 88.4 66.2 91.4 32.3 55.7 107.5 67.7 126 66.3 105.8 160.4 163 66.2 90.1 105.6 63.7 30.6 129.6 28.6 164.2 23.1 94.4 45.5 95.2 202 127.1 58.8 53.3 39.3 48.3 34.4 17.9 51.3 28.5 69.1 17.7 53.1 27.8 45.2 26.5 55.7 26.3 51 46.7 38.6 89.8 43.3 36.1 57.8 132.4 64.3 54.9 55.4 51.8 29.3 42.6 40.2 35.5 48.8 33.1 83.6 18.5 20.3 32.7 31 72.2 117.5 45.9 75.6 62.5 42 94.5 41.7 16.3 40 50.1 41.1 44.9 35.9 43.1 59.7 37 31.3 37.9 36.9 42 59.6 41.7 54 34 59.9 23.4 43.1 36.3 65.7 76.4 37.1 30.3 74 48.6 41 48.2 44.2 42.8 37.9 96.8 34.6 31 46.9 170.6 40.9 34.6 22.6 50.4 65 56.3 34.3 64.1 21.1 33.7 35.5 49.7 34.7 17.5 104.6 20.5 33.4 20.4 49.6 39.9 39.7 100.6 23.1 57.4 154.7 27.1 27.3 55.9 63.3 100.6 73.1 4.1 70.6 172.6 9.7 88.3 28.2 18.2 44.7 216 58.2 189.8 15.7 18.5 119.1 32.8 82.5 61.1 219 296.8 48.3 52.3 57.5 46.2 33.9 85.1 62.2 71.9 41.5 62.6 49.5 94.6 31 85.1 107.4 130.2 109.9 140.7 79.9 20.2 47.7 79.5 97.8 5.8 44.6 Tyrosine 256 248.5 264.3 275.1 268.1 269.7 281.3 307.4 276.2 287.2 298.3 292.2 279.6 276.6 287.3 288.7 224.8 243.3 218.6 223.4 251.8 250.3 244.8 273.6 234.7 237 243.5 242.3 251.7 243.1 247.2 253.9 247.3 244.9 253.7 248.8 218.1 231.8 217 222.6 224.2 218.7 222.3 245.7 219.5 224.8 212.1 222.2 161.4 228.3 361.4 138.5 272.3 144.1 180.8 227.7 246.8 355.5 145.8 126.8 153.5 189.4 139.2 273.7 282.4 247 148.3 150.6 342.2 160.2 112.4 248.2 121.6 125.6 296.2 152.1 262.5 125.8 177.2 148.5 541.5 113.6 94.4 126 190.4 54.4 213.6 85.2 331.2 275.4 324.8 95.4 475.1 101.4 338.2 320.5 189 153.3 297.4 304.7 409.3 85.2 158.5 444.1 184.8 112.7 659.4 103.5 100.3 167.2 435.2 31.8 429.1 96.7 687.4 188.9 468.7 90.6 422.9 175.4 260.5 129.5 255.7 149 94.8 605.6 131.5 121.2 138.9 380.7 89.4 420.6 108.7 121.8 249.6 542 145.6 155.5 98.8 339.2 80 201.5 273.9 187.6 124.5 328.2 237.6 106.9 382.3 217.7 193 79.4 263.2 239.4 181.8 120.7 390.6 191.1 268.8 88.6 18.4 729 184 49.5 156.2 107.6 777.2 105.8 327.4 489.7 375.2 214.5 199 561.3 482.2 325.5 444.4 117.4 285.8 195.2 213.5 644.8 120.7 77.4 66.7 257.1 261.1 508.3 425.7 56.9 167.8 486.2 135.6 211.1 403.8 580.1 78.5 286.9 279.8 120.1 91.4 111.3 105.5 189.6 352.4 134.3 141.6 652.2 431.6 366.3 69.3 144.7 66.3 70.3 322.6 61.3 253.8 943.9 336.7 135.2 378.3 294.2 328.2 138.7 336.5 727.1 236.3 426.1 167.2 334.3 177.7 235.6 350.2 160.7 183.3 262.8 152.3 555.7 313.6 29.6 137.3 342.2 283.4 90.2 467.6 78 211.1 452 64 444.6 70.8 96 497.3 87.8 264.6 526.4 221.7 103.3 504 203.2 379.9 205.1 434 571.1 192.8 88 405 44.7 277.1 262.4 298.2 247.9 560.9 161.9 187.2 171 260.9 317.3 367.4 93.8 262.5 449.9 113.1 125.8 229 562.3 38.2 1356 373.5 563.5 434.7 109.1 345.1 595.3 66.7 406.2 310.3 966.1 537.1 699.8 132.5 103.6 269.1 503.9 126.7 194.1 146.3 223.2 378.6 337.5 171.7 235.2 808 359.5 345.2 255.4 224.2 390.3 104.7 621.2 771.4 228.7 294.2 123.7 173.1 163.4 371.5 332.3 414.3 416.2 127.8 357.8 446.6 321.9 317.2 89.1 215 348.2 248.9 287.7 273.2 537.2 477.3 684.6 333.2 284.9 368.4 533 155.9 574.7 138.5 614 99.9 361 171.3 537.8 335 520.4 234.8 120.9 170.8 355.2 169.4 86.5 234.3 82 209.7 61.7 336.5 175.8 261.7 117.9 269.6 81.8 233.1 332.7 239.2 290.9 242.8 173.1 198.8 301.3 255.6 370.4 248.5 80.5 90.6 146.4 267.3 174.5 171.8 102.9 427.1 67.2 140.4 203.2 142.8 245.5 243.5 323.9 410.3 212.6 293.3 330.5 127.2 38.5 180.8 562.9 112.2 253.9 213.7 176.5 218.7 200.9 270.2 147.8 226.6 96.8 173.4 131.9 358.2 142.2 281.7 73.8 131.8 185.6 232.1 406.8 185.6 240.5 166.6 297.4 214.7 269.4 229.5 363 172.3 301.1 193.3 136.7 155.2 397.1 187.4 176.6 130.9 297 358.2 226.9 167 209.6 124.5 281.7 264.5 231.5 195.7 81.7 359.2 134 205.7 121.6 227.2 217.7 187.8 298.4 176.5 335.4 502.3 105.8 93.3 141.2 155.9 399.1 273.2 27.5 199.5 708.8 42.9 255.7 183.6 96.3 315.5 761.8 209.1 798.7 125.5 50.1 400 112 212 157.9 568.7 204.8 191.8 236.2 106.6 245.8 215.3 307.7 146.1 228 136.9 230 353.7 445.1 97.9 350.9 336.3 407.9 184.1 481.8 318.2 136.9 172.6 329.2 239.2 26.8 62.4 Uracil 176.3 180.9 187.1 188.9 210.7 223.1 213 226.9 186.4 198.6 191.7 204.6 185 206.6 198.6 195.8 172.7 179.2 164.5 161.9 201.1 185.6 186 148.6 174 179.7 192.5 185.2 175.3 175.2 186.2 178 186.7 198.6 192.1 191.4 182.2 198.4 186 178.8 179.2 177.9 175.1 182.6 180.2 181.6 181.2 184.3 148 198 359.1 106.2 258.5 94.3 166.5 140.1 190.1 260.3 94.8 147.6 137 159.1 126.4 219.6 239.4 243.1 132.7 116.5 302 92.3 87.1 149.1 127.6 124.5 314.4 167.9 226.8 175.9 67.3 115.3 283 81.6 17.8 135.1 257.4 47.8 150.4 99.4 485.3 123.4 216.4 35 186.2 48.3 425.3 167.4 160 158.3 212.7 210.4 503.1 51.5 112.5 315.7 112.2 116.6 273.2 95.9 123.9 130.9 198.8 6.6 228.3 121.6 122 68.5 318 108.6 406.2 135.5 235.7 76.5 78.5 142.9 90.4 589 132.9 9.5 67.8 323.7 78.1 143.8 206.5 100.7 145.2 455.1 195.9 154 115.7 301.5 54.6 288.4 349 70.3 113.5 242.5 145.4 97.9 495.3 146.4 80.9 127.2 147.5 281.1 120.4 36.5 201.2 105.4 221.3 53 51 532.9 107.4 104.6 19.1 73.8 365.4 136.9 214.5 228.3 322.3 199.4 184.5 277.2 421.9 105.3 347 136.2 140.5 251.1 112 229.9 230.9 65.8 91.3 209.3 333.1 222.5 173.5 30.6 156.2 160.4 45.8 105.8 219.8 569.9 161 205.3 79.4 37.2 93.7 68.6 121.4 446.9 238.9 55 184.5 530.1 204.6 235.2 11.9 93.5 24.8 19.4 235.4 63 242.6 153.1 236 142.6 405.9 210.1 301.5 58 330.7 789.7 180.1 514 42.9 193.3 100.3 245.3 174.6 135.6 157.3 242.2 164.7 192.8 148.5 5.9 84 59.2 411.3 19.7 304.2 96.2 120.4 158.4 149.9 247.3 143.2 40.5 359.1 77.4 349 435.6 157.6 260.1 225.7 278.1 299.4 78.6 839.2 547.2 204.8 57.5 463.6 14.1 271.9 299.7 118.2 148.6 235.8 114.5 251.5 60.5 231.3 249.6 484.1 101.7 240.4 809.4 204.6 154.8 196.9 194.9 11.7 229.1 162.3 352.3 117.8 197.4 283.9 173 65 300 156.8 802.3 597.7 248.3 265.1 65.2 160.9 530 30.7 103.7 55 102.8 304.4 559.8 42.9 227.9 521.7 151.3 241.6 181 212.5 241.6 168.6 966 639.5 65.4 265.2 107.2 297.8 56.6 342.6 248.8 182.8 279.2 28.1 250.2 85.3 107.2 119.9 128.6 284.6 70.4 226.4 715.2 262.1 401.5 329.9 524.3 182.7 332.5 125.6 508.6 156.7 419.2 108.4 443.3 118.6 421.5 199.8 265.1 284.1 644.6 261.1 176.8 81.3 90.2 117 50.9 101.8 27 246.1 60.7 187.2 74.4 165.2 58.5 113.6 39.3 160.2 206.2 73.9 260.3 90.4 218.8 245 385.5 107.1 211.3 367.8 51.9 28.4 174.4 512.2 224.6 64.2 53.4 256.2 19.5 110.6 47.9 62.6 229.9 220.7 95.4 118.4 179 134.2 343.8 62.9 32.6 125.6 435.7 112.1 88.1 211.2 108.9 114.7 87.9 88.6 100.7 260.4 34.8 141.6 117.9 204.7 155.7 101.8 29.4 72.7 113.9 158.2 237.2 140.9 94.3 169.4 252.2 131.4 122.1 170.3 219.5 62.1 417.2 34.4 109.8 107.1 402.7 148.3 113.9 53.3 145.4 98.1 176.3 106.8 214.4 94.3 119.3 222.7 157.2 93.5 70.4 247.1 30.1 186.4 42.5 328.7 83.4 76.9 268.1 65.7 204.8 475.1 67.3 69.7 221.8 47.2 375.2 155.2 18.2 253.4 479.5 46.1 309 74.3 82.8 156.9 807.5 64.8 541 23.4 17.9 310.7 66.9 141.8 170.2 337.1 35.2 164.9 289.4 73.6 74 93.5 253.7 56.7 139.8 77.2 171.3 368.4 395.4 80.4 323.8 197 102.6 128.9 512.2 223.5 103.4 79 185 277.6 16.4 122 Uridine 11 7.1 12.3 10.9 11.7 10.5 10.4 8 11.2 12.3 10.2 7.8 10.1 12.6 13.5 9.6 10.2 8.4 8.9 9.3 9 9 7.3 15.8 8.2 9.6 10.5 10.7 9.9 8.2 11 9 9.7 8 10.9 10.9 9.5 6.8 9.3 8.9 10 8.8 6.6 9 8 8.7 7.6 8 2.7 17.4 4.1 6.5 13.6 2.7 7.2 9.2 5 7.3 2.6 5.2 4.8 1.7 1.2 3.1 6.3 2.3 2.8 1.6 5.9 1.9 2.5 4.8 0.9 3.4 3 3.2 4.9 2.5 10.6 3 2.6 3 5.8 12 5.1 2.6 12.1 13.3 7.3 7 3.6 3.9 4 5.2 16.7 8.3 3.5 7.7 7.6 3.5 20 5.7 4.4 8.1 3.2 3.5 2.7 2.4 5.5 4.9 17.4 8.9 43.4 4.9 36.4 11 3.4 7.8 86.5 6.3 15.5 26.7 2.8 3.8 2 10.4 5.9 1.1 10.3 27.5 7.8 20 10.9 2.8 2.8 7.1 6.4 2.5 5.3 32.7 3.1 40.6 6.7 3.4 12 23.1 3.5 2.4 23.3 7.6 13.3 3.1 7.7 12.4 3 2.8 6.2 8 2.9 2.6 3.6 70.4 2.4 4.7 8.1 12.5 102.8 1.4 21.2 35 7.3 12.2 8 12 85.5 16.2 42.5 3.4 9.5 4.3 4.8 52.2 14.9 1.1 4.8 8 8.3 12.7 42 3.1 14.2 50.1 7.3 9.9 8.9 4.3 2.6 8.4 1.5 6 0.8 3.3 5.5 2.3 16 4.7 31.5 8.2 12.3 4.6 2.6 5.2 1.4 7 7.2 3 6.5 9 20.9 9.3 7 51.4 11.1 3.6 13.8 15.3 3.1 3.6 2.5 18.1 27.5 1.2 17 4.4 2.9 6.1 5 3.8 12.4 0.5 3.2 10.5 5.2 2.8 3.9 15.8 8.8 43.1 3.4 40 5.6 4.6 8.7 2.3 9.5 10.2 15.2 6 82.9 4.5 18.5 5.8 14.5 11.3 4.8 3.1 4.4 2.9 4 4.8 6.7 8.6 27.2 2.4 4.7 4.1 4 10.3 2 3.6 2.1 5.1 3.6 17.5 12.5 51.4 4.8 56.7 61.6 7.4 30.6 3.8 16 35.6 11 4.2 21.2 8.5 15.1 47.8 5.1 9.9 7 5.7 5.8 2.7 4.2 11.4 3.2 5.1 41.1 8.6 25.8 3.9 27.3 9.2 21.3 6.1 2.7 4.2 9.4 6.4 4.2 4.9 11.6 6.6 49.8 5.4 79.2 14.5 75.4 14.1 9.8 12.6 16.7 8.9 13.1 16.6 3.7 7.3 10.4 29.8 7.3 46.2 4.1 2.7 14.7 8.2 3.1 6.3 6.6 12.6 9.1 3.8 4.3 23.3 23.8 5.9 6.5 10.9 7.2 7.7 7.9 7.5 6.3 6 5.6 9.4 11.2 3.8 12.9 7.2 10.2 2.8 6.4 8 2.2 9.9 7.5 6.7 12.9 9.3 10.8 13 7.6 4.9 2.6 8.3 13.7 4.5 4.8 21.7 6.7 2.2 7.3 5.5 3.6 4.1 2.1 7.5 5.1 3.8 6.6 4.8 6.4 4.4 9 10.9 1.5 9.8 3.7 6.5 4.1 9.6 7.2 8.9 15.2 2.5 5.1 2.5 5.4 8.5 6.5 1.7 5.5 15.7 2.7 13.1 5.2 6.7 4 13.4 16.2 6.4 6.2 24.3 10.1 3 7.7 3 2.6 15.7 9.1 6.7 4 8.7 6.6 3.8 9.9 12.5 12 7.7 7.6 3.8 7.9 3.4 12.9 4.2 6 5.4 2.1 9.7 3.5 6.2 5.3 5.4 30.3 7.5 2.9 1.7 3.4 9.5 44.5 2 5.4 5.5 1.6 3.5 3.4 4.8 7.6 6.5 6.7 13.2 4.1 1.3 4.8 10.1 3.2 1.4 7.9 3.7 5.5 13.4 3.1 6.6 11.9 3.8 3 4.5 6.8 1.8 26.8 1.8 2.2 5.2 3.1 20.5 5.3 8.1 2.3 9.7 5.6 19.8 12.2 3.9 4.5 Valine 680.6 655 698.9 694.6 620.5 672.4 632.2 710.7 756.7 764.5 758.2 769.8 652.4 678.2 667.9 657.5 567.6 627.6 574.3 561.1 624.8 589.4 582.4 657.6 542.4 582.8 584 572.8 551.5 552.6 584.3 569.9 597.4 602 602.7 610.5 535.1 584.9 555 540.3 533.9 544 548.1 582.5 545 550.4 541.4 556.1 418.7 471.2 741.6 275.5 526.4 248.8 304.4 382.1 477.3 565.9 224.3 290.9 275.8 321.2 295.6 475.3 560.8 495 298.6 279.7 574.1 230.8 288.7 460 376 238.4 599.6 322.5 487.2 647.4 307.1 284.3 959.1 335.1 197.3 478.2 427.6 188.5 438.1 691.4 1077.6 564.4 664.1 183.3 644.4 232 1030 743.1 555.6 418 732 750.6 1043.5 628 341.3 1021.9 406.8 236.1 963.4 372.8 261.7 339.8 826.8 231.7 1062.5 227 1022.5 328.2 953.5 543.8 842.2 390.6 742.7 295 604.9 516.3 170.2 1018.7 587.4 266.3 304.1 656.6 178.8 863.4 897.9 249.1 584 1511.7 403.6 337.3 324.1 643.1 160.3 398.7 992 370.2 522.4 617.5 424.5 168.1 848.4 524.8 378.7 352.5 482.9 497.5 478.7 215.1 545.2 310.1 626.7 225.4 191.7 1534.3 314.8 302 441.1 336.8 1463.2 371.7 1011.1 997.2 639.2 535.3 671.2 1156.9 956.9 815.6 858 229.6 694.8 449.1 400.8 1137.3 440.9 132.4 280.6 609.9 484.9 940.2 734.9 86.3 862.1 881.6 1233.9 515.8 920.7 988.6 186.7 589.9 726.1 343.7 350.4 191 402.6 1021.6 731.6 328.9 237.7 1152.9 753.7 571.8 139.1 294.8 180.6 269.6 783.6 157.7 593.2 1865.5 629.5 374.1 740.6 798.3 776.1 300 804.3 1346 425.9 911.7 319.3 731.6 321 581.4 610 438.4 477.6 652.1 437.2 1211.2 649.1 66.6 262.6 591.3 766.9 255.1 1045.6 346.2 508.4 1023.3 297.5 697.2 263.5 315.2 1038.9 166.3 664.5 1030.5 630.6 785.5 1232.1 817.2 823.9 638.2 1759.5 939.2 631.5 164.9 863.1 92.5 489.1 457.7 752.1 411.5 1058 265 616.7 326.1 570.5 751 819.1 317.7 587.9 971 409.7 666.4 802.7 893.8 83.6 668 611.8 1051 803.1 418.6 624.9 913.4 259.5 869 808.1 1792.9 1315.3 1675.2 446.8 161.8 500 1207.1 340 557.2 351.2 344.8 1985.6 904.2 345.8 607.2 1422.8 1094.8 999.5 444.6 563.9 944.1 291.5 1513 1543.1 208.5 678.6 456.8 560.2 211.2 1171.7 888.9 909.9 833.4 199.2 567 1774.3 720.5 898.7 317.3 629.4 624.4 627.5 401.7 569.3 1204.1 1763.6 1344.1 682.3 605.2 600.1 1756.8 279.6 1506.1 354.2 1548.7 268.9 645.2 444.1 1113.5 1004.1 900 552.7 320.5 407 906.4 364 181 476.9 198.2 425.9 108 710 367.8 479.7 285.6 630.5 172.5 477 698.8 604.7 583.2 582.9 357.3 322.2 826.4 538.6 679.1 741 331.5 322.7 444.3 810.6 448.6 407.2 253 1351.4 142.8 225 392.1 344.6 381.5 829.7 1208.9 937.9 421.3 710.6 1307.9 284.8 282.8 665.7 1363 222.2 564.4 582.4 527.6 687.3 316.7 879.7 354.6 654.3 237 433.9 277.5 978 355.2 589 184.2 348.5 520.1 562 761.5 532.3 521.1 762.5 650.9 504.6 611.6 522.7 715.1 353.9 680.7 359.9 399.2 369.7 1096.5 280 434.1 297 774.9 1021.1 486.9 340.8 713.7 255 834.5 779.6 546.1 493.8 122.4 947.9 315.9 377 272.4 444.2 386.2 498.1 662.1 561.6 720.4 1083.6 359.4 200.7 533.5 395.8 912.8 1072.5 79.3 792.2 1668.8 140.1 486.3 406.4 289.5 776.7 1927.8 542.2 1760.8 388.1 107.6 986.6 268.1 377.2 396.6 1263.2 562.7 357.4 700.1 271.6 637.3 427.7 570.9 322.3 571.4 443.7 540.7 830.4 1015.2 204.3 570.7 586.4 780.5 454.4 932.5 515.9 379.1 1243.1 642.6 1118 50 559.2 pi-Methylhistidine 65.2 64.4 66.3 68.7 59.1 73.6 67.9 75.5 3.6 12 13.6 15.6 61.2 62.7 61.7 59.1 55.3 52.8 54.7 10.2 63.9 58.2 61.1 15.2 49.2 63.8 65.2 58.5 66.4 15.9 65.9 51.4 66 59.5 9.4 65 60.1 65.8 60.3 10.7 53 12.9 60.9 54.7 10.9 61.5 55.7 51.6 26.2 19 90.7 26.2 5.2 45.9 41.1 7.6 45.5 86.4 27.9 33.9 11.7 17.9 30.1 47 6.5 56.6 33.8 16.4 9.6 10.3 16.3 34.6 10.8 19.4 84 41.3 36.4 5.2 19.7 10.8 6.5 45.6 43.5 57.5 15.5 5.3 49.1 14.5 11.1 28.8 6.5 8.6 13.7 26 14.4 25.3 81.2 48.9 136.8 6.5 7 4.7 7.1 12.5 10.3 6.4 14.6 17.8 35.9 9.5 10.5 6.7 43.5 11.3 12.2 17.1 9.7 10.4 8.5 69.8 67.5 29.5 14.1 19.8 25.7 16.7 12.8 8.3 15.3 20.8 6.7 17.3 6.7 50.4 38.8 15.7 34 13.2 3.2 19.5 9.5 16.8 12.2 87.1 14.5 11.1 6.2 16.8 27.1 16.8 10.2 7.4 46.3 74 10.4 4.3 50.2 63.3 9.2 9.3 6.6 42.3 10 66.8 17.6 36 92 33.3 17.3 68.6 15.7 12.9 78.4 214 15.7 10.1 11.9 41.9 13.5 8.2 106.5 10.4 55.2 7.1 6.1 80.5 13.3 206.5 136.9 8.5 13.6 6.1 4.3 9.8 20.6 30 65.9 46.9 4.7 61.3 142.8 11.5 12.9 5.8 38.2 4.7 7.6 16.7 6.9 90.4 5.6 20.7 0.8 67.5 34.3 5 73.7 20.4 56.3 44.9 22.3 4.8 12.3 9.3 20.2 29.6 6.6 12.6 7.9 33.3 33.5 26.5 97.6 38.4 4.3 18 12.2 8.5 13.6 1.5 7 24.5 7.3 49.9 257.9 7.5 28 69 8.1 8.2 34.3 6.1 41.2 23.9 34.2 18 14.6 54.3 15 149.5 8.7 25.3 76.7 36.4 82 12.4 59.4 1.7 35.9 11.5 24.1 28.1 11.6 21.4 10.5 8.4 9 158.5 36.8 8.3 7.2 35.8 9.1 136.8 7.1 7.5 12.5 5.2 31.9 16.4 9.2 5.8 37.9 18.8 34.3 36.5 9.9 11.3 24.3 13 5.9 28.1 15.4 82.8 7.5 45.7 12 21.9 6.7 32.8 5.4 183.7 40.5 107.4 4.4 13.5 20.7 163.1 8.1 9.7 23.6 21.2 45.1 4.3 9.4 7.2 10.9 6.7 55.5 266.6 23.7 13.7 16.3 37.4 23.9 79.1 13.3 63.6 60.7 63.3 36.8 22.6 37.4 71.6 39.5 13.2 8.8 23.9 13.3 40.6 4.2 90.7 18.1 81.6 7.9 12.6 240.7 18.7 19.9 11.7 5.1 11.8 15.7 3.4 40.9 7.3 7.9 4.5 21 6.2 37.8 3.6 50.5 13.1 19.4 44.8 4.9 11.4 11.6 57.9 9.4 35.9 12 10.4 16.1 3.5 2.7 42.5 8.9 10.1 13.4 3.7 64.5 13.4 13.6 5.6 6.3 32.3 151.3 42 7.4 26.4 43.2 17.4 27.2 2.7 25.3 23.3 35.1 8.6 17.6 52.7 80.8 72.9 14.7 5.5 9.8 6.5 48.7 49.7 15.1 13.3 35.7 14.8 7.5 38.1 47.8 23.4 26.8 4 9.1 19.4 10 3.2 15.9 14.1 3.9 54.7 6.3 16.8 14.9 10.6 43.4 4.9 11.2 22.1 6.4 22.7 87.9 17.9 4.4 11.7 88.1 9.6 9.7 4 13.3 3.1 40.4 9.8 7.2 6.9 7.6 9.3 4.5 11.3 72.8 6.6 12 10 8.7 12.6 63.8 2.8 78.5 8.5 18.8 24.8 18.3 65.9 87.7 238 8.6 146.8 5.7 8.6 21.8 26.2 118.8 13.6 36.7 13.7 19 25.1 60.2 11.3 12.8 92.5 19 10.7 8.1 18 16.2 17.1 8 31.6 6.4 4.8 99.7 40 17.8 14.4 8.6 6.9 44 6.3 14.9 NMR_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name CAS Registry HMDB Accession Number KEGG Compound ID PubChem Compound Acetate 64-19-7 HMDB00042 C00033 176 Alanine 56-41-7 HMDB00161 C00041 5950 Asparagine 70-47-3 HMDB00168 C00152 6267 Aspartate 56-84-8 HMDB00191 C00049 5960 Butyrate 107-92-6 HMDB00039 C00246 264 Cholate 81-25-4 HMDB00619 C00695 221493 Formate 64-18-6 HMDB00142 C00058 284 Fucose 2438-80-4 HMDB00174 C01019 17106 Fumarate 110-17-8 HMDB00134 C00122 723 Glucose 50-99-7 HMDB00122 C00031 5793 Glutamate 56-86-0 HMDB00148 C00025 33032 Glycerol 56-81-5 HMDB00131 C00116 753 Glycine 56-40-6 HMDB00123 C00037 750 Histidine 71-00-1 HMDB00177 C00135 6274 Inosine 58-63-9 HMDB00195 C00294 6021 Isobutyrate 79-31-2 HMDB01873 C02632 6590 Isoleucine 73-32-5 HMDB00172 C00407 6306 Lactate 79-33-4 HMDB00190 C00186 107689 Leucine 61-90-5 HMDB00687 C00123 6106 Lysine 56-87-1 HMDB00182 C00047 5962 Malonate 141-82-2 HMDB00691 C00383 867 Maltose 69-79-4 HMDB00163 C00208 439186 Methionine 63-68-3 HMDB00696 C00073 6137 Nicotinate 59-67-6 HMDB01488 C00253 938 Phenylalanine 63-91-2 HMDB00159 C00079 6140 Proline 147-85-3 HMDB00162 C00148 145742 Propionate 79-09-4 HMDB00237 C00163 1032 Propylene glycol 57-55-6 HMDB01881 C00583 1030 Succinate 110-15-6 HMDB00254 C00042 1110 Threonine 72-19-5 HMDB00167 C00188 6288 Tryptophan 73-22-3 HMDB00929 C00078 6305 Tyrosine 60-18-4 HMDB00158 C00082 6057 Uracil 66-22-8 HMDB00300 C00106 1174 Uridine 58-96-8 HMDB00296 C00299 6029 Valine 72-18-4 HMDB00883 C00183 6287 pi-Methylhistidine 368-16-1 HMDB00479 C01152 64969 METABOLITES_END NM:NMR_RESULTS_FILE 4a.Fecal_Metabolomics_Microbiome_Normalized_Binned_Data_Metabolomics_Workbench_Format.txt UNITS:ppm #END