#METABOLOMICS WORKBENCH kuppal2_20180712_123636 DATATRACK_ID:1441 STUDY_ID:ST001039 ANALYSIS_ID:AN001713 PROJECT_ID:PR000679 VERSION 1 CREATED_ON September 10, 2018, 10:36 am #PROJECT PR:PROJECT_TITLE Denver Asthma Panel Study-CHEAR Ancillary Study PR:PROJECT_TYPE NIH/NIEHS 1U2CES026560-01 PR:PROJECT_SUMMARY Urban environments remain a poorly understood toxic environment for children PR:PROJECT_SUMMARY with asthma, where improved exposure characterization and estimation of exposure PR:PROJECT_SUMMARY health outcome relationships are clearly needed. The goal of this project is to PR:PROJECT_SUMMARY investigate the interactions between relevant environmental exposures and asthma PR:PROJECT_SUMMARY severity in a year-long longitudinal study of urban children with asthma. PR:PROJECT_SUMMARY Environmental and clinical samples are being collected at 3 seasonal visits. PR:PROJECT_SUMMARY Using these samples, we will measure the effects of multiple relevant exposures PR:PROJECT_SUMMARY (environmental tobacco smoke (ETS), polycyclic aromatic hydrocarbons (PAHs), PR:PROJECT_SUMMARY phthalates, and volatile organic compounds (VOCs)) on biological responses PR:PROJECT_SUMMARY (metabolomics, oxidative stress, inflammatory markers, and endocannabinoids) and PR:PROJECT_SUMMARY asthma outcomes. Our overall hypothesis is that relevant environmental exposures PR:PROJECT_SUMMARY and their interactions drive disease severity in urban children with asthma. We PR:PROJECT_SUMMARY will test this hypothesis by investigating the following aims:" "Aim 1: To PR:PROJECT_SUMMARY investigate how environmental exposures (ETS, PAHs, phthalates, and VOCs) and PR:PROJECT_SUMMARY their interactions contribute to asthma severity in urban children." "Aim 2: PR:PROJECT_SUMMARY To determine if environmental exposures in children with asthma are associated PR:PROJECT_SUMMARY with changes in biological responses (metabolomics, oxidative stress, PR:PROJECT_SUMMARY inflammatory markers, and endocannabinoids)." Aim 3: To determine which PR:PROJECT_SUMMARY biological responses mediate the relationships between environmental exposures PR:PROJECT_SUMMARY and asthma severity. Aim 4: To compare environmental exposures and biological PR:PROJECT_SUMMARY responses in asthmatic and non-asthmatic children PR:INSTITUTE Emory University PR:DEPARTMENT School of Medicine PR:LABORATORY Clinical Biomarkers Laboratory PR:LAST_NAME Uppal PR:FIRST_NAME Karan PR:ADDRESS 615 Michael St. Ste 225, Atlanta, GA, 30322, USA PR:EMAIL kuppal2@emory.edu PR:PHONE (404) 727 5027 PR:FUNDING_SOURCE NIEHS ES026560 #STUDY ST:STUDY_TITLE Denver Asthma Panel Study-CHEAR Ancillary Study (part II) ST:STUDY_SUMMARY Urban environments remain a poorly understood toxic environment for children ST:STUDY_SUMMARY with asthma, where improved exposure characterization and estimation of ST:STUDY_SUMMARY exposurehealth outcome relationships are clearly needed. The goal of this ST:STUDY_SUMMARY project is to investigate the interactions between relevant environmental ST:STUDY_SUMMARY exposures and asthma severity in a year-long longitudinal study of urban ST:STUDY_SUMMARY children with asthma. Environmental and clinical samples are being collected at ST:STUDY_SUMMARY 3 seasonal visits. Using these samples, we will measure the effects of multiple ST:STUDY_SUMMARY relevant exposures (environmental tobacco smoke (ETS), polycyclic aromatic ST:STUDY_SUMMARY hydrocarbons (PAHs), phthalates, and volatile organic compounds (VOCs)) on ST:STUDY_SUMMARY biological responses (metabolomics, oxidative stress, inflammatory markers, and ST:STUDY_SUMMARY endocannabinoids) and asthma outcomes. Our overall hypothesis is that relevant ST:STUDY_SUMMARY environmental exposures and their interactions drive disease severity in urban ST:STUDY_SUMMARY children with asthma. We will test this hypothesis by investigating the ST:STUDY_SUMMARY following aims: Aim 1: To investigate how environmental exposures (ETS, PAHs, ST:STUDY_SUMMARY phthalates, and VOCs) and their interactions contribute to asthma severity in ST:STUDY_SUMMARY urban children. Aim 2: To determine if environmental exposures in children with ST:STUDY_SUMMARY asthma are associated with changes in in biological responses (metabolomics, ST:STUDY_SUMMARY oxidative stress, inflammatory markers, and endocannabinoids). Aim 3: To ST:STUDY_SUMMARY determine which biological responses mediate the relationships between ST:STUDY_SUMMARY environmental exposures and asthma severity. Aim 4: To compare environmental ST:STUDY_SUMMARY exposures and biological responses in asthmatic and non-asthmatic children ST:INSTITUTE Emory University ST:DEPARTMENT School of Medicine ST:LABORATORY Clincal Biomarkers Laboratory ST:LAST_NAME Uppal ST:FIRST_NAME Karan ST:ADDRESS 615 Michael St. Ste 225, Atlanta, GA, 30322, USA ST:EMAIL kuppal2@emory.edu ST:PHONE (404) 727 5027 ST:TOTAL_SUBJECTS 169 ST:STUDY_COMMENTS Both CHEAR pooled urine samples and Clinical Biomarker Laboratory pooled plasma ST:STUDY_COMMENTS samples were used #SUBJECT SU:SUBJECT_TYPE Urine samples SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:AGE_OR_AGE_RANGE Teens (12-17 yr) #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS Quality Control NIST SRM 1950_1a Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_001,VT_180426_M342_003,VT_180426_M342_005 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_1a_1 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_007,VT_180426_M342_009,VT_180426_M342_011 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1a_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_013,VT_180426_M342_015,VT_180426_M342_017 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1b_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_019,VT_180426_M342_021,VT_180426_M342_023 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G660-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_025,VT_180426_M342_027,VT_180426_M342_029 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYQ8-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_031,VT_180426_M342_033,VT_180426_M342_035 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAM9-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_037,VT_180426_M342_039,VT_180426_M342_041 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXK2-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_043,VT_180426_M342_045,VT_180426_M342_047 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAN6-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_049,VT_180426_M342_051,VT_180426_M342_053 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAS5-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_055,VT_180426_M342_057,VT_180426_M342_059 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5J7-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_061,VT_180426_M342_063,VT_180426_M342_065 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0C8-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_067,VT_180426_M342_069,VT_180426_M342_071 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G918-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_073,VT_180426_M342_075,VT_180426_M342_077 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3H4-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_079,VT_180426_M342_081,VT_180426_M342_083 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G082-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_085,VT_180426_M342_087,VT_180426_M342_089 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1K9-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_091,VT_180426_M342_093,VT_180426_M342_095 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYV7-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_097,VT_180426_M342_099,VT_180426_M342_101 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7X4-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_103,VT_180426_M342_105,VT_180426_M342_107 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7W7-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_109,VT_180426_M342_111,VT_180426_M342_113 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZE3-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_115,VT_180426_M342_117,VT_180426_M342_119 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXA4-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_121,VT_180426_M342_123,VT_180426_M342_125 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7V9-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_127,VT_180426_M342_129,VT_180426_M342_131 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2Q5-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_133,VT_180426_M342_135,VT_180426_M342_137 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2M4-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_139,VT_180426_M342_141,VT_180426_M342_143 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5U3-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_145,VT_180426_M342_147,VT_180426_M342_149 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1c_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_151,VT_180426_M342_153,VT_180426_M342_155 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1d_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_157,VT_180426_M342_159,VT_180426_M342_161 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY42-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_163,VT_180426_M342_165,VT_180426_M342_167 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1S1-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_169,VT_180426_M342_171,VT_180426_M342_173 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5X6-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_175,VT_180426_M342_177,VT_180426_M342_179 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G520-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_181,VT_180426_M342_183,VT_180426_M342_185 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3X8-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_187,VT_180426_M342_189,VT_180426_M342_191 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G546-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_193,VT_180426_M342_195,VT_180426_M342_197 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2A0-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_199,VT_180426_M342_201,VT_180426_M342_203 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY42-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_205,VT_180426_M342_207,VT_180426_M342_209 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1T9-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_211,VT_180426_M342_213,VT_180426_M342_215 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G8D7-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_217,VT_180426_M342_219,VT_180426_M342_221 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G272-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_223,VT_180426_M342_225,VT_180426_M342_227 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0U8-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_229,VT_180426_M342_231,VT_180426_M342_233 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYQ8-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_235,VT_180426_M342_237,VT_180426_M342_239 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0J2-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_241,VT_180426_M342_243,VT_180426_M342_245 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1Q6-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_247,VT_180426_M342_249,VT_180426_M342_251 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GBD7-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_253,VT_180426_M342_255,VT_180426_M342_257 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G8R7-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_259,VT_180426_M342_261,VT_180426_M342_263 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXK2-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_265,VT_180426_M342_267,VT_180426_M342_269 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4L4-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_271,VT_180426_M342_273,VT_180426_M342_275 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9F2-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_277,VT_180426_M342_279,VT_180426_M342_281 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G587-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_283,VT_180426_M342_285,VT_180426_M342_287 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1e_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_289,VT_180426_M342_291,VT_180426_M342_293 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1f_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_295,VT_180426_M342_297,VT_180426_M342_299 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_1b_1 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_301,VT_180426_M342_303,VT_180426_M342_305 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_2a_1 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_001,VT_180427_M342_003,VT_180427_M342_005 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2a_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_007,VT_180427_M342_009,VT_180427_M342_011 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2b_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_013,VT_180427_M342_015,VT_180427_M342_017 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4L4-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_019,VT_180427_M342_021,VT_180427_M342_023 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2Q5-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_025,VT_180427_M342_027,VT_180427_M342_029 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYL9-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_031,VT_180427_M342_033,VT_180427_M342_035 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ33-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_037,VT_180427_M342_039,VT_180427_M342_041 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3F8-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_043,VT_180427_M342_045,VT_180427_M342_047 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0U8-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_049,VT_180427_M342_051,VT_180427_M342_053 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY18-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_055,VT_180427_M342_057,VT_180427_M342_059 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0T0-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_061,VT_180427_M342_063,VT_180427_M342_065 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXP1-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_067,VT_180427_M342_069,VT_180427_M342_071 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GA77-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_073,VT_180427_M342_075,VT_180427_M342_077 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZN3-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_079,VT_180427_M342_081,VT_180427_M342_083 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2V4-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_085,VT_180427_M342_087,VT_180427_M342_089 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G314-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_091,VT_180427_M342_093,VT_180427_M342_095 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5Y4-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_097,VT_180427_M342_099,VT_180427_M342_101 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7Y2-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_103,VT_180427_M342_105,VT_180427_M342_107 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAY2-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_109,VT_180427_M342_111,VT_180427_M342_113 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GB50-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_115,VT_180427_M342_117,VT_180427_M342_119 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAL1-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_121,VT_180427_M342_123,VT_180427_M342_125 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9T1-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_127,VT_180427_M342_129,VT_180427_M342_131 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4D1-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_133,VT_180427_M342_135,VT_180427_M342_137 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2Q5-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_139,VT_180427_M342_141,VT_180427_M342_143 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2c_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_145,VT_180427_M342_147,VT_180427_M342_149 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2d_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_151,VT_180427_M342_153,VT_180427_M342_155 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GB27-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_157,VT_180427_M342_159,VT_180427_M342_161 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G660-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_163,VT_180427_M342_165,VT_180427_M342_167 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3U5-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_169,VT_180427_M342_171,VT_180427_M342_173 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G8D7-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_175,VT_180427_M342_177,VT_180427_M342_179 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2L6-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_181,VT_180427_M342_183,VT_180427_M342_185 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G389-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_187,VT_180427_M342_189,VT_180427_M342_191 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G8G1-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_193,VT_180427_M342_195,VT_180427_M342_197 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5M1-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_199,VT_180427_M342_201,VT_180427_M342_203 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4U4-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_205,VT_180427_M342_207,VT_180427_M342_209 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4L4-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_211,VT_180427_M342_213,VT_180427_M342_215 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G520-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_217,VT_180427_M342_219,VT_180427_M342_221 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1M5-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_223,VT_180427_M342_225,VT_180427_M342_227 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GB43-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_229,VT_180427_M342_231,VT_180427_M342_233 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2A0-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_235,VT_180427_M342_237,VT_180427_M342_239 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY26-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_241,VT_180427_M342_243,VT_180427_M342_245 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4Y5-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_247,VT_180427_M342_249,VT_180427_M342_251 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5C3-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_253,VT_180427_M342_255,VT_180427_M342_257 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZH7-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_259,VT_180427_M342_261,VT_180427_M342_263 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FWY2-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_265,VT_180427_M342_267,VT_180427_M342_269 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1L7-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_271,VT_180427_M342_273,VT_180427_M342_275 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G603-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_277,VT_180427_M342_279,VT_180427_M342_281 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G322-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_283,VT_180427_M342_285,VT_180427_M342_287 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2e_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_289,VT_180427_M342_291,VT_180427_M342_293 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2f_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_295,VT_180427_M342_297,VT_180427_M342_299 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_2b_1 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_301,VT_180427_M342_303,VT_180427_M342_305 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_3a_1 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_001,VT_180429_M342_003,VT_180429_M342_005 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3a_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_007,VT_180429_M342_009,VT_180429_M342_011 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3b_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_013,VT_180429_M342_015,VT_180429_M342_017 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2K8-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_019,VT_180429_M342_021,VT_180429_M342_023 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5W9-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_025,VT_180429_M342_027,VT_180429_M342_029 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G546-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_031,VT_180429_M342_033,VT_180429_M342_035 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1U7-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_037,VT_180429_M342_039,VT_180429_M342_041 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G264-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_043,VT_180429_M342_045,VT_180429_M342_047 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4S8-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_049,VT_180429_M342_051,VT_180429_M342_053 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5N8-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_055,VT_180429_M342_057,VT_180429_M342_059 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ58-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_061,VT_180429_M342_063,VT_180429_M342_065 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5H2-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_067,VT_180429_M342_069,VT_180429_M342_071 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G736-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_073,VT_180429_M342_075,VT_180429_M342_077 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G439-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_079,VT_180429_M342_081,VT_180429_M342_083 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G983-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_085,VT_180429_M342_087,VT_180429_M342_089 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G6D9-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_091,VT_180429_M342_093,VT_180429_M342_095 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FX35-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_097,VT_180429_M342_099,VT_180429_M342_101 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXK2-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_103,VT_180429_M342_105,VT_180429_M342_107 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYE4-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_109,VT_180429_M342_111,VT_180429_M342_113 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAS5-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_115,VT_180429_M342_117,VT_180429_M342_119 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3G6-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_121,VT_180429_M342_123,VT_180429_M342_125 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0F1-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_127,VT_180429_M342_129,VT_180429_M342_131 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9D6-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_133,VT_180429_M342_135,VT_180429_M342_137 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3c_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_139,VT_180429_M342_141,VT_180429_M342_143 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3d_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_145,VT_180429_M342_147,VT_180429_M342_149 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G611-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_151,VT_180429_M342_153,VT_180429_M342_155 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1D4-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_157,VT_180429_M342_159,VT_180429_M342_161 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GBD7-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_163,VT_180429_M342_165,VT_180429_M342_167 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ17-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_169,VT_180429_M342_171,VT_180429_M342_173 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0W4-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_175,VT_180429_M342_177,VT_180429_M342_179 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G645-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_181,VT_180429_M342_183,VT_180429_M342_185 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G892-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_187,VT_180429_M342_189,VT_180429_M342_191 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G6N7-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_193,VT_180429_M342_195,VT_180429_M342_197 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FX19-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_199,VT_180429_M342_201,VT_180429_M342_203 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1F0-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_205,VT_180429_M342_207,VT_180429_M342_209 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GA77-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_211,VT_180429_M342_213,VT_180429_M342_215 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ66-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_217,VT_180429_M342_219,VT_180429_M342_221 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G025-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_223,VT_180429_M342_225,VT_180429_M342_227 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYB1-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_229,VT_180429_M342_231,VT_180429_M342_233 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GB27-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_235,VT_180429_M342_237,VT_180429_M342_239 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYQ8-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_241,VT_180429_M342_243,VT_180429_M342_245 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAH0-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_247,VT_180429_M342_249,VT_180429_M342_251 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZG9-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_253,VT_180429_M342_255,VT_180429_M342_257 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1V5-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_259,VT_180429_M342_261,VT_180429_M342_263 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G231-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_265,VT_180429_M342_267,VT_180429_M342_269 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3e_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_271,VT_180429_M342_273,VT_180429_M342_275 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3f_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_277,VT_180429_M342_279,VT_180429_M342_281 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_3b_1 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_283,VT_180429_M342_285,VT_180429_M342_287 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_4a_1 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_001,VT_180501_M342_003,VT_180501_M342_005 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4a_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_007,VT_180501_M342_009,VT_180501_M342_011 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4b_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_013,VT_180501_M342_015,VT_180501_M342_017 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1S1-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_019,VT_180501_M342_021,VT_180501_M342_023 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G892-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_025,VT_180501_M342_027,VT_180501_M342_029 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2E1-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_031,VT_180501_M342_033,VT_180501_M342_035 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3G6-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_037,VT_180501_M342_039,VT_180501_M342_041 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5Y4-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_043,VT_180501_M342_045,VT_180501_M342_047 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY18-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_049,VT_180501_M342_051,VT_180501_M342_053 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9G0-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_055,VT_180501_M342_057,VT_180501_M342_059 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7W7-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_061,VT_180501_M342_063,VT_180501_M342_065 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0P9-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_067,VT_180501_M342_069,VT_180501_M342_071 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G314-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_073,VT_180501_M342_075,VT_180501_M342_077 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1V5-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_079,VT_180501_M342_081,VT_180501_M342_083 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXP1-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_085,VT_180501_M342_087,VT_180501_M342_089 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZE3-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_091,VT_180501_M342_093,VT_180501_M342_095 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4K6-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_097,VT_180501_M342_099,VT_180501_M342_101 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYM7-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_103,VT_180501_M342_105,VT_180501_M342_107 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5H2-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_109,VT_180501_M342_111,VT_180501_M342_113 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4D1-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_115,VT_180501_M342_117,VT_180501_M342_119 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G827-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_121,VT_180501_M342_123,VT_180501_M342_125 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4H3-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_127,VT_180501_M342_129,VT_180501_M342_131 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYL9-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_133,VT_180501_M342_135,VT_180501_M342_137 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G777-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_139,VT_180501_M342_141,VT_180501_M342_143 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G322-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_145,VT_180501_M342_147,VT_180501_M342_149 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4c_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_151,VT_180501_M342_153,VT_180501_M342_155 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4d_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_157,VT_180501_M342_159,VT_180501_M342_161 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G6C2-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_163,VT_180501_M342_165,VT_180501_M342_167 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9Y0-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_169,VT_180501_M342_171,VT_180501_M342_173 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G611-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_175,VT_180501_M342_177,VT_180501_M342_179 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4Y5-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_181,VT_180501_M342_183,VT_180501_M342_185 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYV7-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_187,VT_180501_M342_189,VT_180501_M342_191 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY42-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_193,VT_180501_M342_195,VT_180501_M342_197 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9Q8-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_199,VT_180501_M342_201,VT_180501_M342_203 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4B6-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_205,VT_180501_M342_207,VT_180501_M342_209 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0L8-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_211,VT_180501_M342_213,VT_180501_M342_215 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GA69-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_217,VT_180501_M342_219,VT_180501_M342_221 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2X9-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_223,VT_180501_M342_225,VT_180501_M342_227 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5H2-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_229,VT_180501_M342_231,VT_180501_M342_233 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3M3-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_235,VT_180501_M342_237,VT_180501_M342_239 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G769-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_241,VT_180501_M342_243,VT_180501_M342_245 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ58-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_247,VT_180501_M342_249,VT_180501_M342_251 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2F9-U-00_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_253,VT_180501_M342_255,VT_180501_M342_257 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G835-U-04_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_259,VT_180501_M342_261,VT_180501_M342_263 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9B1-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_265,VT_180501_M342_267,VT_180501_M342_269 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G645-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_271,VT_180501_M342_273,VT_180501_M342_275 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYQ8-U-01_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_277,VT_180501_M342_279,VT_180501_M342_281 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GA02-U-02_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_283,VT_180501_M342_285,VT_180501_M342_287 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZF1-U-03_1 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_289,VT_180501_M342_291,VT_180501_M342_293 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4f_1 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_301,VT_180501_M342_303,VT_180501_M342_305 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_4b_1 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_307,VT_180501_M342_309,VT_180501_M342_311 SUBJECT_SAMPLE_FACTORS Quality Control NIST SRM 1950_1b Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_313,VT_180501_M342_315,VT_180501_M342_317 SUBJECT_SAMPLE_FACTORS Quality Control NIST SRM 1950_2a Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_002,VT_180426_M342_004,VT_180426_M342_006 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_1a_2 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_008,VT_180426_M342_010,VT_180426_M342_012 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1a_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_014,VT_180426_M342_016,VT_180426_M342_018 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1b_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_020,VT_180426_M342_022,VT_180426_M342_024 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G660-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_026,VT_180426_M342_028,VT_180426_M342_030 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYQ8-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_032,VT_180426_M342_034,VT_180426_M342_036 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAM9-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_038,VT_180426_M342_040,VT_180426_M342_042 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXK2-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_044,VT_180426_M342_046,VT_180426_M342_048 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAN6-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_050,VT_180426_M342_052,VT_180426_M342_054 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAS5-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_056,VT_180426_M342_058,VT_180426_M342_060 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5J7-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_062,VT_180426_M342_064,VT_180426_M342_066 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0C8-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_068,VT_180426_M342_070,VT_180426_M342_072 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G918-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_074,VT_180426_M342_076,VT_180426_M342_078 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3H4-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_080,VT_180426_M342_082,VT_180426_M342_084 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G082-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_086,VT_180426_M342_088,VT_180426_M342_090 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1K9-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_092,VT_180426_M342_094,VT_180426_M342_096 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYV7-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_098,VT_180426_M342_100,VT_180426_M342_102 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7X4-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_104,VT_180426_M342_106,VT_180426_M342_108 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7W7-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_110,VT_180426_M342_112,VT_180426_M342_114 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZE3-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_116,VT_180426_M342_118,VT_180426_M342_120 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXA4-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_122,VT_180426_M342_124,VT_180426_M342_126 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7V9-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_128,VT_180426_M342_130,VT_180426_M342_132 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2Q5-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_134,VT_180426_M342_136,VT_180426_M342_138 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2M4-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_140,VT_180426_M342_142,VT_180426_M342_144 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5U3-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_146,VT_180426_M342_148,VT_180426_M342_150 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1c_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_152,VT_180426_M342_154,VT_180426_M342_156 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1d_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_158,VT_180426_M342_160,VT_180426_M342_162 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY42-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_164,VT_180426_M342_166,VT_180426_M342_168 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1S1-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_170,VT_180426_M342_172,VT_180426_M342_174 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5X6-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_176,VT_180426_M342_178,VT_180426_M342_180 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G520-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_182,VT_180426_M342_184,VT_180426_M342_186 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3X8-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_188,VT_180426_M342_190,VT_180426_M342_192 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G546-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_194,VT_180426_M342_196,VT_180426_M342_198 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2A0-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_200,VT_180426_M342_202,VT_180426_M342_204 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY42-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_206,VT_180426_M342_208,VT_180426_M342_210 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1T9-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_212,VT_180426_M342_214,VT_180426_M342_216 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G8D7-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_218,VT_180426_M342_220,VT_180426_M342_222 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G272-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_224,VT_180426_M342_226,VT_180426_M342_228 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0U8-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_230,VT_180426_M342_232,VT_180426_M342_234 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYQ8-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_236,VT_180426_M342_238,VT_180426_M342_240 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0J2-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_242,VT_180426_M342_244,VT_180426_M342_246 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1Q6-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_248,VT_180426_M342_250,VT_180426_M342_252 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GBD7-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_254,VT_180426_M342_256,VT_180426_M342_258 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G8R7-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_260,VT_180426_M342_262,VT_180426_M342_264 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXK2-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_266,VT_180426_M342_268,VT_180426_M342_270 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4L4-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_272,VT_180426_M342_274,VT_180426_M342_276 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9F2-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_278,VT_180426_M342_280,VT_180426_M342_282 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G587-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_284,VT_180426_M342_286,VT_180426_M342_288 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1e_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_290,VT_180426_M342_292,VT_180426_M342_294 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_1f_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_296,VT_180426_M342_298,VT_180426_M342_300 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_1b_2 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180426; Batch=1; CHEAR_Project_ID=2016-1450; Raw files=VT_180426_M342_302,VT_180426_M342_304,VT_180426_M342_306 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_2a_2 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_002,VT_180427_M342_004,VT_180427_M342_006 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2a_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_008,VT_180427_M342_010,VT_180427_M342_012 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2b_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_014,VT_180427_M342_016,VT_180427_M342_018 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4L4-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_020,VT_180427_M342_022,VT_180427_M342_024 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2Q5-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_026,VT_180427_M342_028,VT_180427_M342_030 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYL9-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_032,VT_180427_M342_034,VT_180427_M342_036 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ33-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_038,VT_180427_M342_040,VT_180427_M342_042 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3F8-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_044,VT_180427_M342_046,VT_180427_M342_048 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0U8-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_050,VT_180427_M342_052,VT_180427_M342_054 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY18-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_056,VT_180427_M342_058,VT_180427_M342_060 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0T0-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_062,VT_180427_M342_064,VT_180427_M342_066 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXP1-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_068,VT_180427_M342_070,VT_180427_M342_072 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GA77-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_074,VT_180427_M342_076,VT_180427_M342_078 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZN3-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_080,VT_180427_M342_082,VT_180427_M342_084 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2V4-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_086,VT_180427_M342_088,VT_180427_M342_090 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G314-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_092,VT_180427_M342_094,VT_180427_M342_096 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5Y4-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_098,VT_180427_M342_100,VT_180427_M342_102 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7Y2-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_104,VT_180427_M342_106,VT_180427_M342_108 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAY2-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_110,VT_180427_M342_112,VT_180427_M342_114 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GB50-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_116,VT_180427_M342_118,VT_180427_M342_120 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAL1-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_122,VT_180427_M342_124,VT_180427_M342_126 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9T1-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_128,VT_180427_M342_130,VT_180427_M342_132 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4D1-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_134,VT_180427_M342_136,VT_180427_M342_138 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2Q5-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_140,VT_180427_M342_142,VT_180427_M342_144 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2c_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_146,VT_180427_M342_148,VT_180427_M342_150 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2d_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_152,VT_180427_M342_154,VT_180427_M342_156 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GB27-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_158,VT_180427_M342_160,VT_180427_M342_162 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G660-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_164,VT_180427_M342_166,VT_180427_M342_168 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3U5-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_170,VT_180427_M342_172,VT_180427_M342_174 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G8D7-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_176,VT_180427_M342_178,VT_180427_M342_180 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2L6-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_182,VT_180427_M342_184,VT_180427_M342_186 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G389-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_188,VT_180427_M342_190,VT_180427_M342_192 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G8G1-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_194,VT_180427_M342_196,VT_180427_M342_198 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5M1-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_200,VT_180427_M342_202,VT_180427_M342_204 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4U4-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_206,VT_180427_M342_208,VT_180427_M342_210 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4L4-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_212,VT_180427_M342_214,VT_180427_M342_216 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G520-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_218,VT_180427_M342_220,VT_180427_M342_222 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1M5-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_224,VT_180427_M342_226,VT_180427_M342_228 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GB43-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_230,VT_180427_M342_232,VT_180427_M342_234 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2A0-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_236,VT_180427_M342_238,VT_180427_M342_240 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY26-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_242,VT_180427_M342_244,VT_180427_M342_246 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4Y5-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_248,VT_180427_M342_250,VT_180427_M342_252 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5C3-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_254,VT_180427_M342_256,VT_180427_M342_258 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZH7-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_260,VT_180427_M342_262,VT_180427_M342_264 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FWY2-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_266,VT_180427_M342_268,VT_180427_M342_270 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1L7-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_272,VT_180427_M342_274,VT_180427_M342_276 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G603-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_278,VT_180427_M342_280,VT_180427_M342_282 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G322-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_284,VT_180427_M342_286,VT_180427_M342_288 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2e_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_290,VT_180427_M342_292,VT_180427_M342_294 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_2f_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_296,VT_180427_M342_298,VT_180427_M342_300 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_2b_2 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180427; Batch=2; CHEAR_Project_ID=2016-1450; Raw files=VT_180427_M342_302,VT_180427_M342_304,VT_180427_M342_306 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_3a_2 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_002,VT_180429_M342_004,VT_180429_M342_006 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3a_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_008,VT_180429_M342_010,VT_180429_M342_012 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3b_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_014,VT_180429_M342_016,VT_180429_M342_018 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2K8-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_020,VT_180429_M342_022,VT_180429_M342_024 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5W9-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_026,VT_180429_M342_028,VT_180429_M342_030 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G546-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_032,VT_180429_M342_034,VT_180429_M342_036 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1U7-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_038,VT_180429_M342_040,VT_180429_M342_042 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G264-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_044,VT_180429_M342_046,VT_180429_M342_048 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4S8-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_050,VT_180429_M342_052,VT_180429_M342_054 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5N8-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_056,VT_180429_M342_058,VT_180429_M342_060 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ58-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_062,VT_180429_M342_064,VT_180429_M342_066 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5H2-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_068,VT_180429_M342_070,VT_180429_M342_072 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G736-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_074,VT_180429_M342_076,VT_180429_M342_078 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G439-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_080,VT_180429_M342_082,VT_180429_M342_084 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G983-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_086,VT_180429_M342_088,VT_180429_M342_090 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G6D9-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_092,VT_180429_M342_094,VT_180429_M342_096 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FX35-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_098,VT_180429_M342_100,VT_180429_M342_102 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXK2-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_104,VT_180429_M342_106,VT_180429_M342_108 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYE4-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_110,VT_180429_M342_112,VT_180429_M342_114 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAS5-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_116,VT_180429_M342_118,VT_180429_M342_120 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3G6-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_122,VT_180429_M342_124,VT_180429_M342_126 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0F1-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_128,VT_180429_M342_130,VT_180429_M342_132 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9D6-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_134,VT_180429_M342_136,VT_180429_M342_138 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3c_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_140,VT_180429_M342_142,VT_180429_M342_144 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3d_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_146,VT_180429_M342_148,VT_180429_M342_150 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G611-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_152,VT_180429_M342_154,VT_180429_M342_156 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1D4-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_158,VT_180429_M342_160,VT_180429_M342_162 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GBD7-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_164,VT_180429_M342_166,VT_180429_M342_168 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ17-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_170,VT_180429_M342_172,VT_180429_M342_174 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0W4-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_176,VT_180429_M342_178,VT_180429_M342_180 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G645-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_182,VT_180429_M342_184,VT_180429_M342_186 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G892-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_188,VT_180429_M342_190,VT_180429_M342_192 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G6N7-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_194,VT_180429_M342_196,VT_180429_M342_198 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FX19-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_200,VT_180429_M342_202,VT_180429_M342_204 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1F0-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_206,VT_180429_M342_208,VT_180429_M342_210 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GA77-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_212,VT_180429_M342_214,VT_180429_M342_216 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ66-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_218,VT_180429_M342_220,VT_180429_M342_222 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G025-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_224,VT_180429_M342_226,VT_180429_M342_228 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYB1-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_230,VT_180429_M342_232,VT_180429_M342_234 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GB27-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_236,VT_180429_M342_238,VT_180429_M342_240 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYQ8-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_242,VT_180429_M342_244,VT_180429_M342_246 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GAH0-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_248,VT_180429_M342_250,VT_180429_M342_252 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZG9-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_254,VT_180429_M342_256,VT_180429_M342_258 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1V5-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_260,VT_180429_M342_262,VT_180429_M342_264 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G231-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_266,VT_180429_M342_268,VT_180429_M342_270 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3e_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_272,VT_180429_M342_274,VT_180429_M342_276 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_3f_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_278,VT_180429_M342_280,VT_180429_M342_282 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_3b_2 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180429; Batch=3; CHEAR_Project_ID=2016-1450; Raw files=VT_180429_M342_284,VT_180429_M342_286,VT_180429_M342_288 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_4a_2 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_002,VT_180501_M342_004,VT_180501_M342_006 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4a_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_008,VT_180501_M342_010,VT_180501_M342_012 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4b_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_014,VT_180501_M342_016,VT_180501_M342_018 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1S1-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_020,VT_180501_M342_022,VT_180501_M342_024 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G892-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_026,VT_180501_M342_028,VT_180501_M342_030 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2E1-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_032,VT_180501_M342_034,VT_180501_M342_036 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3G6-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_038,VT_180501_M342_040,VT_180501_M342_042 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5Y4-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_044,VT_180501_M342_046,VT_180501_M342_048 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY18-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_050,VT_180501_M342_052,VT_180501_M342_054 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9G0-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_056,VT_180501_M342_058,VT_180501_M342_060 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G7W7-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_062,VT_180501_M342_064,VT_180501_M342_066 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0P9-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_068,VT_180501_M342_070,VT_180501_M342_072 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G314-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_074,VT_180501_M342_076,VT_180501_M342_078 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G1V5-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_080,VT_180501_M342_082,VT_180501_M342_084 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FXP1-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_086,VT_180501_M342_088,VT_180501_M342_090 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZE3-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_092,VT_180501_M342_094,VT_180501_M342_096 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4K6-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_098,VT_180501_M342_100,VT_180501_M342_102 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYM7-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_104,VT_180501_M342_106,VT_180501_M342_108 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5H2-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_110,VT_180501_M342_112,VT_180501_M342_114 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4D1-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_116,VT_180501_M342_118,VT_180501_M342_120 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G827-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_122,VT_180501_M342_124,VT_180501_M342_126 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4H3-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_128,VT_180501_M342_130,VT_180501_M342_132 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYL9-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_134,VT_180501_M342_136,VT_180501_M342_138 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G777-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_140,VT_180501_M342_142,VT_180501_M342_144 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G322-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_146,VT_180501_M342_148,VT_180501_M342_150 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4c_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_152,VT_180501_M342_154,VT_180501_M342_156 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4d_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_158,VT_180501_M342_160,VT_180501_M342_162 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G6C2-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_164,VT_180501_M342_166,VT_180501_M342_168 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9Y0-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_170,VT_180501_M342_172,VT_180501_M342_174 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G611-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_176,VT_180501_M342_178,VT_180501_M342_180 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4Y5-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_182,VT_180501_M342_184,VT_180501_M342_186 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYV7-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_188,VT_180501_M342_190,VT_180501_M342_192 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FY42-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_194,VT_180501_M342_196,VT_180501_M342_198 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9Q8-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_200,VT_180501_M342_202,VT_180501_M342_204 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G4B6-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_206,VT_180501_M342_208,VT_180501_M342_210 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G0L8-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_212,VT_180501_M342_214,VT_180501_M342_216 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GA69-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_218,VT_180501_M342_220,VT_180501_M342_222 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2X9-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_224,VT_180501_M342_226,VT_180501_M342_228 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G5H2-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_230,VT_180501_M342_232,VT_180501_M342_234 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G3M3-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_236,VT_180501_M342_238,VT_180501_M342_240 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G769-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_242,VT_180501_M342_244,VT_180501_M342_246 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZ58-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_248,VT_180501_M342_250,VT_180501_M342_252 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G2F9-U-00_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_254,VT_180501_M342_256,VT_180501_M342_258 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G835-U-04_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_260,VT_180501_M342_262,VT_180501_M342_264 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G9B1-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_266,VT_180501_M342_268,VT_180501_M342_270 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1G645-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_272,VT_180501_M342_274,VT_180501_M342_276 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FYQ8-U-01_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_278,VT_180501_M342_280,VT_180501_M342_282 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1GA02-U-02_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_284,VT_180501_M342_286,VT_180501_M342_288 SUBJECT_SAMPLE_FACTORS Urine Study Sample C-1FZF1-U-03_2 Sample.Matrix:Urine HRM_Sample_Type=Study; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_290,VT_180501_M342_292,VT_180501_M342_294 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4e_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_296,VT_180501_M342_298,VT_180501_M342_300 SUBJECT_SAMPLE_FACTORS Quality Control chearurine_4f_2 Sample.Matrix:Urine HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_302,VT_180501_M342_304,VT_180501_M342_306 SUBJECT_SAMPLE_FACTORS Quality Control Q-Std Plasma pool_4b_2 Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_308,VT_180501_M342_310,VT_180501_M342_312 SUBJECT_SAMPLE_FACTORS Quality Control NIST SRM 1950_2b Sample.Matrix:Plasma HRM_Sample_Type=Quality Control; Date Analyzed=180501; Batch=4; CHEAR_Project_ID=2016-1450; Raw files=VT_180501_M342_314,VT_180501_M342_316,VT_180501_M342_318 #COLLECTION CO:COLLECTION_SUMMARY Urine samples were collected by random catch methods and transferred to 1.8 ml CO:COLLECTION_SUMMARY freezer tubes and stored in a -70 degree C freezer. The samples were shipped on CO:COLLECTION_SUMMARY dry ice to the metabolomics analysis lab at Emory University. CO:SAMPLE_TYPE Urine CO:STORAGE_CONDITIONS Described in summary #TREATMENT TR:TREATMENT_SUMMARY Samples were received frozen in aliquouts of <250uL. Prior to analysis, samples TR:TREATMENT_SUMMARY were thawed and prepared for HRM analysis using the standard protocols described TR:TREATMENT_SUMMARY in the Sample Preparation section. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Samples were prepared for metabolomics analysis using established SP:SAMPLEPREP_SUMMARY methods(Johnson et al. (2010). Analyst; Go et al. (2015). Tox Sci). Prior to SP:SAMPLEPREP_SUMMARY analysis, plasma aliquots were removed from storage at -80 degrees C and thawed SP:SAMPLEPREP_SUMMARY on ice. Each cryotube was then vortexed briefly to ensure homogeneity, and 50 SP:SAMPLEPREP_SUMMARY microliters was transferred to a clean microfuge tube. Immediately after, the SP:SAMPLEPREP_SUMMARY plasma was treated with 100 microliters of ice-cold LC-MS grade acetonitrile SP:SAMPLEPREP_SUMMARY (Sigma Aldrich) containing 2.5 microliters of internal standard solution with SP:SAMPLEPREP_SUMMARY eight stable isotopic chemicals selected to cover a range of chemical SP:SAMPLEPREP_SUMMARY properties. Following addition of acetonitrile, urine was equilibrated for 30 SP:SAMPLEPREP_SUMMARY min on ice, upon which precipitated proteins were removed by centrifuge (14,000 SP:SAMPLEPREP_SUMMARY rpm at 4 degrees C for 10 min). The resulting supernatant (100 microliters) was SP:SAMPLEPREP_SUMMARY removed, added to a low volume autosampler vial and maintained at 4 degrees C SP:SAMPLEPREP_SUMMARY until analysis (<22 h). SP:SAMPLEPREP_PROTOCOL_ID HRM_SP_082016_01 SP:SAMPLEPREP_PROTOCOL_FILENAME EmoryUniversity_HRM_SP_082016_01.pdf SP:SAMPLEPREP_PROTOCOL_COMMENTS Date effective: 30 July 2016 SP:EXTRACTION_METHOD 2:1 acetonitrile: sample followed by vortexing and centrifugation #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY The C18 column is operated parallel to the HILIC column for simultaneous CH:CHROMATOGRAPHY_SUMMARY analytical separation and column flushing through the use of a dual head HPLC CH:CHROMATOGRAPHY_SUMMARY pump equipped with 10-port and 6- port switching valves. During operation of the CH:CHROMATOGRAPHY_SUMMARY C18 method, the MS is operated in negative ion mode and 10 μL of sample is CH:CHROMATOGRAPHY_SUMMARY injected onto the C18 column while the HILIC column is flushing with wash CH:CHROMATOGRAPHY_SUMMARY solution. Flow rate is maintained at 0.4 mL/min until 1.5 min, increased to 0.5 CH:CHROMATOGRAPHY_SUMMARY mL/min at 2 min and held for 3 min. Solvent A is 100% LC-MS grade water, solvent CH:CHROMATOGRAPHY_SUMMARY B is 100% LC-MS grade acetonitrile and solvent C is 10mM ammonium acetate in CH:CHROMATOGRAPHY_SUMMARY LC-MS grade water. Initial mobile phase conditions are 60% A, 35% B, 5% C hold CH:CHROMATOGRAPHY_SUMMARY for 0.5 min, with linear gradient to 0% A, 95% B, 5% C at 1.5 min, hold for 3.5 CH:CHROMATOGRAPHY_SUMMARY min, resulting in a total analytical run time of 5 min. During the flushing CH:CHROMATOGRAPHY_SUMMARY phase (HILIC analytical separation), the C18 column is equilibrated with a wash CH:CHROMATOGRAPHY_SUMMARY solution of 0% A, 95% B, 5% C until 2.5 min, followed by an equilibration CH:CHROMATOGRAPHY_SUMMARY solution of 60% A, 35% B, 5% C for 2.5 min. CH:CHROMATOGRAPHY_TYPE Reversed phase MS:INSTRUMENT_NAME Thermo Q Exactive HF hybrid Orbitrap CH:COLUMN_NAME Thermo Higgins C18 (50 x 2.1mm, 3um) CH:COLUMN_NAME Product #TS-0521-C183; Thermo Accucore C18 guard column with holder, Product CH:COLUMN_NAME #17126-014005 CH:FLOW_GRADIENT A= water, B= acetontrile, C= 10mM ammonium acetate in water; 60% A, 35% B, 5% C CH:FLOW_GRADIENT hold for 0.5 min, linear gradient to 0% A, 95% B, 5% C at 1.5 min, hold for 3 CH:FLOW_GRADIENT min CH:FLOW_RATE 0.4 mL/min for 1.5 min; linear increase to 0.5 mL/min at 2 min held for 3 min CH:COLUMN_TEMPERATURE 60C CH:METHODS_FILENAME 20160920_negC18120kres5min_ESI_HILICposwash.meth CH:SOLVENT_A LC-MS grade water CH:SOLVENT_B LC-MS grade acetonitrile CH:METHODS_ID 10mM ammonium acetate in LC-MS grade water CH:SAMPLE_INJECTION 10 uL CH:ANALYTICAL_TIME 5 min CH:SAMPLE_LOOP_SIZE 15 uL CH:SAMPLE_SYRINGE_SIZE 100 uL #ANALYSIS AN:LABORATORY_NAME Clinical Biomarkers Laboratory AN:OPERATOR_NAME Vilinh Tran AN:DETECTOR_TYPE Orbitrap AN:SOFTWARE_VERSION Xcalibur 3.0.63 AN:ACQUISITION_DATE 4/26/2018-5/01/2018 AN:ANALYSIS_PROTOCOL_FILE EmoryUniversity_HRM_QEHF-MS_092017_v1.pdf AN:DATA_FORMAT Profile AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive HF hybrid Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE NEGATIVE MS:ACQUISITION_DATE 4/26/2018-5/01/2018 MS:CAPILLARY_TEMPERATURE 250C MS:COLLISION_GAS N2 MS:DRY_GAS_FLOW 45 MS:DRY_GAS_TEMP 150C MS:MASS_ACCURACY < 3ppm MS:SPRAY_VOLTAGE -4000 MS:ACTIVATION_PARAMETER 5.00E+05 MS:ACTIVATION_TIME 118ms MS:INTERFACE_VOLTAGE S-Lens RF level= 55 MS:RESOLUTION_SETTING 120,000 MS:SCANNING_RANGE 85-1275 MS:MS_RESULTS_FILE ST001039_AN001713_Results.txt UNITS:Peak Area #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Peak Area MS_METABOLITE_DATA_START Samples NIST SRM 1950_2a Q-Std Plasma pool_1a_2 chearurine_1a_2 chearurine_1b_2 C-1G660-U-01_2 C-1FYQ8-U-02_2 C-1GAM9-U-02_2 C-1FXK2-U-00_2 C-1GAN6-U-00_2 C-1GAS5-U-04_2 C-1G5J7-U-00_2 C-1G0C8-U-04_2 C-1G918-U-01_2 C-1G3H4-U-01_2 C-1G082-U-00_2 C-1G1K9-U-00_2 C-1FYV7-U-02_2 C-1G7X4-U-01_2 C-1G7W7-U-03_2 C-1FZE3-U-04_2 C-1FXA4-U-04_2 C-1G7V9-U-00_2 C-1G2Q5-U-00_2 C-1G2M4-U-00_2 C-1G5U3-U-03_2 chearurine_1c_2 chearurine_1d_2 C-1FY42-U-01_2 C-1G1S1-U-02_2 C-1G5X6-U-01_2 C-1G520-U-02_2 C-1G3X8-U-00_2 C-1G546-U-02_2 C-1G2A0-U-04_2 C-1FY42-U-03_2 C-1G1T9-U-02_2 C-1G8D7-U-00_2 C-1G272-U-03_2 C-1G0U8-U-00_2 C-1FYQ8-U-04_2 C-1G0J2-U-00_2 C-1G1Q6-U-00_2 C-1GBD7-U-03_2 C-1G8R7-U-01_2 C-1FXK2-U-01_2 C-1G4L4-U-03_2 C-1G9F2-U-02_2 C-1G587-U-04_2 chearurine_1e_2 chearurine_1f_2 Q-Std Plasma pool_1b_2 Q-Std Plasma pool_2a_2 chearurine_2a_2 chearurine_2b_2 C-1G4L4-U-04_2 C-1G2Q5-U-01_2 C-1FYL9-U-04_2 C-1FZ33-U-01_2 C-1G3F8-U-00_2 C-1G0U8-U-02_2 C-1FY18-U-02_2 C-1G0T0-U-00_2 C-1FXP1-U-02_2 C-1GA77-U-01_2 C-1FZN3-U-00_2 C-1G2V4-U-04_2 C-1G314-U-02_2 C-1G5Y4-U-00_2 C-1G7Y2-U-04_2 C-1GAY2-U-00_2 C-1GB50-U-00_2 C-1GAL1-U-04_2 C-1G9T1-U-00_2 C-1G4D1-U-03_2 C-1G2Q5-U-04_2 chearurine_2c_2 chearurine_2d_2 C-1GB27-U-00_2 C-1G660-U-02_2 C-1G3U5-U-01_2 C-1G8D7-U-03_2 C-1G2L6-U-03_2 C-1G389-U-04_2 C-1G8G1-U-04_2 C-1G5M1-U-00_2 C-1G4U4-U-01_2 C-1G4L4-U-02_2 C-1G520-U-04_2 C-1G1M5-U-02_2 C-1GB43-U-03_2 C-1G2A0-U-03_2 C-1FY26-U-04_2 C-1G4Y5-U-00_2 C-1G5C3-U-02_2 C-1FZH7-U-00_2 C-1FWY2-U-00_2 C-1G1L7-U-00_2 C-1G603-U-00_2 C-1G322-U-03_2 chearurine_2e_2 chearurine_2f_2 Q-Std Plasma pool_2b_2 Q-Std Plasma pool_3a_2 chearurine_3a_2 chearurine_3b_2 C-1G2K8-U-00_2 C-1G5W9-U-01_2 C-1G546-U-00_2 C-1G1U7-U-02_2 C-1G264-U-03_2 C-1G4S8-U-03_2 C-1G5N8-U-00_2 C-1FZ58-U-02_2 C-1G5H2-U-01_2 C-1G736-U-04_2 C-1G439-U-00_2 C-1G983-U-04_2 C-1G6D9-U-03_2 C-1FX35-U-00_2 C-1FXK2-U-02_2 C-1FYE4-U-03_2 C-1GAS5-U-03_2 C-1G3G6-U-02_2 C-1G0F1-U-00_2 C-1G9D6-U-03_2 chearurine_3c_2 chearurine_3d_2 C-1G611-U-01_2 C-1G1D4-U-04_2 C-1GBD7-U-00_2 C-1FZ17-U-00_2 C-1G0W4-U-00_2 C-1G645-U-01_2 C-1G892-U-00_2 C-1G6N7-U-03_2 C-1FX19-U-04_2 C-1G1F0-U-00_2 C-1GA77-U-00_2 C-1FZ66-U-00_2 C-1G025-U-02_2 C-1FYB1-U-03_2 C-1GB27-U-01_2 C-1FYQ8-U-03_2 C-1GAH0-U-00_2 C-1FZG9-U-00_2 C-1G1V5-U-04_2 C-1G231-U-02_2 chearurine_3e_2 chearurine_3f_2 Q-Std Plasma pool_3b_2 Q-Std Plasma pool_4a_2 chearurine_4a_2 chearurine_4b_2 C-1G1S1-U-04_2 C-1G892-U-03_2 C-1G2E1-U-00_2 C-1G3G6-U-01_2 C-1G5Y4-U-04_2 C-1FY18-U-04_2 C-1G9G0-U-00_2 C-1G7W7-U-01_2 C-1G0P9-U-00_2 C-1G314-U-03_2 C-1G1V5-U-01_2 C-1FXP1-U-04_2 C-1FZE3-U-00_2 C-1G4K6-U-02_2 C-1FYM7-U-01_2 C-1G5H2-U-03_2 C-1G4D1-U-00_2 C-1G827-U-01_2 C-1G4H3-U-03_2 C-1FYL9-U-01_2 C-1G777-U-00_2 C-1G322-U-01_2 chearurine_4c_2 chearurine_4d_2 C-1G6C2-U-04_2 C-1G9Y0-U-02_2 C-1G611-U-02_2 C-1G4Y5-U-04_2 C-1FYV7-U-03_2 C-1FY42-U-02_2 C-1G9Q8-U-00_2 C-1G4B6-U-00_2 C-1G0L8-U-03_2 C-1GA69-U-04_2 C-1G2X9-U-00_2 C-1G5H2-U-02_2 C-1G3M3-U-00_2 C-1G769-U-01_2 C-1FZ58-U-03_2 C-1G2F9-U-00_2 C-1G835-U-04_2 C-1G9B1-U-01_2 C-1G645-U-02_2 C-1FYQ8-U-01_2 C-1GA02-U-02_2 C-1FZF1-U-03_2 chearurine_4e_2 chearurine_4f_2 Q-Std Plasma pool_4b_2 NIST SRM 1950_2b Factors Sample.Matrix:Plasma Sample.Matrix:Plasma Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Plasma Sample.Matrix:Plasma Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Plasma Sample.Matrix:Plasma Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Plasma Sample.Matrix:Plasma Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Urine Sample.Matrix:Plasma Sample.Matrix:Plasma Oxalic acid 8773901 7094073.9 13517360 13877618.9 12905379.5 48432296.3 6451748.8 69015620.4 26184232.5 66702829.8 6239199.2 27729118.8 13613096.6 14478565.5 52665756.5 55738553.3 116085891.8 32236284.5 57257584.8 7839999.6 3121373.4 4461424.6 42545988.7 105454015.9 10257344.7 3220931.1 2708923.5 16968172 39647610.8 9949391.5 971338.4 104080007.2 74794179.2 11047000.4 142841014.7 3977775.3 32683755.9 88106137.5 120686650.7 14967729.1 5792287.3 5228354.3 25834668.4 113366373.6 84932189.4 4211535.2 42952381.5 39834096 10001934.9 10888436.5 9218345.1 288231.3 18204822.4 12236459.8 105497036.4 43995248.7 56990647.7 18093697 27902069 37572721.9 158113784.4 95774855.9 42105861.2 0 37990531.9 41710176.6 77364359.4 91157586.5 8412605.1 43538858.2 10880496.8 76449133.8 68460143 30215969.6 0 12557109.6 11497600.9 81821.7 45920597.4 38237988.7 32438703.9 0 50866908.8 0 103705938.1 0 25064156.6 0 49893129 17901561.3 18445583.4 77645467 0 0 53318006.2 72064144.1 51211117 0 78710992.8 0 0 0 14009008.5 17829609.1 19984081 26472953 7109143 19408001.9 47577408 1605693.2 29832420.2 66662057.6 53644204.6 10278757.7 29993844.1 13554857.9 2579252 8934875.3 45260712.7 17373361.1 21583684.8 18305499.1 49242254.6 32363378.4 48047971.2 15734801 15229386.4 24568834.3 23609831 55202423.3 27055839.9 92243068.7 144374375.7 97940148.3 78943197 18239210.6 30511149.9 6072093.6 4359122.3 22244460.6 67386361.5 38124423.4 22862544.2 2734240.2 144627586.1 13661572.8 169002854.1 10836470.2 10021680.9 6867233.1 12317453.7 27205753.8 28459490.4 13793692.4 25320896.8 33280746.9 12641617.8 15620199.4 87723472.9 10343203.1 8761572.6 20108602.5 79113032 12292279.2 91450986.7 20554615.3 31348874.5 28173690.8 20689245.7 33843521.5 12312625.5 18493906.6 12073562.4 15463324.9 14495030.2 8181764.2 16207600.7 8237349.5 16976755 14634153.3 61122734.4 48402065.5 91828669.7 9284154.7 29809325.2 11732557.3 44789288.4 9124603.5 8184389.4 28271967.6 68913978.2 46759897.2 14612298.3 32644309.2 23904292.5 72235903.1 50028985.3 221574790.9 125099522.9 22074549.9 21221787.2 14215199.6 8213273.4 Serine 5545173.1 5182755.1 3077930.2 0 7843276 7626862.1 9309363.2 3484797.2 2887241.2 6431532.7 4469020 6337630.2 7204940.9 10925206.8 26710176.1 7681223.6 12516435.7 9947220.5 8066414.6 8884340.9 3143535.6 5244698.5 4199564.6 7148155 0 5097984.2 1950002.2 5811560.1 7990527.1 5260269.7 6923472 5431825.8 5236614.2 2415750.7 9483546 4702859.1 15219045 5992458.9 9134533.6 7396227.8 2372880.4 7167516.3 6226167.8 7280052.3 9163895.8 9679848 5266504.4 5855632.9 1423396.1 1473286.5 5588672.2 4340589.7 2902227.9 2307144 6135724 4678798.7 5392011.6 11533997 6726254.4 14437764.5 17571833.7 7180106.9 11471738.9 13478098.8 9054962.2 7687799.1 3071786.9 16118763.8 6682856.1 9639685 3320235.4 10758471.9 13472391.4 4107068 3701086.2 3604318.1 1860045.5 4297438.1 6025136.8 8198371.4 4901791.9 4711454.1 7169975 3967849.8 7934565.6 4123548.7 7457632.6 13245554 5871381.3 2610579.8 5178319.7 4798792.7 7302464.5 15403108.9 3557595.1 5292269.2 4226413.7 7495584.1 9287946.2 1640688.9 522758.6 4335893.3 5162259.3 2663657.6 3797178 6873383.3 7212574.1 13898581 4954959.6 4961392.7 1252491.8 9439391.8 8488694.8 2917016.5 8090616.6 10280160.1 5463392.8 7848213.6 3240512.2 3865233.8 10266820.7 11422072.1 3340250.3 1702875.1 9273038.9 2234639.6 1187529.3 11670216.1 4060523.7 13884555.9 3314576 6330218.8 9404635.2 4726524.9 5001538.7 6250031.8 10640784.5 12712061 7698235.2 8934588.2 8429486 7445616.4 7460424.6 1544539.3 6993890.8 4868622.9 20302708.3 4409896.8 908496.8 6129830.4 5334030 5142074.9 161817.1 8877138.3 7302364.8 5860751 12390892.4 3521230.3 7359499.8 10956432.1 993228.6 3462560.3 8936554.6 10425977.1 3045078.8 4207329.7 15269588.3 8534059 10756284.4 4838683.5 8031990.9 8173950.7 6961796.7 7733729.3 6496899.6 2864633.3 286294.4 7667708.8 135621.4 7543817.2 4357619.9 11062592.8 11720111.6 6186518.8 12718997.2 2096497.4 8636411.7 12987986.5 4986245.9 2031468.2 2567200 4284602.1 4942721.4 17663298.7 10457499.7 2320085.6 8509452.7 7006040.2 8462482.6 1764266.6 4197554.4 5266761.8 5429253.2 Glyceric acid 12259766 12604665 4928517.6 3313549.6 8058454.6 168139.4 325567.6 0 0 2511682.9 0 0 1924318.6 0 13613804.7 0 39868600.1 59920.6 1657960.4 2391393.2 0 0 1556731.4 116769067.2 5832218.6 405469.5 0 816474.9 168945.8 0 0 33772500.3 10352610.6 0 124506878.9 0 10335022.8 0 6921283.1 0 0 0 0 164726271.3 0 769365.6 0 0 4165140.8 4515058.4 14973031.7 31596790.7 9827599.3 11145584.9 205702054 2680056.3 596950 9760032.5 1771413.7 2481812.2 9897640.7 2651890.6 11722237.9 0 3463311.2 7336388.3 507185.7 2710925.5 1080188.8 1529380.8 0 27436503.7 911516.9 636555.8 4895528.1 9421472.6 9223775.7 0 2397011.2 2112569.6 37176016.3 236746 1099581.4 3626407.9 6974690.7 1513942.2 7956830 5478666.2 9701542.7 491921.4 1627105.6 1122165.8 563920.4 5605278.1 0 0 23277902.9 8463597.8 66826862.4 6835623.3 7492614.9 14709743.2 18597981.6 7594641.6 9027938.9 3687133.1 4613178 9873794.1 8117387.7 4540782.1 3395710.1 3873187.5 3794358 4970233.4 3883320 4410962.6 5528484.7 6282823.1 5477834.2 3448354.8 5864249.8 7147228.8 5537097.6 4585247.5 14755734.7 7719791.7 7649134.7 8229763.5 3954995.7 7310502.6 5749186.1 4204792 3535188.5 3865886.9 6693724.8 3285441.1 4673801.4 6860551.5 6673863.1 3471826.2 4272292.4 22808079.9 3903730.7 5334677.6 244151245.3 5413707.8 12708736 6457651 8173831 10126846 8096501.5 5081400.9 5675480.5 631245.3 1429590.4 1447914 2272149.5 2637659.5 140781696.3 1806115.5 984150.3 324608.2 25020105.6 247329.2 320344.4 479756.2 864658.7 493637.3 1659421.1 2611675.8 1612627.3 678351.6 1934074.2 4730124.3 2028325.9 2551475.6 2856914.9 2201393.2 686945.5 553836.8 83457339.5 985147.4 1650020.2 485674.8 5323043.1 473004.3 3742820.3 1022619.4 386095.2 2538244.3 105718492.1 25037467.7 766423.6 4965830.1 2752794 490490.1 3521263.2 176012869.2 10628099.4 1865895.1 3318036 11308184.8 6209035.3 Uracil 0 0 31082627.1 31311130.5 31260265 55275475 12146701.1 22326975.2 7908516.9 22163550.1 39938659.4 32971102.7 11646020.6 40427114.9 23055166.8 29878446 59682825.9 57855749.4 36878383.4 52789771.4 17617431.8 42714952 22841041 32499271.1 29870120.5 23600173.9 0 43721241.2 58606580.6 46058610.8 20665092.9 47984355.7 14637325.1 5135147.4 19302760.6 10145374.3 37978661.7 31413497.3 26888411.2 44746005.9 16116202.1 16856076.5 97109483.8 6972923.9 49005699.5 42044331.3 56833906.3 47691859.8 31939792.8 32879844.9 3735843.7 2445870 16491324.4 14519221.7 20991037.3 17264647.3 28680911.6 22670467.7 10298567.8 67814910.5 51094962.7 32628376.9 57607965.8 65481998.8 18634508.7 21755002.4 14548977.1 20465450 31892660.9 37702025 21914564.1 13651075.3 61952957.6 17429069.5 39113469.7 16924558.3 16731491.2 34413164.3 40556217.9 11347338.4 34324510.2 61845571.7 39016067.5 25116534.4 68640903.8 587097.1 6289842.5 47256550 16836638 58584278 26250695.4 38529115.2 50121387.8 119732469 50031616 32230429.2 19891485.9 27608238.9 25592266.6 16956893.5 17325955.3 3497387.9 0 22304276.5 26353405.8 58818082.9 5486395 43638349.8 14342181.7 28355296.8 41070839.8 41502431.4 69850592.5 25335004.9 9452904.8 21369391.4 40143281.7 16032370.7 52094094.8 16990091.5 7478604.2 26541252.1 75698333.7 12844135.6 32061575.2 25812719.2 27184310.8 7332853 30677509.6 19029250.4 44109042.4 99247952.1 52966688.5 13658804.9 23361123.8 54954192.4 34868286.7 10281760.3 57966223.7 47869582.2 84106456.8 35121622.7 28649026.6 15879206.8 5855270.1 29921934.4 10975714.1 26129739.3 24006347.4 5475328.1 5179130.5 21440555.8 21942879 19248000.3 27426562.6 14842317.9 60884546.6 26852335.2 31933382.6 19905983.9 18221377.1 18955063.9 17084258.8 34848775.7 39134914.3 28234656.9 11611818.1 84231433.8 22228937.9 14621238.1 41596631.3 41616383 15685981.1 54164403.7 119739682.5 22339049.9 23342364.4 24121915 34305279 30519810.6 22910604.5 30932210.8 16266451.2 21013950.3 38442070.2 44989970.8 37531465.2 14679458.1 34373441.5 41014239.6 22155111.2 50574079.6 68890621.3 17364280.7 99952987.2 34183881.4 42524304 23756107.9 23513827.4 13223304.9 23560030.1 5440734.4 8595710.1 Creatinine 138719528.8 121381586.1 557800571.1 641514081.8 747085017.1 553586880.1 393512100 280138720.6 462627335.3 574804086.8 412418113.5 481834776.8 569319171.1 988524887.3 972483500.2 422328481.5 1103072721 904290377.4 479358328 579435115.9 420575640.9 407483065.3 505662989.8 399156962.1 679061254.9 294163817.3 163368076.2 492443047.1 724257052.7 938306700.2 377167240.4 1473784957 375786266.6 266444916.4 339098299.4 440009886.2 885493178.2 363670649.1 439637945.5 427042497.1 316193690.3 658972024.6 516787541.4 468991377.3 453868166.3 669993444.4 395224328.1 332233970.1 659254747.1 675797111.6 164203580.9 17898201.7 600176156 628828998.3 257122974.5 547706104.6 329051360.9 303984473.9 331127881.2 860496100.1 697200716 610665994.2 658855559.6 473644933 315296808.3 653599050.5 334477345.2 676257619.9 925393147.4 547019442.6 417105685.8 263579217.1 484216675.9 464979855.2 412399918.8 630224101.5 633300156.6 276773063.3 498706779.2 448621056.1 318194837.9 360538771.9 676096606.5 732732076.9 796260770.4 228655044.3 433492100.9 1479867131 408266728.8 505509310.4 445118450.3 685900027.4 304589482.9 1124742203 249871112.4 569642399 888852608 832327286.3 598586136.8 652709281.3 678609042.8 76139719.3 0 585455057.7 597508677.9 211689678.4 284034422.1 764084823.1 369920264.9 356182652.6 244877321.8 410415227.4 567852694.6 471012897.6 296671520.8 425664502.9 393346322.8 276698322.1 743340775.2 234206614.1 186997384.9 552815544.8 409390335.3 897884309.5 710774995.3 685693163.2 737821959.6 308823549.1 600055342 890725180.2 522424941.4 781064499.8 787779286.3 357667727.5 543983277.5 994321401.5 1217765028 659237970 916572984.4 498161612.3 972006633.6 677699460.2 503153327.1 375369759.6 534322048.9 475740962.2 521059297.9 697531449.2 705288388.1 0 0 618020994.1 622411764 545589782.7 440838248.8 684253421 621600887.3 799555688.1 412965948.9 639459082.7 574600402 369886439.2 672442007.3 674787956.1 740707111.5 644787879.8 495301147.7 690342844.8 838141839.4 237382578.8 516382188.1 442239559.3 432339867.5 506326942.1 960994411.6 303245924.7 695251730.3 300048880 382033365.9 421423222.8 1094138548 866979335.5 368951542.4 564804544.4 639632606.1 244858880.7 501502490.6 521898821.5 343981513.3 578154404.7 761890119.5 831901177.7 661099942.7 366956826.1 915474653 705154690.4 536860119 669022389.6 474747539.9 0 667380953 0 0 Acetylglycine 1385235.2 1101838.3 3340973.2 2711426.1 2880972.9 1497767.9 2900239.8 1257049.9 1497167.4 2224046.7 1568091.5 2995122 4375221.2 2251938.4 14008867.3 2189809.3 2421577.8 2214480.3 1396875.2 3261322.3 1744477.4 1981044.8 2435665.3 2256462.7 3353575.1 1529305.5 1207317.1 2503778 8841170.4 1882405.1 2199794.3 3246489.2 1657603.1 1088745.6 2870871.7 1395594.6 4958197.8 1440776.8 2372467.9 7215179.7 1391986.8 4581445.6 2401621.8 2425215.2 1550559.2 2233243.2 2361974.4 2445857.9 3002049.7 2888881.7 1306543.6 886603.2 4095675.9 4155454.4 1890536.4 781636.9 2599514.4 3220671.2 2218918.2 6763467.7 4657238.8 488448.5 2638551.1 1434314 1877424.1 2159898.5 1714593.8 3384148.4 2480248 922461.3 912254.8 2796534.9 1465186.1 7430447.2 619999.2 3469775.1 3845998.9 1506344.6 1482492.1 2934858.5 2853651.9 2136871.6 1293481.2 1351722.9 2954696.2 4894081 4408622.1 6235181.2 1918552.9 1040369.5 1381354.9 1881353.3 1872342.9 3613445.6 919665.1 729611.9 1353757.8 2101071.9 11918411.1 3099894.1 4175619.7 633321.2 0 6709447 4628713.9 696645.1 3290124.2 869820.9 1614307.2 1559290.8 321100.6 2876499.1 4921554.1 821625.2 2343102.3 215651.2 2804162.1 198839.7 2125159.8 1512698.9 4359017.2 3019489.3 884248.8 2148150.1 3962464.1 6551138.4 5403823.3 5865036.3 928385.6 5329412.5 1867052.8 3508601.3 7110879.7 412208.9 1681545 2091921.5 3334111.1 3849366.6 2329432 2825221.6 3257115.7 1765051.1 3446847.7 154406.7 1504931.6 1277282.5 2572132.2 3623953.1 5476282.9 220851 451170.8 4901375.4 5099843.8 2514743.4 3704400.5 1296923.1 6620581 683125.5 2368340 5457370.7 3162596.8 2814878.4 1946596.6 3821283.9 3217841.1 1086806.7 1244359.7 1733133.9 2381959.5 1391581.2 4092897.1 3060650.6 2465481 2290241.2 1044056.9 716680.4 3258759.2 2319644.6 1104379.6 1992334 10961230.2 2671710 3010093.7 2620476 3296271.3 1112911.7 3622973.5 5834834.2 1602632.2 1286359.9 684141.7 382545.2 6510342.2 3246800.5 4908562.5 1228414 632818.4 1270579.9 1501451.1 727453.3 4402850.9 499191.8 1073017.6 Imidazoleacetic acid 635735.6 548151.2 4263201.3 3906488.4 3445315.2 4518086.2 1836644.3 2464728.8 1553817.5 2062397.9 3422891.4 1752551.8 2592759.3 1373587.7 615276.1 2186484.3 2443083.6 1365889.7 3567710.9 1507055.5 1529849.5 3608322.6 1927505.1 2418427.5 5870964.9 1292488.2 1429508.5 3781121 3349198.2 2736750.3 2650414.8 6561836 4236371.3 1192348.3 1861686.1 1522871.8 2476559.1 4249588.7 3589410.9 3008408.7 1477278.9 3111309.4 2956426.2 2584619.6 3949554.9 2589259.2 3917100.8 3560933.2 4915216.7 4937996.5 798429.9 819208.3 3031762.6 3396508.6 2328608.5 2321033.3 1644417.4 2984301.3 3577109.2 2105001.9 3789010.4 9351522.5 3186876.2 2601711.1 3856659.5 1759473.1 760411.1 1952327.2 3413966.8 1626902.8 1069798 2202243.8 4221862.5 1224066.8 2611190.9 3398651.7 3026453.8 2560236 3011020.7 1886174.3 3536008.8 2541192.3 3464225.3 950550.5 3673711.9 1306364 1826924.4 3811031.6 1120445.8 3291172 2729186.8 1483509.2 2077958.1 5020580.3 2323320.5 3500865.1 2969848.3 5362194.9 4489945.1 2987049.8 3141107 1072293.2 298871.5 3497860.6 4658521.6 2691698.9 2496229.7 2866968.3 1841933.8 754755 2045168.1 2827370.6 3059432.4 882259.6 2348713.1 4647129.6 3255281.5 2845136.3 2963329.6 1096562.4 721459.1 1269701.4 6074633.6 802315.5 0 4511044.7 4562512.7 1164476.1 3582854.1 1622284.6 3151379.3 4226807.1 3394333.9 1838994.9 2127201.8 4634941.2 4890355.8 2796681.2 4764693.4 4387488.4 2589949.2 2603711.3 3060364.5 1767294.2 2338100.8 3393478 3239036.7 4038249.4 4274129.1 743894.2 702676.9 5416055.1 4228134.2 4256410.4 2213125.8 1563506.4 1202351.7 3366889.6 2682427.3 1023387 679137.5 1202981.4 2037593.4 3243360.3 4192928.6 3043060.1 2434411 3897433.4 1406958.6 1516612.2 5855207.3 2667520.8 1505202.7 4252647.3 3503839.2 1542309.6 3458852.8 4289932.2 4735055.2 3981771.8 1339779.2 1755269.2 1713729.2 3662954.6 4369859 2333808.3 5014036 1809642 1786045.5 1017414.3 1403306.9 3974510.7 2520095.1 2540065.3 4217460.4 3127167.1 4797237.3 2827699.7 4679547.6 1453277.5 4105584.1 737556.4 857277.6 Ureidopropionic acid 3823850.3 2838707.1 1836815.1 1829124.9 2538612.4 2550108.3 3870822.4 2279713.5 1651502.9 2602264.4 2149737.1 2989403.2 2343691 4333737.6 6411705.7 3021171.9 2909486 2575532.3 2028512.6 3690198.7 2323979.4 3666798.8 2991457.9 3680369.7 2126410.7 2482941.5 1577900.3 2577510.6 4561921.7 3635382.2 2494222.7 31627213.3 3209333.2 2643445.6 4616604.2 2276974.5 5335653.4 2968676.2 5577246.8 2905049 1534391.6 6871372.8 2771996.3 2766068.6 2336566.5 3269269.3 2948526.6 2915298.9 1889667.4 1923902.6 2617322.1 0 0 1564336.2 1834916.5 0 1895274 5205298.1 1004531.9 4006379.8 9674584.2 3032097.1 19136174.4 4197183.9 1549179 6805522.9 1446497.7 3969095.1 1088419.1 2377246 1445248.7 15415843.8 3835452.5 360449 2316045.2 705598.5 2071011.9 1643499 2736615.2 4921026.9 1932357.3 3686470.6 5193081.3 219722.9 4013105.5 4025686.5 3491777.3 4171641.8 1424341.6 767864.6 2442254.5 1063097.4 12654339.9 5756289.2 6050667.5 977550.7 5119719.5 5600570.4 5317782.9 0 0 992035.5 0 2237265.7 1465370 1122078.4 5906857.2 4509633.3 3293195.2 1598412 2768354.9 7100272.5 4019813.1 5184406.1 11271929.3 14335262.4 6984966.5 3534130.5 3599146.4 449761.9 2277915.2 4910744.2 950435.1 1441487.1 4230310.5 510997.4 1703484.5 4577173.5 356492.4 9584750.6 827585.3 4580021 6278667.3 3572935.9 3616615.1 2800131.6 3108485.6 3507983.3 3157782 2942532.3 5514475.8 4725682.3 2560309 636915.8 3304281.5 1096917.6 3245018.9 957293.9 0 1173843.3 1399326.3 1200830.7 1933388.1 1052789.6 6841228.9 4507828.9 8005513.6 0 3373758.3 2115042.6 3302837.2 2428449.5 3737208.9 5877311.5 242894 0 3525755.1 1875762.4 7212974.2 214177.9 10110549.8 4350303.6 4230506.7 12921900.7 4970106.5 1758433.9 1943249.8 2054663.4 3826038.6 8535633.5 2625220.9 2558554.3 4077350 2477946.6 5621470.3 3991319.9 3055727.3 2779411.7 1806794.6 2809820.5 0 0 1575595.8 11262220.4 14177980 373278 3805367.6 1887121.2 1860583.6 152221 438523.1 2943712 770159.1 Aspartic acid 8922546.8 24011925.1 22734479.9 20524316.2 18741757.1 20197047.7 16117657.7 14551563 13344093.5 16200535.7 13583704.5 12953687.1 11158775 35435599.2 73872960.5 26681799.1 32695635.8 20600074.5 18135600.6 20476971.1 9060181.2 17564857.3 17499746.8 23738846.6 17303811.4 16026699.1 5872903.1 15886163.1 23795375 16755431.9 14199537.5 39442689 17328298.9 15137966.9 23003184.6 13947031.2 22460384.4 16037590.2 23396083.6 16218937.7 11464436.6 22005634.7 20982902 16266947.3 13885503.1 23597256.2 23384502.4 18885227.9 19533678.7 21793455.2 16837196.7 19220960 30236175.5 30170289.7 9455499.1 15407505.2 13547405.5 10107309.7 21603343.8 26303704.7 47243494.6 15025389.9 30571756.6 25116523.3 1340849.5 26525529 7638475.8 14729014.5 22882809.8 14147767.3 22836533.5 18239188.9 11364804 17454237.5 26495690.1 25727599.3 25565931.7 2169936.2 23798393.4 17601510.6 17790057.4 2633654.1 20496354.7 12821095 21983597.7 10632411.5 27286574.2 43706659.2 10150988 12133763.3 19075671.3 17049802 17390175 16643070.3 31508480.1 12990824.6 24228498.4 25526532.6 7414239.5 19760453.3 23402516.4 27548466.8 16133906.9 29747152.3 28495184.2 2444083.5 10323684.5 20322930.2 35016900.9 7630669.8 12393632.8 22056128.8 13283604.8 17813738.6 27982859.9 33571371.7 39429210.2 10839889.9 30674256.6 12126148 20766933 22257629.5 10076157.7 12498168.2 33673237.1 25110739.4 31047168.6 10290185.6 6163625.7 21407125.7 25321343.3 14968727.6 21450888.5 19190375.2 41010852.3 7054289.4 21534996.8 15751862.6 3257685.6 18510389.6 16835220.7 20890180.9 9153444.7 15971409.3 11594696.4 10498269.2 18834947.4 23411841.3 22084324.8 30730566.4 17651378 28079391.8 29058522.6 25240739.5 23621964.8 19063668.8 29062994.9 15037726.8 14508632 24781915.9 10414414.3 16283383.5 10723399.3 30028128.7 19757521.5 21614741.5 18080012.6 15250319.1 36111648.1 15651408.8 28994838.5 27871105.8 6408646.3 27783572 29134794.4 2948793.2 20976086.2 8433904.2 18822395.1 10200114.6 19162020.7 29709732 31661179.2 21696282.3 19865870.2 9970323.3 7702635.6 22493706.5 6786564.8 8310117.1 10046796.2 23359528.4 13348812 29524274.5 30137436.3 13937499.9 26049801.8 26880165.7 37747573.7 0 20208019.4 21162332.5 2270327 Phenylacetic acid 799384.3 906926.4 13809082.1 14499456.9 12938335.3 8523916.7 214724.4 4281045.8 347134.4 1994218.4 5995193.7 1660664.6 3938820.9 20252778.7 2862695.5 6885487.2 7586129.5 7654187.7 19113691.3 8766434.4 5595128 6512657.6 639326.7 3041492 15908204.4 2466423.1 3012330.8 4398954.2 2738963.4 1329446.5 8099871.3 15092578.9 7493145 4966525.2 2075124 5571433.4 2112363.4 2235599.6 28450296.9 884261.3 1182339.3 6588341.6 1937844.4 7042959 13135912.5 8060187.4 1887583.6 17601163.1 12048021.8 13231028.6 3302343.8 9774461.9 13022032.1 15996922.3 4855047.7 4668033.9 4771822.8 2874898.3 4922644.2 3444364.3 3243932.4 31283836.4 4942069.3 5075584.8 2406075.1 3398184 4560035.2 4010866.2 1614069.8 3516835 4460726.9 3462287.7 3387818.4 3594669.2 5069879.3 17172130.1 19038166.8 2833051 3371968.7 3853324.6 3236795.3 9257263 3364927.5 2367409.5 3698385.5 3388887.2 15263570.8 3384961.4 8008776.4 1486561.1 3945783.6 5310249.7 3909132.6 3382084.6 3599812.6 3244922.5 9495463.9 4154072.1 16061037 18112523 18005791 3895345.4 1374211.2 12157781.7 11769062 4997647.6 6049973.3 3546507.6 1042314.4 3669607 4509279.7 7700020.7 8670891.4 4024294.6 1925581.4 24559623 2446954.9 7700059.1 12090875.7 8746796.4 2031934.8 1819207.8 6828850.2 3560031.2 7420835.5 15337291.1 15702592.3 21343659.8 1146609.3 2707398.1 2807231.9 2921008.3 15320072.3 4020196.8 1560646.3 3779371.1 1696012.3 11725793.6 25849094.6 3832686.2 7255962 1026751.5 8528818.3 2086743.3 706432.3 3906486.6 3911109.2 13840790.5 13916573.5 3358848.1 5063470 17396786.2 16054921.2 3600706.9 4112769.3 2456304.7 13495416.5 2621993.5 2592261.5 2449724.4 2658856.8 2230411.9 4366640.6 10046751.2 3013136.8 3040344.5 2634049.8 4530672 19926092.8 2527556.6 10987555.6 8322458.8 791468.6 19704004.2 986032.6 4455840 14485713.6 2166449.1 21340277.6 3576318.4 6552652.4 3507970.6 3310559.8 2516090.1 7568493.1 15245840 3081571.8 5359575.7 2853730 3448314.4 8410623.5 5413272.3 2043828.3 2148188 6938825.4 2671326.1 23494176.6 1729684.6 2638271.3 4930556.5 16639573.9 2671986.4 4901689.1 6-Hydroxynicotinic acid 1308579.9 1051878.2 13759605.3 13263019.7 13040107.4 49792300 12140196.8 144981311.6 1768829.3 3697271.6 1867269.9 6558439.7 6951387.7 1051565.7 8362703.2 9567335 10227066.1 21554751.1 52785816.7 4457469.9 62141319.7 6010707.6 42202800.9 17074958.3 18457845.1 1788814.1 1155871.3 14319576.3 11150969.4 1555809.9 13933980.8 11056966.8 101651794.6 126024298.9 37242463 9916636.2 25210994.1 236102323.1 27794744.8 5571434.8 7106897.7 9748731 1657586.8 27325477 8420988.7 3982885.3 32693138.7 7857260.9 17430275.8 18393161.1 1097091.4 0 26239241.1 27689737.4 42930454 6687119.5 0 39865943.7 66935351.1 0 19897638.3 59325955.1 8390816.9 36755164 173433330.5 15684872.5 0 56700710.3 53563383.6 0 35143479 5075886.2 31586960.9 0 0 42202370.1 46660565.3 125735760.9 0 4513886.2 0 16544434.5 71623097.6 0 6486032.3 978451.7 72120795.8 0 37887224.9 0 13534391.9 0 459339 32042543.8 0 0 49384851 0 13262334.2 47505012.9 55399241.7 0 679314.9 18307981.7 21622595 43604.4 253379248.2 12772641.9 17671141.9 5627408.9 8835393.2 3775055.7 5347423.7 12981965.8 9538819.7 16857615.7 9738029.3 11603710 34806413.5 5360585.7 5168801.4 1790226.3 1406728.1 38475341.5 8351871.4 26705398 27795747.8 29124573 4960396.9 103921463.9 800447.2 26592288.8 8227890.9 6114407.7 7846211.9 9485610.2 25833307.3 33500236.8 23464856.7 10785576.6 18612414.9 107148124.5 6311125 3798168.6 105807049.4 23087377.4 6373766.2 33403349.8 31779143.6 757046.9 1526649.7 20342647.3 20887947.5 59674113.6 2539227.6 12975018.4 80889669.6 1123236 9983546.9 1933609.5 2694808.6 3772146.1 9970685.7 15886847.9 2076376.7 88968219.8 2022182.3 16032461.6 83694819.9 4801807.6 40981532.6 2412688.7 18849317.6 13931822.8 39882313.1 1920286.5 40077441.6 13617862.7 2874711.9 4834805.5 1051962.6 1510713.5 23305384.8 47100274.3 16874479 251841585 24608116.5 105157442 20793587 3985788.4 4049774.7 8233599.2 1731722.5 8732875.2 4486727.8 5715777.1 20726158.6 20580929.3 7806049.1 2183010.8 34618994.8 1794054.7 1753426.8 Caprylic acid 84994126.7 258900052.2 4109776.1 4892282.4 0 2537316.9 2012320 1853037.8 5595377 2173024.4 0 0 0 0 0 0 1121948.3 0 0 0 0 533932.1 1369590.2 616144.3 2503395.6 0 1507066.6 0 0 2279749.1 836669.2 0 1049720.4 318539.1 0 708411.8 65857.1 767750.6 0 0 0 0 612839.2 600934.3 706422.5 0 991522.2 0 2868709.9 4266724.8 251770451.6 183249017.8 0 1145.6 7296246.5 5787194.1 5885841.6 3736688.4 5360658.8 4523089.8 3831111.2 2674090.6 5104126.4 4324204.5 4137515.5 5889811 4600191.5 4505598.6 4674177.9 2746421.2 0 5424189.8 4037405.3 5057343.7 4887052.9 0 225902.7 4752189.4 5449587.1 4960505.9 5385346 7045849.8 6520791.5 4632984.6 4849642.4 2345878.8 3418166.3 4057936.5 4497643.3 4642595.7 3136822.3 4382656.6 2705280.2 2223031.7 2520201.3 3975180 4184308 2513813.5 2596124.9 0 0 218574639 138178768.7 3852659.3 5141636.2 2395432 2708491 2208796.6 2965706 3857468 3491937.1 0 2784363.9 3532949.4 4019087.9 3994335.1 4275923.3 2928270.3 2938284.7 2524985.4 3702528.2 4174991.2 3441579 2727246.8 3286528.3 22005857.8 27696679.6 2809554.6 0 3059730.3 3311491.3 2016955.4 2872966.3 3030209.7 2743220.2 2762776 2541046.4 2526573.7 3808201.9 4466900.3 3936400.6 3913536.9 3797294.1 3943448.6 4370461.4 4469189.3 3858399.4 5645540.8 4882322.1 216804485.6 51715580.9 2500810 2497727.1 1933812.8 2290662.8 2109468.5 1144346.8 1689263.8 827091.9 1901692.3 1701306.4 931930.7 5358618.6 875812.9 896052.7 1069197.7 1978329.5 910912.6 1859419.3 1993374 999686.9 1062252.1 1943982.7 2010795.4 2148341.4 2188631.6 2167568.7 955077.9 1841959 1098746.4 516565373.5 1110577 3861909.3 3449199.5 3099824 3492667.5 3310210.8 3029583.5 3027933.6 3024966.3 3233620.6 2594904.7 3093635.1 2931731.3 2612186.4 2740606.3 3121425.5 2898263.1 2969553.9 2939287.8 1754150.3 57891511.7 15807812.9 4-Acetamidobutanoic acid 4455414.7 4359982.5 64878921.4 62287485.9 44491779 49343824.2 121816173.7 41655532.9 17731780.7 33807562.1 54337194.4 50476076.8 46242955.7 196253732.8 181414676.2 50987508.4 70178395.4 88810233.3 78652113.5 152278828.8 75470176.3 136365175.1 37380536.4 36782439.7 54736043 65993111.9 7414183.7 106739176.4 135232786.4 92884638.4 62169942.3 49947318.7 34476391.1 50379460.3 32662032.2 65602242.5 106769072.8 28383626.8 143428935.2 89646764.4 38352529.3 83136434.8 52392609.8 26423666.6 49890360 100734455.9 38095082.5 92426477.5 57244180.7 55539637 7231152.8 0 68952491.8 58063084.2 15131251.4 15489526 18713908.5 42683847.7 58551171 181706094.3 94365048.7 165002686.4 110609180.1 146876676.1 36363471.4 60907402.7 80049246 74220517.6 24629374.2 52241522.3 121413106.6 16366108.3 54538322.5 70053313.1 111603198.2 65704234.1 63430427.6 75513166 56063689.7 48279382.5 2406386.8 104424156.5 85600320.5 124510671.9 62142576.2 52996378.3 46583516.7 100781513.2 58559093.5 10155839.3 110285143.5 64210384.7 63728966.8 131959334.9 38180469.6 41986187.9 29000499.7 127316223.8 57331366.3 54474598 53551783.6 0 0 59653741.1 63594523.7 43362930.7 68376426 101427341.7 42330827.1 73050682.5 78853350.6 61792040.8 98408179.9 99063533.8 54791905.8 171286555.6 203813085.5 72797137.4 65376843 27020587 48567393 49856143.4 54510748.8 103611830 143776044.1 58560883 61125856.7 56892926.8 10193688.9 71041743.1 44257713.1 106843914.9 94868547.5 44299623.7 33497079.8 50431706.2 139011609.3 117379982.6 62557758.5 19169806.5 111870674.3 53683864.5 59245318.3 64507344.3 26710982.5 2433301 26309022.6 55298350.3 53415740.6 0 11667433.4 58785277.3 60029599.4 129108631.6 54220056.3 37630407.9 151285684.8 16873375.3 32104694 156181479.9 111449270.8 73898300.7 57219924.1 194909233.4 43823256.6 41872338.8 41095106 86349729 154716921.1 18879095.6 121451005.5 41588317.6 92100616.5 107448323.9 111165851.3 25382466.7 55372881.8 73084632.3 95897002.4 42770554.8 48410294.6 39047424 36226119.6 87478441.1 59175239.3 96280025.3 50253261.9 155198727.9 77466680.6 49656980.4 21051308.9 29890657.8 90315317.4 53694387.8 109066175.1 62232655.7 49391307.8 44357353.5 36115764 10086591.4 56824308.8 12422391.3 9103930 Oxoglutaric acid 5780401.2 25459953.6 6652231.4 6034388.1 106973076.1 70493670.4 89579367.5 135975416.8 63593687.6 127562494.1 287097661 69177361.5 540466358.4 155447330.2 431499028.9 50753413.6 287748023.9 105716446.7 91971403.1 460942045.8 205687029.1 460763300.2 100478211.7 27929278.3 6652094.6 192845442.2 909605.1 219615211.8 237596760.2 128436740.1 118891676.6 44226099.5 27713822.3 79191610.4 68949873.6 209962651.9 93806323 46977957.9 103560556.3 121156671 93372457.1 305728965.1 163599259 3388201.4 87661079.2 86507585 96035522.5 171030252.8 5511437.3 5703166.8 26289028.7 25565181.8 17355129.1 16312068 87867168 75200589.6 70869425 113084214.2 259569717.5 207337624.6 106325242 130907164.7 157622186.1 370567098.9 82766094.8 95442998.7 147452481.5 72055198.7 41240490.4 831871629.5 197439354.8 55328419.5 143563592.9 105640423.5 143073804.1 15189331.5 15292207.4 125122468.3 128475171.6 111757291.3 51000963.9 230172638 87726515.5 361304862.3 150387190.6 146806912.2 101165679.6 42517725.6 108810254.3 30938885.1 167285866 164058630.3 177522859.5 167475811.3 152165051.6 271800106.6 38374259.8 174803526.1 43398700.1 11644955.1 12227140 22219317.1 18101479.1 8451132.2 12074911.3 123521799.5 267728659.4 205015551.9 103892645.9 86805462.9 223198227.2 362556771.5 261615357 94579134.6 329512288.8 687828134.8 448136497.1 126116197.3 130381039.8 90520446.5 209279596.5 262710923.4 140157838.3 148217137.5 81817566.4 6461103 7095646.7 177445869.1 89523795.9 103781310.9 63612771.2 171196236.6 45643580.6 203696114.6 135914086.1 109001642.5 162640720.6 132793280.5 52489257.7 136015904.5 24417205.6 26458883.2 48338846.6 99827065.6 24261979 20860966.1 45034533.5 4293898.7 5242917.9 17063529.4 33787893.7 21475413.5 22628880.6 103835823.3 318697188.2 83868816.1 144417580.5 32838729 13228058.7 231394645.8 493955136.6 134121486.9 98653855.6 116826196 116002396.2 63479636.4 315577847.4 128288716.3 262732163.1 68034099.9 115684775.6 117132697.3 388763749.8 180165680.6 55809226.6 9231275.3 12392185.5 130090567.5 397591943.4 81477231.1 170731035.7 58723675.3 104643554 106720815.1 234915164 122485991.3 76294588.2 206701188 97447600 78044104.8 5242164.1 27795247.5 160232184.7 616244157 139782696.5 42371623.6 109344435.3 15605414 79232053.7 7211637.2 13937866 33321574.4 15899228.4 Glutamine 70319839.2 38138338.1 35671413 32336533.4 82050138.2 42735623.9 65076726 32790143.3 25701130.7 42236002.2 46685977.2 50653907 49188906.4 63564924.5 104629004.5 41215961.8 110160830.3 62799924.3 53306930.8 116351418.6 87044710.3 44969724.6 85204379.5 86046411.7 31287564.9 30953078 6988916.4 56388895.3 69595426 65942018.3 35736125.4 30873505.4 51368177.6 29774566.5 55182313.1 36263414.4 90856496.3 24801287.5 84979698.5 51280774.3 19055636.2 81126091.2 95829526.7 49552640.8 50307860.8 48133879.7 57458984.4 70102064 34913678.9 35057191.4 31172204.8 20184890.3 26891809.8 23579816 27284132.2 28221298.1 29005317.6 68676824.7 55571383.3 121345380.3 99593333 39868300 46459894.6 96803528.3 38870228.4 33464245.1 55831544.7 78137217.4 52651948.5 92988760.4 82621564.7 40383039.1 75828128.2 42910300 25534011.7 30674122.5 32137917.8 46988648.8 45200791.1 51390276.8 44270281.3 53677204.8 67149193.5 93692710.2 86885588.8 29225636.1 60870938.5 80928178.8 65501591.3 45471469.6 64460387.5 101338841.8 47461276.5 95005377.6 46599553.4 74319427.3 29480678.3 79582637.7 61458979.2 27877815 30503727.4 21689191.1 15808985.6 27426663.6 32328460.3 43132569.1 34250972.8 63326034.7 68273239.5 44977773.9 70732990.9 56633441.4 78084680.1 56714104.5 26218183.2 78521121 83085568.9 79002346.2 65031697.8 24419274 34602439.7 49200695.5 97479389.9 78319335 63277600.7 29732927.3 31320677.1 73686739.2 44086635.5 136783538.5 36748254.8 77472307.2 77564537.6 41894145.2 38573280.6 67487665.1 105776413.3 46932756.9 40088097.7 65933800 63464932.8 55969336.9 56401866.6 28770364.9 75897441 28268878.9 65647605.9 27469300.8 29600789.1 16408848.3 26305623.1 32775930.2 32281456.4 42732151.6 48227298.4 39391570.9 69391079.9 26143926 76933914 73486142.5 142705363.9 83330062.5 90702868.4 56718907 34979415.1 34265765.2 80740071.7 60418867.6 79903346.9 24220606.8 49281375.9 61955348.8 116624446.2 48284460.4 55091352.5 16369703.1 32215660.6 47483766.4 43604277.4 56887794.2 60930258.5 42034428.6 62446624 41784513.8 104853913.1 36791238.3 67616693.6 63202023.5 39750737.5 79684220.9 28885246.1 45260973 83865461.9 83317260.6 63547990 84662237.1 41380755.4 58727800.7 52602020.7 12647472.9 33677842.7 28109389.6 65400590.1 Lysine 1159603.1 2111653 339889.4 354834.3 317430.1 257875.6 500110.6 353224.2 400450.9 480979.7 380281.1 2132610.6 362226.9 409778.6 453005.7 564265.1 270369.7 371841.1 296741.2 319896 325090.7 356902.9 300947.4 333286.2 395243.6 296580 443744.4 467954.8 280639.8 365404.2 308335 269265.3 315122.1 311660.1 363347.4 358399.6 3797433.4 351530.2 254849.5 305399.6 282447.3 541144.8 324096.2 542225.7 450751.5 301286.7 301521.8 296149.1 384289.8 334033.7 1646778.3 3880712.7 374304.1 407314.8 414953.3 392255.8 589953.3 286753.3 361282.3 315425.7 248621.9 766156.7 291244.6 348697.7 256253.6 1320369.3 466002.4 301976.1 280186.9 772172.2 257729 286520.5 482914.5 480090.8 287217.6 257084.7 452378.2 316037.5 258275.9 654614.4 413504.9 256351 299833.4 365756 402663.8 336129.3 341148.5 290271.4 234902.9 340757.3 312882.2 294584 207892.8 355681 591210.8 529552.1 1630059.9 296606.3 1446583.5 257631.5 332285 1846288.5 4099049.4 1536440.6 712809.8 597285.6 466284.3 466234.2 458808.2 388765.1 342671.2 342934.7 341660.7 346724.5 357613.8 299709 345397.9 430953.6 345520 412743.4 343239.5 557356.6 353057.6 403377.9 334451.3 377287.3 389272 395321.3 728806.6 352831.3 355900 393436.1 347113.4 483822.8 399275.2 386873.4 347827.2 506856.8 327954.9 351855.5 358498.2 291266 191384.5 421995.6 355704.4 348514.4 774442.2 371182.2 380515.3 2409215.4 3478703.3 383921.2 361397.2 441026.6 660353.4 331657.1 328114.7 342184.6 351104.9 328268.2 362823.3 281394.4 487724.7 288896.9 383787.1 462455.1 336638 275179.7 280294.8 360141.3 516361.1 448796 715074.2 580569.2 205548.1 475825.1 338010.1 313369.8 472990.9 320497.4 378564.1 372229.1 410585.2 201334.9 243794.9 264417 427942.9 432037.2 309170.4 276215.7 308445.6 382309.8 318704.8 1849334.3 456045.4 322129.6 512150.6 411015.3 297399.4 869104.4 320005 2720624.8 676834.3 Glutamic acid 33707308.5 105407332.5 53332169.6 45124985.2 20971663.1 22427538.3 24441451 17313961.9 18517068.6 22700169.1 20723319.6 19318258.1 25064587.6 59673731.7 111393963.2 28127995.6 32244598.6 37823766.3 22200258.6 22349256.9 25862961.5 39314342.7 24010687.1 20184095.4 47141304.6 19826171 4438095.2 20659620.4 34310027.2 25614264.9 18736099.5 31064693.2 19387112.8 20511774.1 21782002.2 16649107.2 27949196.6 18621472.1 31604146.6 21471009.4 14268184 43754023 19655664.8 22080969.3 19365710.7 35750420.9 23425768.7 27145835.9 41979841.6 57968577.7 99655989.5 89947795.2 99596725.6 68461460.3 15360628.7 23318296.7 22389622.3 28332415.3 28994648.4 28405832.7 36485197.1 22109530.9 34531145 23627961.9 12090333.6 34819342.2 7164745.7 30787702.5 30001624.7 25030929.8 22340163.8 27718006.8 11942843.1 17077805.2 24414286.3 74862703.1 61997124.9 15054303.4 31701118.3 28631303.9 23596808.8 2671920.2 27314495.8 8539824.5 25584375.6 32873871.8 32720621.1 55807539.3 25781904.3 3667624.1 31650079.2 11565495.4 21361127.3 38425672.4 15785343.8 23264897.3 20880871 37787631.4 20041838.9 44729003.2 52471895.3 76871107.5 95689006.3 81359146.9 78723298.4 19882052.4 16239359.3 40577747.7 26114035.4 32933169 32234220.6 21860479.7 15682775.4 28834452.5 14867191.1 29695838.4 28879333.3 41976388 31231758.4 22801022.8 24974821.1 36122238 6820317.9 13310531.8 61852083.1 56934296 60915265.8 35757960.7 20496140.7 21239012.9 25145752.9 19264747.2 32197167.7 22490706.5 26365029.2 7789929.7 19493844.8 20452266.5 26413477 22270803.2 16843308.7 21421813.7 23835876.2 7437186.3 13630756.1 3038303.5 33936536 48357780.3 46478532.2 87247070.8 94980267.3 74459579.8 82942436.2 29139539.7 29151972.6 16711512.8 42168923.1 8933038.8 25500061.6 28037327.4 16489565.6 34137890.5 20072143.6 23239619.5 39045374.9 15046110.3 26869666.1 11730468.1 39309909.1 20017279.4 32562266.3 30503947.6 24340474 30696318 32245014.1 7934587.9 53269825.7 19375293.6 22319619.1 28410975.2 18900506.9 26706002.3 38366649.6 21881949.1 30097755.5 17815207.5 26902911.1 32994744.3 21031246.7 18627359.7 30893224.9 23782555.9 19154300.7 52499274.9 33367453.9 11849294.3 19509296.7 18911369.8 25399881.6 3826083.6 53538556.9 120541420 34642720 Citramalic acid 16570172.1 20143754.1 85397524.9 78873421.8 68758254 59851480.1 78059201.1 76621827.8 53856052.3 85843009.2 107957048.6 56703773.1 76472415.6 303909949.4 461092570.1 54844788.9 81092718.2 118671643.3 95034372.5 180412091.2 118636413.8 220495771.5 65818076.3 48464200.6 80907198.4 80650899.3 18051279.8 115639307 127078959.8 117326668.8 81588784.6 64892303 63538369.6 87520485.9 68570481.7 94292877.9 97934065.6 55732207.1 124056091.7 67344360.5 66056385.6 194822504.4 69858941.1 52742073.8 57393315.7 187674566.3 57845084.5 101678236.3 69642317.6 71580404 17362401.5 2620998 88563343.4 102897969.7 74197175.7 55838231.3 47149031 63525464.8 106369109.3 123547532.7 56979970.6 500156656.4 120470736.9 160150579.5 44633840 106552661.6 74599321.3 62264989.2 42008747.8 152084700 129481618.1 54162428.8 49931222.5 70576828.9 177123297.6 77198260.7 77639442.2 92374018.9 60537928.6 62754569.7 45653759.1 70300757.3 92072344.9 184538408.1 64704691.4 74875211.1 63089289.4 101517330.8 111851113.6 25085690.1 115455633 67783080.9 135194579.5 105740264.4 81285907.6 217590054.5 73119367.7 127800824.6 118546911.5 57356280.8 59355855 1345446.1 0 140599992.1 96969192.2 62981612.2 77384675.3 294941584.9 49838953 166585045.2 84420383.1 74444316.9 103929927.8 213187451.6 109173762.1 198035628.7 265433036.5 261391152.7 121283989.4 154436216.9 98238838 152756693.8 41855543.7 102081335.3 164678423.2 71846975 71039572.9 47575726.3 33549639.6 70497225 45851195.5 97386282.4 51127204.7 75267284.4 114886434.3 48957358.1 111281732.5 108789812.3 111565751.2 20070872 66165558.5 73255734.7 20147818.2 51605471.9 36403467.7 6578389.6 79779227.3 61111371.9 62047283.4 0 0 123847852.8 118648271.1 125526892.2 81418708.3 52790252.7 280736889.9 12759301.1 82575130.8 142179415.4 180651214.9 100541262 106960443.7 150144717.8 53856911.2 59353906.6 108266832 75554099 308480310.3 51428032.5 86102678.3 39114660.6 146754441.6 133119526.1 118494040 0 65176447.5 52669433.7 122274623.1 50478970.4 109787694.4 78048994.9 50662059 109269579.7 156664239.2 106243565 43695898.7 149094731 49271591.1 66593856 31430115.1 91003982 82071530.2 313287775.6 110636762.2 48321392.9 122857657.6 95262958.4 88443822 0 73115212 0 0 Mevalonic acid 0 0 213521146.8 209379543.4 71292694.8 77792443.2 201250050.2 12009141.1 0 59274198.4 22736100 28486810.8 18225923.5 126406225.8 205867110.3 81489458 174491871.8 98721298 73049433.7 144971170.8 62139163 75014961.5 52697460.4 35886052.3 194871528.4 8246169.7 0 74492876.8 91274184.5 47144518.5 54276313.1 116474857.6 50107854.6 34364804.4 34475677.8 47331644.1 172726726.1 16367537.5 321120067 18454899.5 11864591.8 83293079 16246510 17663473.2 11596107.3 74948987.5 45134952.8 33679716.2 196375255.8 205601915.8 0 0 224014911.3 187805696.6 63311887.8 0 0 45805175.5 47107502 55569120.2 91427970.9 321831676.4 69504284.2 64038281 41834400.5 47231075.9 104257278.2 69498560.4 200673154.1 33437757.3 80912009 0 60683274.4 21946728.1 26577695.5 217959781.3 217565317.1 89768212.1 30905017.4 13107660 0 62721086 130220448.3 57780034.1 63646902.5 29358714.8 48264180.4 76279161.8 97812646.2 0 52849982.1 9952722.6 28526568.1 198482059.5 0 0 70572740.6 184400132.6 143824438.1 190221881.5 185788247.8 0 0 206680234.9 209599514.7 0 54672218.3 124438122.9 20385660.4 38338248.1 21733918 32301067.4 76300673.2 57978101.6 22005693.3 332636291 61828491.4 61847875.8 88448661.7 5307103.4 4510257.3 134333246.8 2098699.4 77451964.8 107274325.2 204089883.3 219944263.3 70175744.2 14881910.6 100159137.6 17784719.5 108374038.1 33579190.2 21960527 76214180 24268295.7 99860115.3 98484842.2 70184240.1 13804361.8 83601665.5 75134025.2 40365588.6 5579460.8 51822020 33949184 233920918.2 182301782.7 183060213.8 0 22586549.9 120713537.6 124310794.5 195295460.7 49836919.7 38769941.7 275888791 39649542.6 53768250.8 64949648.7 62140232.2 46953871.4 57912712.2 135624581 80775586.8 97746227.4 64222172.2 59488159.8 112736615 28097433.3 73189940.4 43339985 64048127.4 120864960 597795043.2 69967182.3 112559589.8 44625333.5 49365947.6 46537175.7 51901866.3 35710145.8 37990831.7 57835841.3 73815276.4 76781648.8 79805645.7 78873972.5 181374483.1 43199262.3 37764051.8 59639802 47052622.5 61710401.9 53513556.1 51987302 56703086.5 51125367.8 52857445 23653960.2 114288953.9 25113272.5 24418838.6 Xanthine 7550662.4 3326210.5 47503769.3 49225997 137796297.4 141385251.3 20788181.1 54262652.4 98055009.7 101975944.4 95999148.8 44797570 65728756.5 64111594.7 69174850.4 91748543.5 66488700 56411675.6 60014866.5 47837839.9 35087379.4 131627576.2 62230037.6 31188690.9 48091618 56006915.6 4671644.7 54387213.9 87127109.8 188850498.3 74756345.5 45724816.9 56826437.6 37169865.1 25161568.8 81618841.9 104721443.5 66317527.7 40410048.5 85694998.7 65507302.3 93713148.9 139798371.4 18655361.4 94023026.1 58451892.7 119359262.3 100547195.8 51626742.4 55435742.8 3253677 0 37903206.9 36663425.9 15213471.9 67383722.4 63143054.8 92665192.2 40520100.7 154558561 96888604 70383021.5 118484586.4 126971701.2 35145916.8 86822364.5 70452737.1 99290010.3 42668541.5 53445852.4 32566049.8 19313633.2 40943937.1 74313826.8 74611609.2 40294632.8 41402520.5 52427650.8 82999632.3 40703042 34793659.1 43743121.2 65512632.4 57868678.2 118304228.7 20206973.7 62340547 152653260.4 74269377.3 53532116.8 95016045.3 67858616.4 102283353.4 203561576.8 119807948 73477980.2 59857817.8 88799263.1 79962919.8 49863059.6 50077375.3 0 0 44182729.5 44574709.1 151013717.8 9913882.2 94308424.5 34266729.9 113054435.6 79875681.7 86933493.2 98684772.1 87477538 19801096 51250110.4 45986093.8 88451666.5 81140129.6 102748775.4 33359326.4 35143239.3 124216870.8 110191731 95770585.5 49409493.2 53800046.9 62490530 62876849.6 109556712.6 86181809.9 91662060.5 42883894.1 39695056.3 66124482.8 182939877.7 107826487.2 37976437.4 32217326 121968899.2 64946073.8 91667608.3 104103185.4 42169223.1 36611685.9 38222312 10623052.5 51043304.7 49033291.7 0 8001771.1 46496219.3 46454107.6 29859604 62972226.3 75580614.7 34522878.2 43252643.2 78087734.5 120955053.3 55156124.3 99417815.9 28415337.1 43993515 65800147.4 27468956 64424387.8 99939280.3 93107528.1 65652412.6 128835964.4 148267496.6 56436025.8 31027144.4 74059114.6 18114382.1 50671200.9 63038294.5 53075302.3 114315732.8 58555430.5 77814120 63590620.9 104517891 104030827.2 37292666.7 43722426.9 88093079.9 71880257.5 168831723 67894058.4 37131013.1 134746338.2 47178729.5 179649990.6 116536482.4 88209853 68766116.7 44249583 9075694.7 51533738.2 8831290 7849051.7 3-Hydroxyanthranilic acid 0 0 17115563.8 15428264.8 31133666.1 46208168.8 61260899.7 7735021.6 5639172.1 5730068.7 57850070.4 66419915.7 21741248.8 16286411.5 39734479.1 15406960 32562399 42008589.7 61623018.9 31166402.8 43466506.6 42109647.9 13563875.8 27897390.8 13556679 32271776.6 0 34850054.7 23847920.8 12096037.4 54988592.4 23547179 43466600.4 3695951.3 19503129.4 13142027.6 75695437.9 53910584.1 91699074.9 23781076.4 9273138.3 14430643 20093998.7 22456769.8 20970898.7 23829057.1 16734327.4 8264742.3 15277241.4 14420663.7 0 428884.4 15119677 13342355.9 16331966.7 5021572.1 5557761.6 14433567.9 11266555.2 84605712.1 27662216.2 51259342.7 78958531.3 22408117.7 47482168.8 71652966 20776251 37068888 8847201.4 13050367.8 19192451.2 10478026.7 51646241.4 26777228.4 18845012.5 13750173.1 13915283.7 20267584.5 33630732.3 44911686.2 10390791 36489728.4 15706104.4 41480157.4 70982880.7 12417276.6 18133809 31489212.4 30423015.1 7789917.8 47445683.7 19145703 8636994.2 14934487.2 13189960.3 53761823.1 82135585.4 24737681.9 13194854.9 12273301.4 12613222 783256 595767 14591396.3 23433513.1 63341303.5 72325533.8 22970241.8 12287977.8 12320802.5 9408508.2 40046768.8 27736953.9 31050263.6 56428011.7 39887174.1 22509572.7 32603977 24448072.3 45790223.3 4628543.8 3232500.5 16666076.8 29346629.3 37433293.4 15293667.3 17785614.1 38041188.8 15756518 22286374.9 19035206 55420074.2 21670256.3 11270723.9 8496422.3 100155453.1 64263715.5 87640606 35601021.8 12988319.3 19042146.1 17498668.2 21752879.7 15998107.3 12138462.8 15721457.2 12121265.8 14778456.5 14163067.1 797056 1699811.1 20957169 18366001.6 14828031.4 22255035.2 25791239.4 23595842.3 7868320.5 15512528.7 11256265.6 21713814.8 11219572.3 77182424 16423378 18759641.9 29137100.7 12617920.2 60002259 36725545.1 8218407.3 53206950.6 40282614.2 62780504.3 107067251.1 17179183.1 3006646.7 17411255.7 50794407.7 19605283.3 22435341 12501710.1 11711684.8 11586266.4 38746680.9 24977513.4 40111202.8 46942955.9 37163935.7 28879534 18988273.6 4379265.9 8537279.4 36334880.9 33442526.1 67603585.1 11319881.3 43921381.1 26048064.3 15729710.3 2301041.2 18134565.5 1718432 1738551.8 Dopamine 0 0 0 0 4906580.2 6943441.3 0 3384265.2 2643805.6 5063375.2 5007880.9 4222154 0 0 0 6449535.5 0 11446174.4 5563535.8 0 0 3404218.4 11188022.8 0 0 3500940.9 1886526 2992944 5085177.1 4210139 14802194 0 5779415.7 11317340.9 0 3155053.3 19309212 4566170 27317445.2 6251398.9 3566617.3 14528289.9 4282765.5 0 5625073.2 14708290.5 4027172 16648442.7 13325423.9 10474638.1 0 0 12402928.6 7767036.1 3765469 6607773 3269144.9 4469509.6 7280677.5 6991860.5 5970434.2 15263241.3 7793226.1 17448330.6 15014315.3 10627617.9 12819680.1 23595212.2 8569265.1 4042853.4 24847119.9 5428784.5 5447375.1 3236661.4 5858291.9 5963316.5 8055691 16774537.4 4383648.1 1609207.1 5138437.3 8444172.6 6408412.5 18304575.7 5170240.1 1568548.2 7647947.3 10247333.5 3896121.4 0 4821321.7 15468589.3 2672017.8 13072693.3 4311906 4137405.4 17631188.3 8126160.3 4719833.6 4228032.4 6068952.7 0 0 0 0 11385282.7 0 9836158.8 8620465.4 4560730 7410887.3 5081829.6 8387609.3 4164831.9 5378133.2 0 15812329.1 3757328.5 5619638.3 3451462.7 4000998.4 6503681.8 8556502.6 15675663.6 0 6058202 9160422.7 10394490.8 8342268.9 35732751.2 8290793.3 4600855 7462874.9 3750141.1 5452487.8 13898001.1 11125158.9 4372419.3 6023733.7 7340352.6 10203623.3 24810514.8 5458204.5 5116029.5 4478445.1 4792734.1 5443688.2 9100073.5 3958111.5 1141793.7 0 8529889.1 12508861.7 7865780 11374448.4 7484940.7 9090602.7 4262663.7 6338332 10493627.5 13431209.3 26417616.8 21994468.3 2299800.4 5635588.7 4640259 8368867.6 6596249.4 20193262.3 4971063.2 2340110.9 6914583.6 9538677.8 6511570.6 5957076.2 0 10126406.3 3626615.4 6716358.5 3260077.3 3902817.2 7179857.8 7757942.8 4500046.9 21886225.2 4937375.7 6329820.8 7847806.6 3597759.7 17254623.1 6927229.7 8318839.8 17932292.4 13386493 6392631.7 5926070.8 5534488.4 6525143.4 917516.5 411684.6 2103392.9 0 0 Histidine 25862582 25132492.2 43117591.2 43052103.1 63370175.3 75887297 80832292.1 23101145.2 15133241.5 65076084.7 24404291.4 72685274.2 26047234.2 115815140 74169842.8 37472402.9 36737314 83922281.7 45568372.5 62402717.9 20833437.3 25029316.2 85227496.6 52233902.4 48178377.2 41655953.6 7996179.9 59516952.6 43055609.5 41587497.1 46464540 65129610.6 86272488.7 19974488 97996225.8 17668295.4 110401599.3 77499131.2 93489845 37541516.3 15933739.2 106031944.3 43180583.1 76414739.4 52433860.5 118383829 60827790.6 29936136.9 36688087.3 39636426.2 23086386.6 12468957 41842688.6 44112434.6 50335805.4 23050358 59985292 98602937 31705358.2 41651757.3 106169796 20605865.6 46461203.6 46657839.4 34364678.5 44922235.2 36061783.1 68869644.1 62543961.5 74898386.3 15645882.4 86378668.3 82279447.3 28844261.1 53736875.7 39573242.1 41928187.6 22055911.7 79800452.1 90717750.5 111682339.2 29451596.8 65984643.6 5831664.4 82435969.3 26664031.9 66917872.7 98262951.7 42817778.3 73221353.1 35691140.2 34002954.1 67751211.5 52322225.4 49945691.1 27328347.6 47560180.5 71181717 136715618.2 32894025.6 35199566.9 16239808.6 19333270.9 48916173.6 46321113 38618845.8 38625679.1 71381475.8 50363289 29757660.1 41252176.5 56809665 40749086.3 16326228.9 56745195 61380995 20545380.2 109111584.5 15726373.4 19012089.8 57703988.2 95478082.2 28717516.4 31571465.5 50065321.1 45996015.1 49478220.5 80024157.3 35468738.5 126992510.1 3165955.4 49282633.5 95042144.2 58602818.8 61303326.9 47924441.3 64705527.1 31775134.4 43914184.5 60934341.9 70927808.4 103886593.7 44526187.3 13814474.4 83744417.1 72100689.6 106980533.2 42631328.9 46041582.9 22675219.5 30712557.2 53944555.4 56491378.9 25126408.6 77018044.1 62182681.5 53654405.5 59974727.5 70414610.4 38475467.5 22448126.2 29872769.7 115987270.5 24024132.8 35504714.5 22865199.7 82388525.5 27905913.6 41516748.4 62604987.5 57740091.3 66815809.1 48570960.9 94287566.2 47891363 15873692.6 40969900.4 40604840.1 50200967.2 44342502.3 20393473.5 47290539.6 66125746.4 43603209.7 70484742.1 23209165.1 122765370.1 37999073.8 32091954.9 43010061.5 46863867.3 57543038.6 35807703.8 165016429 69382935.2 19978559.7 72944000 76943140.8 84394230.4 15126515.4 44386672.4 31662557.7 31805262.2 Indoleacetaldehyde 5430604.6 1946191.8 652125.8 938927.9 203570.2 603244.7 178486.9 613799.5 1052951.9 902861.1 312126.5 858780.1 1319380.8 2036381.8 1895453.9 887680.2 1098233.5 172457.5 840070.4 2273728.8 1230744.3 1166769.4 425551.7 1044117 910183.7 1076706.6 1489246.1 1362897.5 999637.1 877089 1173179.4 993802 1647568.3 0 267376.8 1073189.3 1095651.7 233638.3 2197791.8 1314769.7 1835158.9 1888791.4 1079748.6 729465.1 871268.2 1179741.5 180669.8 1405676.6 872166.4 858820.2 1409157.6 3149338.4 556286.3 493479.9 768512.5 268300.5 648272.7 1382253.1 806071.4 1168426.8 1063504.4 714329.6 1261643.5 1470294 776189.2 330847.8 1144352.1 1184957.9 722613.5 491495.6 1446278.2 343514.7 768024.7 1330172.5 253099.6 673938.9 205848.1 1402008.1 853194.9 573845.5 453910.8 2227921.7 1231561.3 1161459.5 885720.4 1192052.6 1246110.3 227617.6 1409581.2 1628032.2 1163926.6 1742204 2868440.8 243418.5 1329798.4 1242701.4 1069273.1 3101878.2 1074853.3 642098.2 1034311.4 4124433 2400822.3 418666.4 736451.2 933522.9 736859.5 2945587.4 629327.5 1012909.6 1428387 821144.5 3095853.7 1600334.5 422336.2 2772375.3 395232 391539.7 1299014.1 1123273.3 670703.4 317401 862588.1 1778098.6 2244165.2 739028.9 788948.1 1447375.5 717326.2 872517.8 625036.1 2511452.1 1487872.6 629981.8 835946.5 1432520.4 1125919.8 1896230.4 134969.9 591324.6 1368990.6 121178.7 1464223.9 624346.8 166925 489775 592376 895699.5 740994.1 3539672.7 1879937.2 728419.3 551899.3 1012761.9 271219.6 715665.9 1963450.8 439676.3 741387.9 1089005.8 2509403.1 1294806.7 721168.1 3431983.4 647810.4 698579.2 702199.8 783435.2 1575533.5 315359.8 1042682.4 727942.4 1351079.6 2683387.3 1420615.7 951290.4 716542.2 854530.7 999383.7 691898.3 726120.2 661489.4 537027.3 2786439.2 653060 4377550.8 847548.3 1393630.4 1033063.7 1246623.5 796243.6 719258.1 1187357.3 1069008 977048 798832.8 1099982.4 605855.7 682388.4 740013 643360.2 1480288.8 3225587.6 Oxoadipic acid 3096025.1 3093875.6 17682055.3 17870337.5 15977547.4 15348722.5 20561455.1 11148230.1 13942768.5 11823629.1 18460995.1 12034062 19791244.2 23135537.4 74249351.2 13455208.8 19989859.4 21410028.5 22303991.1 40215009.4 18406513.7 41479461.1 9505221.3 10054400.9 18852341.5 16447581.3 3883143 25179709.2 25667262 17309887.9 13737391.1 16878954.5 24798312.6 22459082.8 6990939.1 16573975.1 20142491 13136148.9 30393247.3 15930115.8 20513960.8 28368697.3 13821694.2 8927872.3 10940515.1 18183762 12304450.3 15776293.2 19671792.4 19086601.1 2860280.7 0 19881844 20739814.7 6763524.9 4646772.4 4917647.6 15789293.3 20033083.2 35279067.2 12975715.5 51058052 19476409.3 42876412.7 9327899.5 18294789.4 24717619.3 9265091.8 6606467.7 26858302.5 27284801.9 11953417.8 23932714.7 9477506.3 20140224.8 22944204.6 24299445.3 21633733.2 17761153.5 18490721 0 26993632.2 16974300.8 20816515.7 9123068 8189069.3 25237192.7 13040871.6 25241436.2 4735871.8 24004143.2 9869732 26029800.2 23158552 11745748 23382820.8 28231221.8 30798120.3 9124513.7 23894470.3 23590312.5 0 0 21324429.5 22364304.9 15576992.6 22016107.1 41911600.1 5431129.7 18319906.1 25289475.3 19871922.7 23499676.3 26997035.6 32667786.4 46701032.5 36858943.5 44116779.9 20065049.6 17667776.7 20988739.6 16117234.5 10596436.6 16933013.7 20241793.4 20789799.9 24210544.8 14353630.7 8758863.9 13465897.8 8200389.8 30236195.6 12454771.3 17385072.8 5358450.1 10293093.6 14614819.3 28640951.4 25911739.6 9283902.3 16930180.7 10003629 8410329.5 1003269.5 5157966.8 7795142.2 19799700.4 20680536.5 18530643.2 0 1203739.5 20773559.3 22430239.9 22248477.1 21535198.3 14488269.3 28353629.3 2492317.3 6549444.4 21404472.2 22487413.6 13396616 29864736 31658302.5 6874168.9 19832018.7 25774970.7 17198783 32644756.4 10210470.6 23104076.4 8629985.6 24479766 38178097 19462747.5 3613262.4 21945343.2 20229814 32921955.5 8846518.4 11805837.5 13126431.2 11641266.5 19450325.5 32781755.2 28573607.1 17843023.3 25250518.8 16485483.6 9270354.1 4606169.1 13289610.2 10240249.1 55141158.7 18786776.3 10195681.8 27246244.6 8544731 9081393.7 2407100 22249527.4 1230531.9 1276850.6 Pimelic acid 3113520.5 3037399.9 65348788.8 66887727.5 58981273 33793782.2 229708617.1 77579239.2 17071401.7 22511429.2 128548317.5 108007111.8 120595198.7 376659225.5 433185548 88367786.2 60313671.9 234539629.8 98690526.6 767837645 182508174.4 238644135.7 17153967.7 19910595.4 60867634.9 92463266.7 4853618 238990324.2 143348366.3 107404552.4 140904299.8 27650973.6 35502532 320204914.9 12280880.6 299101392.7 139505004.1 21595074.7 166618891.8 119599689.5 99578099.1 125632154.9 90128914.1 12813426.5 38098949.7 295552759.7 34037866.2 158893534.7 62456489 59853513.6 4828633 0 91288984.9 81049420.8 4483195.5 28015053.1 6197322.5 45660496.8 155373490.1 358112435.3 70570404.1 415055952.1 215973802 419390473.4 19926776.3 50954196.6 155241372.3 40945131 11412021.1 75334260.6 617606562.8 4825136.3 49647482.8 121247246.2 290291857.6 85232116.2 86124615.5 173770459 52016477.9 72069783.5 0 320962207.9 244065981.5 254402425.2 23509925.3 167911078.6 91214983.3 87389306.8 85477017.4 0 286163437.2 76129782.6 139659090.8 227474162.6 33575898.9 66024020.2 12575160.4 182423864 49295925.2 67803517.7 70164487.9 0 0 60523721.6 58748475.2 66649997.8 216487023.1 349944228.4 40892555.5 303645002.1 144579800.2 75604238 503914765 257465776.3 118943929.8 286871948.5 322283495.1 209902391.2 134745896 52437964.4 54012854.5 24279111.3 74195346.4 172376202.5 231154548.8 57051462.8 57668120.1 116798371.9 2504272.7 3346857.2 4334641.3 329465718 131839836 44506340.2 33388644.5 61838586.4 206046073.6 561092266.1 124159340.6 0 176526262.8 0 67457747.9 199349981.7 0 0 0 52074746.3 49977197.5 0 14146415.3 78666146.3 76777408.4 430983414.9 68031032 65365241.1 232575051.4 13288053.9 35527893.5 293837672.2 406035690.3 185383528.9 32645110.4 733867656.3 29195687.5 52219767.8 43005161.1 92174466.4 297423675 15870801.4 292639691.9 40167879.7 262037276.8 214869199 111872116.9 19848934.9 67442409.3 116136619.4 195648673.5 40091316.2 140148496.2 26556538 27643660.2 183332712.1 98352939.4 294172031.8 35709330.4 308795731.9 116238964.4 51745579.7 23706483.5 19222428.4 168109848.7 86278674 125277732.3 91345811.8 47581842.7 75519357.9 33390943.6 12994006.4 67095346.4 14257274.2 14189874.4 Aminoadipic acid 13649823.2 13971165.3 51466220.1 46313561.1 47472813 46600450.6 53205679.7 31342755.6 35169334.6 44629132.4 40174475.8 42269688.5 38423977.8 96452443.5 229192345.8 50160213.2 59394805.5 54009334.2 46082425.9 92030324.3 39197574.2 56342836.9 55178913.7 43678799.8 51597879.2 34802055.1 15527322.9 64582674.2 87013934.2 50165358.7 37094238.4 48494545.3 35670212.6 35628693.9 39074101.2 37807331.7 78206897.5 35187341.6 66867527 53954515 34176586.1 64805489.8 59595582.2 42013418.5 37509781 61835189 56436627.7 45044524.9 49488471.1 50528030.5 13954658.9 0 58843437.1 55173759.3 31065914.2 20926321.5 48225806.5 61668960.1 44917562.8 150511450.7 104748327.7 49269635.3 66720077.9 54002658.6 13466096.8 49185399.1 42286174.6 95367602.6 56118111.9 42438650 47500998.2 33732257.9 42383676.6 64689958.7 29987744.9 58116531 53351079.1 36006301.1 46517802.7 53871243.6 26141595.4 50639312.2 53202873.1 38405722.9 72662635.7 40947604.1 79239997.6 104472286 45776217.6 11920652.7 44790450 52324188.9 37864098.7 100997639.2 29908263.9 25981126.4 36271027.1 80600840.1 91149241.6 45370327.6 48381003.3 0 0 61153902.9 48163415.8 22159547.5 37093066 86301935.3 46261979.3 51854795.7 27729521.6 48084369 93068573.2 33454501.2 31350521 53119354.8 63994492.5 71433438.3 38321082.6 28167603 90734730.7 55321231.7 37858419 57122905.9 73036825.8 60913555.6 65180606.1 75556499.1 24270794 77833885.9 50897486 99391914.9 112656054.7 44228468.3 44334461.9 36319482 77151474.9 63191084.7 49144708.1 75597712.2 74748311.9 42995992.1 45610830.6 18236426.4 42685334.7 0 52465314 50725921.6 50402739.5 0 800451.2 58076715.3 57130453.6 61380908.3 67975519.4 41681381.8 81185231.2 24828633.5 53969635.2 110882639.3 77674980.7 70824894 54095792.2 94456873.3 54843426.6 33641525 46680423.7 47656113.2 77847463.2 26533495 65086179.1 57331657.3 46235900.9 62689718.3 47545985.6 11591375.7 49447052.4 49394804.8 44772095.2 35129064.6 168859488.7 53575291 43369895.8 49771477 65743976.3 29897023.1 45942465 113058441.4 41888392.1 29519391.1 16228590.9 23444295.6 66692576.1 65085234.3 79128511.8 27585545.7 33349362.8 40682952.2 37794949.5 2019885.4 51724763.5 1216494 452130.4 Tryptophanol 0 0 5512133 2571907.8 0 0 14375080.8 0 0 6183786.5 0 0 0 0 0 0 0 0 0 0 0 0 5588914.9 5509101.3 21376942.7 0 0 0 0 5092080 0 0 0 0 4224285.3 0 0 0 0 0 0 0 7935902.2 0 0 0 0 0 0 3462978.6 0 0 0 15115160.3 0 0 3445597 0 6736744.9 7198745.1 11591734.6 29738193.4 0 3124458.6 3299337.5 0 6742102.9 10740906.5 0 0 8729111.3 0 0 0 0 0 0 5923272.9 10119643.6 0 3737759.5 9854490.2 0 10032147.7 6071868.2 0 2672369.6 6248318.2 4025985.1 4479869.1 5780994.7 9370198.5 0 0 0 3118194.4 0 7389452 0 0 11914851 0 0 0 0 0 0 7839338 0 6312342.3 0 14139625.7 6592252.6 8557652.5 0 4845729.5 5368062.5 5073405.7 9755218.8 0 0 0 0 7199328.8 0 0 7136393 0 16295618.9 32196883.8 0 10302523.7 9975102 4112709.2 6853758.1 6235756.5 10914461.4 7764990.5 3890970.8 0 4559911.4 0 5617423.8 3805508.5 0 2947583.9 0 0 0 0 0 0 0 19927349.7 0 0 8403005.2 0 0 8767536.3 0 7084027.9 0 7701053.4 0 13890311.3 0 14255698.7 10251576.8 0 0 0 0 0 3690169.5 629852.4 6806331.5 4800852.3 0 7740206.5 16978812.4 448195 5578138.2 5901516.1 0 8349502.4 4705964.6 9096009.8 7441591.3 4111074.1 5248878.2 2794036 26146858.9 5217005.6 0 3373491.4 6430558.2 6742668.8 0 0 10673396.4 0 0 3-Hydroxymethylglutaric acid 20806959.1 18976218.7 83758391.3 84498378.4 56820108.2 74176148.4 107829902.4 95586858.5 32123390.7 35602181.7 50056623.5 61135872 71520917.2 219892871.4 475708670.7 60976272.6 71464282.1 152186184.3 102011809.7 181645555.2 120074676.5 129658419.3 98275583.3 47114655.7 82058188.4 70074058.1 18079663.6 113131235.2 133540434 81776698.9 72097459.7 57127225.2 81245025.5 100827585.6 77264516.1 83086736.1 138514691.4 67017518.2 323629396.6 70994859.2 50429977.6 106245881.3 59111828.6 41970158.4 48154797.9 119876369.9 61006373.2 86373739.4 81663187.8 80909870.5 19802815.5 0 119184458.9 109835740.7 22471770.7 1905760.2 15264556.5 75629764.6 106995808.9 217263211.9 76190096.4 328702911.4 188236090.8 240722034.9 163034176 75175862.1 62105148 61331299.1 26419621.3 66259241.8 143307969.9 20884180.7 63294341.3 79115632.2 82098182.2 110758833.9 115649469.4 128740402.7 55116753.6 82549811.2 0 103947869.5 182435253.3 69156735.4 34452436.1 69726648.5 96065505.2 86371963.6 156534847.5 0 135809113.7 41586225 112324665.6 204164691.6 46248669.1 31259088.2 46079814.9 173844452.8 133889244.4 87387037 88225937.6 0 0 102302675.3 113713775 26683899 243980190.3 245470239.5 27141026.8 109430339.3 116883462.1 40393885.9 166973924.2 142284208.4 86062057.5 174047827.6 153974738.4 144027046.9 112446244.5 40721284.2 52898533.5 63102812.9 47219177.6 131494772 187468006.9 92537375.1 104918905.1 51842029.8 48850546.2 123391137.1 21571731.8 345636577.1 81743155.3 51894002.3 40045361.2 28745718.4 96709607.6 137679422.5 127198200.4 3187543.1 122740297.6 52920040.7 61148738.5 33560062.9 47249177.2 23045510 53530899.9 83930964.9 85333748 0 5075417.2 101806516.2 103717322 213591508.4 68908750.7 56818994.8 179086140.5 3593623.4 39374820.4 211823645.6 185090115.2 80191599.3 47166769.2 330312343.3 34680659.1 64596440.9 46396945 102407145.9 313835458.1 16956889.6 192975397.2 43224485.3 135777186.6 143482656.8 119527013.8 23596925.8 80654789.1 101988671.6 87757715.2 33339799.3 46551925.6 28182810.9 47467684.7 117526352.9 114625991.4 173423112.4 44538336.6 165822872.6 89648949.6 73832120.4 18715081.3 21290565.6 116539814 114729979.7 116293773.2 74116238.3 136801320.5 55173483.5 34328341.1 2104193.3 89629719.8 4559069.9 6692823.3 Phenylalanine 28250699.7 41833728.9 9658312 8185419.3 28969889.5 17022120.6 19004443.7 5081065.3 6487113.9 16423053.2 11791930.1 16043014.8 11612759.7 22688407.3 21922852.7 10916415.2 21396159.4 22521824.5 16011537.8 21985674.4 12965276.9 15564639.1 15388331 11850309.8 9735306.5 5772713.8 1315353.5 19645578 18048142.5 18108014.6 11715218.5 47291880.2 9599039.8 5631303.5 11977919.3 8288224.8 30822214.4 8651837.1 18607983.6 9332668.7 6241874 23660762.7 11506115.7 10049551 8889545.6 16497905.9 10869313.5 6472262.1 9280832.3 9794837.2 41969176 36549805 8332015 8340889.2 8899517.9 7634216.9 6861858.5 25235410.3 5178378.3 22021002.5 25989519 26267295.3 19957122 15677187.7 9725809.5 18647107.1 9189522.9 15072324.6 15375933.9 5219996.9 7608086.4 10141892.4 17767079.7 17228492.8 14435952.4 9786163 9155664.1 9503825.3 13845963.4 17467206.2 11713146.9 12603454.5 17397078.7 6695855.1 27783205.8 6034510.6 14394693.2 26821944.1 12197861.6 12725056.7 12130875.1 9445945.6 9182024.4 47682131.4 7816397.6 7183636.5 21566918.8 22525224.4 37785475.9 8831501.9 10151014.4 40868972.7 42022490.4 6340671.5 8369539.4 9735822 12162355 22092860.9 11319520.4 9375670 8158566.8 24604388.5 18222030.7 9572292.6 25768625.2 28230575.5 12374305.3 14229356.9 12167310.4 5210013.7 5051466.5 7095159.9 10941983 10484972.4 23137659.8 10704842.3 9352462.2 11933596.6 12825942.3 27947519 3905469.4 34082241.5 17928246.1 13423677.2 11256986.5 9495215 17737095.3 23003864.3 23870397.5 15076063.3 19143215.2 27526071.1 14471789.5 10309484.7 13110292.7 18001032.5 6621977.6 8713123 9326434.4 48129308.4 41077255 8724677.7 8839877.9 9580242.4 20946622.5 14141256.5 12355804.5 16186875.9 9544260.3 16435408.4 5196234 2488356.5 24323681.8 9853022.4 9332119 9897026 13609665 20878801 22227167.6 7197213.3 16762207.9 7996131.4 16994823.6 42200055.8 16984296.2 4330043.3 9290736.7 9166255.6 18005085.7 10779577.9 20559146.8 13153230.6 8930668.9 21888122.1 19237536.7 10262637.9 15316824.3 14680424 10624167.1 9927906.6 14787719.1 11231745.4 14030185.3 19263295 25186432.3 12620703 26920977.8 13642943.1 12636045.2 1742272.5 10210526.1 51828384.2 30561994.5 6-Methylmercaptopurine 0 0 771065 739990.9 1228937.6 926900.1 1257164.6 1370308.5 1137341.3 2621878.7 2949077.1 752588.5 9244540.1 7086718.8 5189766 1100648.7 1972552.3 0 4473778.1 1985527.1 0 927218.4 589044.9 709607.5 1292076.1 847552.6 3001741.9 1125746.7 2468893.7 2592699.8 3066061.3 1571660.3 734785 2375984.8 246871.9 769698.4 2961313.2 289616.2 4052056.7 721830.8 3702241.9 1899568 1520688.2 744213.4 1206845.8 3907606.4 706417.5 878699.4 1194875 460520.7 0 0 1124057 1335121.4 259189.1 562157.8 361712.7 537093.2 999426.1 3977072.1 1841464.1 6841068.5 1801187.7 2025645.7 0 0 426997.8 2502975.9 800267.7 7010938.6 1304252.6 1420913 680596.7 3609871.4 0 1056274.8 869600.3 0 2242495.2 4245165.6 0 2213581.1 5657192.2 1800522.4 1174454.1 3919601.9 2323235.9 1300985.2 2432897.5 0 5031267.4 778794.2 1211755.4 1815889.9 2914458.2 3522772.6 209041.9 3828212.5 1955217.6 490005.8 601901.6 0 0 1140095.9 1439054.4 5681767.2 11740908.1 1041909.1 1373517.2 0 1655763 1279863.9 2113707 1557993.4 2525210.3 2135675.6 1493329.8 0 1870570.7 3590329.4 1163331.8 2431639.6 853026.1 1171005.8 2394703.3 1427101.4 1078194.5 1086759.4 1086673 1690493.6 1477460.6 2143691.4 1606963.4 1085415.3 1339265.2 1358394.9 1834066.4 5131032.6 1430806.8 721671.3 3475902.3 1403609.1 1032188.3 1669858.5 0 460991.4 1145241 979822.4 933926.6 0 0 1065688.7 2805932.9 4580583.7 2489551.5 769417 1195129.3 3808910 866304 1212761.4 1772494.9 1368039.8 1092226.4 1885946.4 784262 1317757.2 3274343.2 1605352.5 9087652.8 876684 1084091.1 962871.1 1390930.6 1554370.5 0 967489 767039.3 1595629.7 1539770.7 1035024.3 1310037 858897.1 881610.6 1173744.2 1421540.3 2810072.8 1285898.7 1958307.4 3228249.6 1024703.4 0 0 1045140.9 2668237.9 1399247.7 1814603.4 9029895.6 5508962.5 1864216.2 415380.2 1212138.9 0 0 3-(2-Hydroxyphenyl)propanoic acid 10072606.1 9482708.5 59500505.6 61386382.8 58357606.9 45129522.9 14636185.2 30349636.6 12243361.6 8971344.1 42327849.7 11917793.5 37271112.1 34372233.7 17870598.2 29408839.5 63203360.2 16922572.4 95948288 21065273.7 55953449.2 368348414 13417847.1 16894290.7 57724629.9 11555927.2 5131233.6 23933492.6 14341284.5 11784692.2 34577081 48652903.7 198968615.4 19031666.8 26906486.3 21053331.6 15993668.7 71383549.7 163707519.2 12360328.5 10778800.6 30964794.5 38116498.1 40583498.2 86727129.5 18458338.5 21102756.5 44615780.8 56674610.6 55851976.9 10445990 0 114224239.2 110185733 3997077.5 51361877.3 1821414.8 14556288.1 6367431.9 3269504.3 22497830.1 236163080.3 12747023.6 28379127.5 78514641.9 24031912 12992313.7 6486589.9 11876345.2 0 3821955.3 58927015.3 37945857.7 2638501.8 11084812 121288965.4 113993538.6 28001062.3 23923823.9 7366719.2 12173301.3 176815029.6 10355380.2 37293044.9 10924089.1 3874290.6 39387293.6 7491716.9 172266743.5 3041359.8 9935478.8 13502393.1 12454637.2 47754768.8 25087001.4 16155119.2 63840605.6 75410076.5 95728200.6 100608854.3 100335087.9 2344517.6 0 69443425.3 65770168.3 14982041 35550227.9 9425753.2 0 7436968.9 4559460 37511075.3 47086176.1 25692405.2 25064232.5 29412572.9 26797545.4 37730026.5 133689044.6 235396218.7 0 0 7173485.4 12453690.4 53132310.1 75170518.7 74779136.6 152333003.8 30546032.3 96755629.6 2097853.3 33375076.6 283594373.6 0 1481193.1 42271817.5 14084594.1 60814943 29475496.4 29725903.2 57302158.7 76955161.1 29942711.2 0 26934153.9 8030772.6 19992987.6 65621539.6 65113614.2 0 7120964.7 95071512 95493360 20198867.3 39874161.1 9901593.4 29119451.6 5803057 13965139.3 6865978.3 11077271 24310211 149440938.2 72900187.1 7818189.6 92891282.2 8359662.5 29425941.3 77714611.8 1450285 67328769.8 116316288.3 18551489.4 290455848.7 8428419.9 0 88437469.9 5223203.5 109443908.8 43005990.4 123854420.6 2149039.4 5030383.8 32633404.5 31852776.7 16291244.4 10624924.7 14166753.7 8510394.8 17134754.8 23404563.3 10036721.2 13240991.9 9226316.5 60461378.1 3886635.1 154755270.6 23427136.4 6341704.8 0 84599621 10825658.8 6860054.1 Pyridoxal 0 0 7558712.4 14400065.3 11591126.4 34907917.2 5995652 8074709.6 6333582.8 8563715.9 11554906 17596571.6 4374385.1 3070742.6 21024648.2 11107990.5 17365774 19234466.1 32173102.6 5002253 7574911.2 3495983.1 14673148.6 7909619.1 6187747 5192530.3 0 9732897.1 12574961.8 11414985.9 20208782.4 12084777.3 55755879.9 10543242.2 6319756.1 6840088.8 8880749.1 13052223.6 6741155.5 12561132.2 9206329.9 16281201 8924098.3 3497281.2 5250992.7 5346771.7 13987329.3 4886172.3 6615533.4 7232479.7 0 0 5681198.1 6605372.8 6193521.8 7108129.8 3342949.5 25775004.6 13987479 10316951.1 16408202.4 17714263.9 3554339 14580441.2 15007413.1 10154037.7 0 8056915.6 7425460.6 2930399 9153692.5 13791899.5 23959016.3 2522875.9 18584939.1 7391912.2 6364424 29217685.4 17359644.6 2822778.5 1182368 9216909.2 4476677.4 8582165.8 21308741.9 3079282.9 19179705.2 5281511.9 6557018.7 52242849.5 12220776.4 11779319.4 8122542.2 26053897.2 6939149.5 8951623.1 7099022.4 4976705.3 15781179.1 6129592.6 7978054.9 0 0 7638039.7 6587244.1 6184414.5 54932486.3 5025803.9 6310149.9 11320367.8 0 13848267 7864808.5 6267424 7660986.9 8535079.5 4345942.1 8457439.1 21037835.4 5450603.9 2188565.8 6442502.8 8069861.6 5494684 4646338.9 7074580.9 9220740.8 7210515.8 20810809.5 22149353.7 20846529 11049319.9 8433122.2 10097360.9 17614343.8 6983377.5 6511191.9 26376239.3 3913699 19291127.4 6207984.6 21065613 17106347 3163368.7 12007980.4 25508156.9 6201310.2 9154871.3 10452992.3 0 2410902.5 8224366.5 8366691.2 8012747.8 9288952.1 11091392.2 7556406.7 9561188.3 26276814.5 4710587.9 14674819.5 10258141.8 8229745 9539248 5656622 15692135.5 65399963.4 12032472.8 25255507.2 6773147.1 8552309 7923260 9588521 11292702.1 15496281.3 3579333.1 8871349.9 5410524.8 7181148.2 14616419 2458659.5 5108605.5 7787441.1 32012533.9 13553001.6 15406755 7906321.1 7126464.4 8802622.7 2506064.1 8595094.7 8407142.7 2547174.1 13987842.7 8522041.5 18166595.4 10810677.7 14583110.2 3699371.4 2643500.8 9403419.1 2478109.9 2442604.3 Uric acid 356791026.9 395772894.6 1274293270 1237019178 1590124203 2332615092 2043713736 1578306032 1125078798 1051514641 2229376230 1802635614 1566560783 2577580161 2421728538 2012101519 995220012.2 2252883082 1358350072 1259336385 1369474541 2818520227 1448963788 972973621.4 1263933015 2107809227 206240130.3 1614097470 2453422821 2378430805 1971891693 725414597.5 1384315249 1921230265 1630748678 1727395965 2698187150 1775360534 1891759524 2218031781 1810793121 2322584453 1377751000 1535940467 1591306307 2575333452 1855797155 1934260813 1421041076 1421548083 345429047.3 131053308.8 1079375086 1035213924 1160401394 1185007421 1854503293 1624738465 1802805117 2897733688 2410224524 1448747207 2592032675 1953623633 903133287.7 2150360712 1545102628 1947590840 1371748038 1459862104 1456281316 1045491460 1035986646 2322333374 1862038897 1235772964 1210322416 1757974600 2109263588 2976027751 919420035.6 1501583144 1978598333 1910384613 2271814746 2032876929 1543366798 2774096209 1823031625 642942522.8 2454348232 1230765026 2106652753 1525376577 1615437569 2042201840 1334944804 1699591225 2536964433 1378091900 1361814973 120937580.8 8556856.5 1153151335 1208652561 2426548170 1810653913 1837731074 1666761716 1798861819 2209849645 2122810655 1912739542 1437990985 1987575717 2508674452 1456411931 2418316969 1625678437 2588749207 1541659695 1414031974 1912251143 2161735111 2657747929 1232958274 1395527779 1957527573 1432543735 1525867123 1003439186 1092455658 1649554450 1759495596 1374078959 1668456696 2643183697 3138155703 1707461095 1251145327 2189635674 1276417385 2056813160 2113711803 1158580485 705996743.2 1092639208 1237347425 1283950298 0 451945597.1 1403852106 1457554763 2161543585 1796704486 1606905643 2370294027 632803649.5 1120035240 2015413824 1290573649 1592068259 1477693636 2650882902 1422369535 1266010657 1630938241 2624967028 1835270079 1263279509 1581091845 1555301714 2061912270 1443347851 1971658461 532193713.1 1428544652 2401372570 1640182358 1586053754 1108661031 1916228983 1500671211 2522053437 2472514467 1643017702 1110617883 2927860235 2231412969 2154396654 974863119.8 1132324270 2020929038 1823496470 1852814012 2084736795 2825506314 2259367028 1420260995 277461791.7 1484508905 500653362.6 483877669.2 Homogentisic acid 8510359.2 8418974.1 51744193.3 53551475.4 39193984.1 84792046.7 48856847.3 25970773.8 20680560.4 24089170.1 32128262.8 36874311.8 25637194.6 68316157.7 67039767 50301326.7 42779892.7 65608123.4 118431713.5 30645597.6 48514027.9 38074343.4 37052231.7 32614704.9 52152250.1 25738578.1 8722018.7 35943082.9 75232031.7 28783331.5 176696935.1 56524843.6 52283616 22795671.6 66921400.9 21396197.6 279453950.8 56664702.1 91076289.8 25914796.5 25695130.1 34128711.1 32070773.3 45014453.7 35465589.5 50239032.1 33597820.5 32249957.5 50343184.1 51542848.2 8634117.4 0 57954898.8 54269662 19417557.4 17403413.4 9015668.7 39656520.5 22462294.4 42488808.6 71300249.4 66727709 42372887.7 39143506.2 88805748.8 33858594.4 23521761 57211310.9 41587506.1 15554707.6 20744178.5 23324342.2 58023200.1 13479808.7 52714311.6 57545093.8 55642386.6 81228437.1 19946177.8 28534712.7 11511640.3 101767908.4 80811400.5 53886973.5 40336618.2 14126842.8 55170795.6 54619882.1 53361563.6 24290885.3 29616825.2 30228245.8 59911994.2 138471978.5 9324426.1 20898931.8 98059077.6 214252124.4 183348707.4 50022666.1 51643853.7 0 0 44457599.3 47393791.2 25318456.7 91724579.2 50736412.7 17636900.1 24322485.9 17795236.7 30384433.4 41625718.6 47512272 28343799.7 45198191.3 22022263.7 67684944.9 46253894.6 32658395.7 12348522 7402680.2 36846406.1 43628013.9 61317399.6 52158046.3 52179631.9 58085501 72310512.4 242108119.5 16038357 182168035.4 59641027.3 18670974.4 24732429.8 42254916.8 36963640.2 67772093.8 42742550.1 66556631.6 54050367.9 104352441.2 30274250.1 23399162 97878682 21717713.5 120980489.6 45615471.9 47757262.2 0 0 48971955 50528314.3 65979839.9 39342346.8 21078291.3 60562107.3 52723268.2 23613360.7 37632030.9 29097153.5 20254587.6 209267697.2 53893559.9 32411625.8 78363809.7 28887329.4 134057676.4 94658386.7 10248716.6 134305529.9 23321027.9 34931276 190995589.8 70557180.2 2475553.8 50979779 27909331.5 64068234.1 32275429.4 32187671.4 20473232.2 21013138.3 77259492.9 72395943.4 63825403.1 35209875.7 64175487.6 23115363.2 50393008.6 34000241.9 74006063.4 27137872.7 23778268.3 38417280.4 25027727.3 56261339.8 96216967.8 21176509.7 1580575.7 47539557.3 0 0 Pyridoxine 0 0 4926037.4 4503826.9 6707294.4 13466731.4 3824115.5 3959817.1 162194.7 0 0 3115970.6 3460940 0 3766570.6 2728223.7 12038630.9 6023920.6 14422684.5 8045130.4 8618237.5 2843535.3 7378967.5 5484363.8 4371750.8 2611864 165096.2 5562395.8 4506851.2 2374409.3 9411014.8 10267806.3 20024081.3 2191635.7 4039703.8 1666760.5 5644518.1 2475682.3 7524732.6 3593924.2 2255894.9 2073552.9 7669559.1 3101696.4 4364130.8 4880924 4282419.2 0 4654587.6 5620282.4 89081.8 1166459.5 8352632.1 6635911.7 7079113.3 800191.3 1871617.7 11748669.1 6572103.4 4546154.4 11359809.5 13923074.4 5562577.7 11428400.7 10423791.4 586744.7 746954.9 601024.5 657207.9 1750163.4 5867421.4 4762721.8 15593007.8 5494522.3 2870946 8287739 7270657.4 4466071.7 5252837.4 1213984.7 787947.6 1761201.1 7390251.1 681102.8 9682988.2 4164742.5 6631218.4 943147.4 6830086.7 8852940 4772908.8 736051.7 4396740.2 6725553.6 1650485.4 731388 7768035.9 2286258 6549715.3 6777532.6 6411662.4 718389.7 0 5435008 6343845.4 0 11567093.1 12428615.9 3525487.8 6000485.4 0 7974439.2 2874865.6 8708248.2 3216297.4 0 11505450.6 3583581.8 8466496.1 2404175.7 1169419.1 1596719.4 0 0 6621653.2 7113795.4 6250281.2 4676266.6 3282481.9 16779416.4 6861321.5 11997489 5738840 4554726.3 6289402.6 5561869 3042066.2 8236734.4 7740113.9 3178679.1 4830414.3 10022773.4 109083.7 1816308.3 9907161 4079463.1 1213127.7 3825831.5 5503677.8 0 150604.8 7337078.3 8456066 7759147.8 4345999.6 4609449.5 7900149.3 3971921.8 3408848.4 5396317.4 119874.2 115073.2 3673881 8299904.9 2515646.7 13854701.2 5250089.3 6350509.9 9886034.5 1539439.2 10385103.1 2614651.2 235145.9 6345057.6 8086107.3 372800.1 7741746 5256891.4 6861494.9 7221108 112061.6 1907398.1 6275403.1 8643969.5 12383628.1 4278912.3 7787954.2 9251395.4 5591812.5 654018.3 96626.5 7767271.3 0 5130481.1 11115000 87220.6 10325261.2 5690905.7 3352140.9 287695.3 7788256.8 229448.9 111486.5 Glycerophosphoric acid 0 0 1259424.5 1859907.3 8110233 3354180.4 26476635 12880612 7916056.3 6405835.5 15283264.7 7098247.4 47523692.9 10223666 8417036 12176577.8 1980415.5 9381629.7 2722206.3 11818138.5 3089105.2 26558565.1 2310524.4 1456400.3 1840593.2 8035750.6 0 14600475.9 5159725.1 6544543.2 8553404.4 0 1830294.6 28417109.4 9187943 10910213.1 18363029.7 7340269.2 12228499.5 13724617.4 18005569.3 10630234.9 10335569.7 4518727.1 3976993 8347840.9 4162034.6 17447373 1045679.4 1071066.5 143560 954587.3 4052183.1 3166841.3 11815522.2 2191096.3 5985037.7 15316099 6876257.6 9319863.6 7378097.4 3724150.5 17332009.3 16247180.9 2362150.5 1704488.8 1672338.8 9614271.3 2508924.6 3744908.6 6367792.2 1936356.2 5730934.6 39007990.5 7228832.3 3431669.7 3422455.8 3022933.4 20527497.7 18609604.1 68785.3 4685702.3 29257564.9 2254604.2 6401785.5 20470728.8 9088751.9 15663722.6 5601222.6 1507213.9 11112258 6481110 6240737.3 18376754.4 22149685.3 3049731.6 263003.8 10982911.8 31221318.6 1587476.3 1439281.2 0 0 2395718.3 3418626.4 9470275.3 15259021.4 15941362 4051437.5 16383064.4 6928587.2 5877701 7429745.7 23590144.2 15922614.9 7105032.7 14695237 42239904.1 5174241.9 16321054.2 20926447.9 18950726.6 8083538.8 3680567.8 37638046.4 2505847.1 2857296.5 6110587 7132078 3782245.5 4437364.3 7690230 5169051.9 17956059.2 8260766.2 2848379.6 3383714.9 14605106.2 1039302.4 879430.6 7836322.1 5607072.5 3663838 1438064.9 3041803.2 490002.7 267701.1 1554266.3 1818690.9 0 2550923.1 4584631.6 5712813.8 20087627.1 5615229.8 12948837.3 17137040.3 2517490 9091548 14586483.4 5441088 8221717.8 5245742 13652400.4 6306618.5 9053140.6 15685040 8382447.7 12455007.6 7706916.4 6306132.5 6158253.2 4417799 4905742.1 9859958 3402174.4 3286298.7 4641570.2 6236844 4449860.6 4238815.3 18200878.7 8616602.4 4150455.9 27781740.1 4570489.9 1999004.6 5152842.5 13956009.5 4887389.9 2588182.9 2011332 9399369.4 59870063.6 17900945.7 8020038.1 6512358.4 9927164.1 5635552 2120030.1 3309723.8 3093098.1 1536948.5 Acetylleucine 7374403.4 7370893.6 72549683.6 70884994.7 103824010.1 45285944.1 108277538.7 50254169.9 24913464 56037378.9 94931867.2 73763015 55712843.7 131416804 263307654.8 75190883.7 75729968.6 128051031 47694759.2 89113854.8 121301489.3 151969362.5 46409442.5 54605909.9 62377964.2 36059625.5 7780961.6 86820701.9 189845391 52004729.4 57967849.7 93311046.4 22958671.9 41653647.6 44618234.1 96755548.5 123903023.7 25807962.5 64817820.4 133908106.3 93704131.6 86823357.8 61770708.1 31048677.5 51570466.4 130495729.7 45412840.8 127968400.1 69862459.5 69464748.5 7879217 0 92784629.7 82521175.9 27938093.3 10427639.9 10413013.2 34321115.9 57329264.3 231604450.8 144057261.2 139978458.8 117416253.4 84406357.4 57359388.6 102653265.6 119254528.9 112026333.4 50759324.5 8508395.7 136693208.9 23745759.3 83649856.1 98116689.1 104001931 99948882.7 90133297.9 74562305.2 78742930.3 62214823.7 32258126.4 85063615.5 72509173.3 37491984.8 112282628.5 76765848.5 73536736.1 118568800.4 79523405 19275598.2 82204718.5 126002446.5 26569247.6 77151675.2 19344696.9 31247061.7 80710494.1 97215005.9 33716337.5 84854439.4 83301349.7 0 0 89905249 93783405.9 47285213.9 134914405.5 156528005.7 51436549.7 106430323.3 59419968.5 59387904.2 126871862.6 92838697.1 69362924.8 87313415.2 150596248 126195329.7 59983703.8 25374410.8 21534293.1 21884880 39169418.3 82871680 96179396.4 92045312.3 86384501.7 85219047.8 65090105.4 60671450.8 33792371.4 203312713.5 152023816.9 23702994.3 56733749.3 76885711 105592188.7 131171838.9 35651855.7 28800090.1 93994681.4 42524111 99427898.5 79862498.9 28368816.3 18410083.9 12332719 78738428.6 75690525.8 0 3399257.1 82655080 82645777.2 153798145.5 65415600.1 62578177.2 126949361 73211729.1 37142360.2 108976620.2 61725329.1 52445309.6 66407671.8 185403673 73064246.1 76450764 24162625.9 73153369.5 106694549.3 18907978.3 148224378.4 69033261.4 65586807 120093175.9 79479467.6 7122243.9 73054785.8 88938765.9 62370713.9 37853647.9 189182881.9 50209588.5 44075017 83080330.4 49265207.5 81466460.7 71187032.1 174605416.9 89446896.4 65269097.3 30253177.4 32057771 170670299.4 37683998.3 159261083.2 52480787.6 41338848.6 66593741.9 54815802.6 3666829.7 73554875.6 3710672 3306356.2 Aconitic acid 105009388.2 114594009.2 724648496.3 709359340.7 1072801766 970726626.4 2247012718 804232839.5 712314989.1 991884244.8 1489370795 1373943315 3138687915 3087621173 5167039892 899466485.6 699229234.4 1764540722 1472744962 2200656619 1758026924 3554009778 564921055.8 420257296.1 728569365.1 1332846525 148252073.8 1632078501 2802796130 1703806299 1577969481 226589670.1 615675390.4 1966935209 551605013.9 1927790993 2408417724 609452106.2 2111649195 1584743982 1399444338 3841318545 1046042476 437018258.2 969089316.7 2121988347 590921954 2316047189 663479175.4 655575932.4 114759865 0 786963054 696667778.3 250424492.2 438587395.9 610374347.1 1233752833 3058451056 4256624218 1109718381 2413961915 3162039669 2566009838 671461248.9 1176538221 1284851515 1177177982 296158832.5 1978461348 2860939782 511538604.2 1017706103 2296037948 2274463418 616622776.6 598245262.3 901467910.9 1232859203 1356442682 73847745.2 2255649943 2424686501 1817982390 1127462925 2626456092 915123938.2 1240848071 1864529235 0 2804919664 1009583856 3022762363 2086340623 1220706534 948586977.6 125847133.4 2739436746 1737833236 391826062.5 389898764.4 0 0 679517533.5 682038969.4 631662735.1 2975792233 3253955013 804707520.9 2097833861 1857295757 1111298840 2774515966 2605716761 1216387671 2367727481 3114845339 3701885946 1444804003 1280417531 1327623090 3100905505 1191082589 1571807459 2564234029 535234583.5 563371196.1 754195095.8 179034068.5 1160274571 428232231.7 2347309165 1677709200 1850203377 1833610989 583037611 1513110287 3004397822 2574797752 89830984.2 2139565408 432542837.1 822784291.1 1430947895 330437428.6 0 303749060.7 455634950 449942991.6 0 118986411.6 959246124.3 957275943.9 2828563721 2470882429 857663672.4 4199904371 177698407.9 632509238.7 2641901375 3814363641 1574468728 694780619.8 2698726859 580017807 763566954.7 1597899468 1303184954 3686187426 403366648.1 1460803973 881952932.4 2977675235 2010192266 1844235122 256704674.3 603036255.1 1614728651 2271557946 704156229 458762166.5 881196795.1 819167849.9 1780986557 2409896552 1462944251 524823296.8 2567005133 1269205816 829040363.9 273646028.8 262291517.9 1402923289 3194271829 2326674098 1170310546 1192320153 1371846242 866435222.8 128304583 701228690.1 122938004 111477478.4 Shikimic acid 0 0 9312282.4 6598370.8 4447704.6 12997876.5 12831118.6 4028204.3 0 332488.5 317373.3 2340476.1 1210695.2 9562884.8 9150995.6 6789455.7 7385629.9 11539046.5 17464150.2 17380345.7 619065.5 8267798.5 688561.9 1145893.3 6543052.5 3023177.3 0 13590744.7 12239828.9 4127029.6 5013292.4 6906240.5 2982653 10139051.8 98416.2 6177642.6 5625936.8 3136919.5 15922519 5288075.9 4127678.2 5117173.4 28746762 0 421149.2 6388993.8 1466094.9 709765.4 7437198.3 7848004.3 0 0 12512447.3 9963269.8 7348246.3 993457.9 2076690 4376595.8 10745490.1 13728025.9 1634241.8 24397645.1 7794380.5 6031650.3 4878239.9 6419496.2 3776523.7 947406.2 777632.8 0 15284349.9 0 6465743.4 334577.9 7324146 16026041 11321407.8 4353228.8 4274204 2401479.8 0 5127539.6 8630442 3108275.8 1672498.9 4893120.3 2034008.7 1838099.7 5706022 1994975.5 9007363.2 0 3064560.4 6004548 0 0 17535874.4 13820574.7 8615640.6 12617694.8 12398976.2 0 1837347.8 7762027.1 8565062.3 2487390.1 7612926.2 8338267.2 2859696.8 2850287.7 3430832.2 4020999.8 3971336.9 3362548.6 5861040.8 22535836 8304368 41026342.4 7717140.2 2390436.1 2876250.6 2588631.1 2703510.4 5409551.4 5532036 7921339.8 9621391.9 5033805.4 2901322.2 3297268.2 2456154.2 6127351 4450118.8 4543753.7 2620169.5 3274142.5 6393875.4 10616108.7 4423636.1 3023411.9 7702805.8 3073790.6 4237307.4 2945407.2 2638321.6 5250636.8 2163183.5 7474486.6 7382269.9 1959914.6 583590.7 10524416.8 8791523 14227332 3460337.3 2692952.5 8649449.4 549760.9 1975210.8 7964918.8 4079265.8 2780626.9 11468494 22937041 1134640.3 9768102.6 929792.4 3476710.9 20486517.9 940502.1 10906541.9 1294103.1 3254304.6 16667185.9 3358790.1 913400.8 9024105.2 4896128.6 2200656.4 1697427.6 2799879.2 1314104.6 2556023.1 10222393.9 6177653.3 13876706.1 4592022.5 10513664.5 27750275.6 2807027.2 1523696.2 5325024.8 3911972.9 3668412.6 2214146.6 1952726.5 3610823.9 5500232.9 2109456.1 770586.6 7956063.6 664749.2 642952.7 Suberic acid 13882245.5 13087795.8 132377190.5 132524627.3 100727154.5 55448160.2 323628407.3 112369767.5 37378041.7 36561327 196910017.4 230338668.4 93719632.6 598370763.9 657181044.2 250340946.9 153135354.1 837274000.5 148319536 2171944175 410038966.6 283332709.3 45693691.1 48197900.5 122592453.6 126216788.6 14831411.6 767320063.2 220376571.3 149210317.6 300101271.2 81828941 99580930.5 531953893.8 34386249 724055096.3 259585697.4 56464692.5 292616319.9 156342511.1 184151460.5 196913666.8 189868667.8 33598854.4 104509081.6 422734576.5 76561726.9 143032170.6 129560474 130109665.8 14364911.1 0 195546553.7 167132020.7 0 0 0 91664371.5 199399014.1 507851928.3 166039802.1 1073804600 447325927.9 809327598.5 87204736 107497872.8 213062350.8 75113298.7 0 35811067.3 1336305100 0 142981134.4 260429925.8 526964772.2 196700490.3 181403879.5 328499542.9 27429054.1 70987259.1 0 753617230.9 546665986.4 425788499.2 10994834.8 317819274.8 192538350.6 184117867.9 274408391.2 0 524106527.6 127185045.2 202458676.6 1009678920 33459865.5 57448150.2 12107627.9 315152899.9 190057406.9 153566214.2 151731671.6 0 0 127391752.2 128651472.7 70325518 234916435.4 442169798.7 65446955.4 416303024.3 202416761 176020063.6 1870745812 464338258.4 295703424 327625686.3 463708962.1 271333705 457784183.5 153346087.1 54695736.9 18545169.3 127612402.3 266091284.3 327683920.1 129169560.3 130065357.4 207888204 13349396.6 30070726.2 30888937.5 941867439.5 312293349.4 50939681.9 41812970.7 104662722.9 342874684.9 1214218465 342627441.7 2303882.1 382817148.8 395435.7 166175762.5 221996125.5 5351747.2 0 0 116087829.2 118240544.8 0 10127596.1 156611477.8 162423343.7 854758842.2 123974533.7 241715359.2 277542157.5 13460460 36859586 370002439.4 578814754.8 296741472.7 38887011.8 1566326694 43474490.2 149510039.9 50519856.3 179431995.6 480865633.7 14173145.5 859965374.1 58476159.6 291071046.2 329151923 232916240.3 19666220 139372918.2 192467467 170493611.7 56204678 1591696942 25875104 33808635.3 411302569.5 262243656.5 471250048.7 34131492.9 668743277.5 199553616.7 68579020.7 24823188.3 20396509.2 243395716.1 102919149.5 248350790.4 138161163.2 48410329.9 108706201.1 30043939.9 25743311.6 130568026.3 10459627.7 8471561.9 Acetylaspartic acid 6721429.8 16160972.6 32369542.7 33542425.6 40714632.7 37209122.2 37942260.9 37554316.3 33676721.6 42708220.8 37941140.3 34134831.7 36011154 101613353.9 156153205.3 30068134.1 40259488.9 55415855.8 45676596.8 89653047.8 32782902.4 74356750.7 47814115.7 35901575.7 30406082.4 39006161.3 9265431.7 40525674.8 43454918.6 38538466.4 35630548.5 28266339.3 32295319.6 32647146 35934512.6 30353337 39106376.7 33293189.1 60536786.5 40224469 35352754.1 65406889.1 49557218.7 34718977.7 44262862.2 60510368.7 42922095.2 51614676.7 31255815.5 28391934.4 16222128.3 0 32256941.6 29544404.2 46421792.1 29809461.9 48341063.5 30460968.7 72236062 61766937.8 47988360.6 52004701.6 35725228 114528782.4 28754546.7 21487197.6 80142238.6 50251647.3 33041783 57945787.8 65599337.9 39469987.1 49048885.9 31201567.2 33020916.3 22616008 23425553.8 57897402.2 42961584.2 46137274.9 48427334 43232647.1 49005832.4 65289147.7 42691763.8 34340118.2 70234992.6 27487479.5 54396499 8056203.6 62116150.4 51468634.1 54222353.2 45671911.9 43861773.6 63395651.5 0 65179204.1 21091495.8 8782256.7 7900251.6 0 2119893.7 37407977.8 37868610.9 54034719.4 40444343.5 67299551.7 33159064.8 61326123 84036991.1 58532402.5 39373104.2 55068787.1 41770848.9 75757049.9 86767543.3 69640138.2 58367658.1 38407177.7 78104438 93722946.9 66436903.4 37075521.5 67816158.2 21260707.4 29773645.3 57273984.5 26510915.8 36265190.7 33994840.8 42897799.4 40339886.5 45975235 58144458.6 16111838.7 29910120.8 24189577.1 11117527.4 38002278.1 20805883.1 16950677.2 15934061.5 18565910.4 38319176.5 649239.2 52075078.7 25095106.2 17932291.5 6998265 13309885.7 39419238 43011153.6 56977365.7 43021777.7 36805691.2 69425228 5288698.1 52201518.7 70034626.6 74781388.1 76800569.2 22748716 67425422 45699216.1 40906646 56679139 30816821.6 90532090.6 37649283.8 42445801.9 42972675.6 56631284.3 37887414.8 56590393.9 9481355.7 16465533.8 48174553.3 38510629.6 34747185.9 39460600.2 36498833.7 51259658.4 37612959 59495012.5 34446537.8 43694248.5 52851431.3 39982727.6 24237748.8 13778731.7 10515116.4 26960509.2 123305896.9 43550118.4 28494478.7 53361115 44898886.7 56439759.5 3228230.3 24643844.3 13957418.6 1081956.2 Guanidinosuccinic acid 0 0 2365277.2 2329337.3 1812975.8 1686406.6 2489735.4 3145859.5 1363305 2462722.5 1281919.6 2099825.2 1301144.7 3374074.5 16831501 2403249.2 2587523.8 1801711.9 1786743.1 2681331.6 1063151.2 1728305.1 1557799.1 1947331.8 2322032.5 3586526.5 1236118 1109291 9316130 1250902.9 2341228.8 1612536.4 0 1626144 2520312.8 1821983.8 3432245.9 1640661.5 2846270.6 4449850.6 1444293.3 1920804.4 2825174.8 1412415 4145244 2955365 2419203.4 4555511 2233149.7 2148719.1 0 0 1625956.4 1778555.8 4675802.3 3437649.7 5869409.7 2419567.3 2697912.2 5178344.9 5063568.8 2099674.3 0 3068933.2 445580.5 0 4853052.1 2887951.3 512659 6124448.3 1159461.2 856599.2 1425059.2 5580451.3 16245.4 1425627.3 1600538.8 3082577.6 1653558.6 2174228.7 603191.7 2886714.1 4052 6370602.3 3443403.8 3004516.5 2258109.8 469556 3475107 0 3105658.4 1634299.2 11558487 6051685.9 2952649.1 4564187.4 0 2932199.3 4356382.3 846357.5 609853.6 0 0 2400554.9 2479932.9 2247180.8 1215559.4 3631466.3 1705697.5 1927726.7 2799276.2 4019237.9 4800972.9 2949035.6 3354387 4992293.4 2523825.3 2430489.5 5498972.6 1848575.6 2523974.7 17357782.7 2111013.8 1235547 2473255 2197916.6 2336308.6 1261684.1 1536120.7 2272804.8 3649645.6 3473400.8 3841853.6 1996041.5 3440005.3 883060.2 1555763.5 714968.5 961518.2 1380589 2910738.2 1847857.3 1357590.5 852542.4 1515745.1 580254.8 2046370.5 1960521.8 2014789.7 0 0 4069294 3922839.3 2258393.1 6970283.3 0 4047912.1 3059544.4 2220160.3 4677414.1 2067552.2 3143148 0 3256082.7 2445640.7 1332770.1 2316328.6 4909203.9 5475239.1 0 984920.3 2214265.7 134489.2 3348995.3 4395268.2 785912.7 960352.4 1783655.5 1874061.3 2479713 8891028.5 2349729.3 3282443.5 850383.4 3744901.8 1475719.5 3521271.3 3309573.3 4950593.2 295339.2 0 0 895861.5 7083893.4 4100670.5 2744894.3 2870701.1 2018055 3050339.9 0 2088596.5 0 0 Formylmethionine 0 0 0 0 0 0 0 2865137.1 0 0 5818067.3 4532910 0 4717265 0 2229758.1 0 0 0 3700025.3 12744.7 3412117.6 0 3151430 0 834591 0 0 7355101.6 2177236.3 0 0 0 4376196.7 0 3438955.4 0 0 0 2914031 1242848.7 0 0 6135378.4 0 5352498.9 0 6834443.9 0 3159349.7 0 0 0 0 0 0 1362276.8 0 3770089.6 2081868.4 5258115.5 0 4045692.2 3870852.6 966285.8 0 2125783 0 0 1843112.1 4764162.4 0 0 3068159.5 4409748.4 2629072.3 3953553.5 0 0 4957858.1 862558.3 2912776.1 0 0 2249727.8 0 1852700.4 0 0 0 3653431.6 9769178.6 0 5175354.5 0 0 0 10036587 0 4488569.4 1251483.2 0 0 1414667.1 3414733.9 0 2266548 0 0 0 2437984.2 0 0 10403367.3 0 0 4898354.8 0 5469619.5 0 5314840.7 0 3498631.9 0 3810101.1 2064431.5 1026855.2 0 7594183.4 0 0 5897259.2 4302122.5 2052674.7 0 0 1744215.7 0 0 0 4253720.2 0 3472932.6 0 0 0 0 0 828779.1 0 0 2694475.2 0 5036132.1 0 0 5560430.8 0 0 5151303 2780118.7 0 687463.3 6880842.9 745929.5 0 0 0 0 0 7774951.2 1705488.1 0 0 0 2038660.7 413020.9 3194645.5 0 2815093.5 0 2399662.6 5127927.4 0 0 5572622.7 0 6366895.6 1391318.6 0 0 0 1378419.3 0 5795736.5 0 0 0 2576736.5 0 0 0 0 Gulonolactone 4756676.9 2242175.4 101959062.8 97950584 44512121.7 47325005.5 39990340.8 37039955.7 22605431.8 27463959.3 30688461.4 25820733 34888208.8 62766273.2 157148470.8 30641227.6 56166069.5 42995016.9 54946322.9 51656572.5 61301887.2 40710403.9 46152509.8 46493049.9 97411812.9 16575621.5 2762568.1 48614065.8 63484377.6 38808441.9 23239478.7 65353790 83341789.2 56059785.8 27057098 20677394.9 66608132.5 123347674.5 85300694.3 27131003.7 21198329.4 46224662.7 38256966.1 19884588.4 30759370.8 47766742.6 39322074.5 31744991 107584969.3 100114830.5 9498346.1 5621482.2 108117054.7 111212292.1 18484491.6 23383778.4 24175279.7 58067414.4 48126343.5 39521416.8 46868917.3 80946030.6 56472183.1 37724856.9 88787163.4 35255450.2 19074097.4 37837701.5 39636844.5 29416701.4 28443368.5 19922410.3 33983742.7 28149853.4 26277628.4 118638362.1 121597409 61394660.8 41913160.7 33413287.4 11340629.7 30469851.1 73370925.1 18614515.2 32340468.3 26580212.5 51293052.9 48018041.6 56193435.3 25434386.8 61753948.5 34473769.5 43630732.7 75105409.6 17296637.9 17283333.1 74823992.4 54390862.5 68768081.7 123246997.7 121395628.3 5543903.4 8756311.7 103352673.6 103131452.8 27516604.8 164827974.3 67803554.2 23754897.2 29162959.6 25509407.5 26002863.9 38567184.3 44135309.9 26874533.2 83511402.6 29239266.6 45509434.6 86659048 19767223.1 35793116.5 40574433.6 22018177 49196725.1 72821681.1 114380034.2 113140407.9 44570269.4 27761892.8 73696429.8 38979391.9 46340973.4 31273338.6 41782435 33083041.2 25239817 41965811.9 51019716.3 35842985.7 36470938.6 40990116.4 38147045.9 33052450.5 16408502.5 43060666.8 64059267.2 24415300.6 99627268.4 99110795.6 9393186 9238603 120619164.6 127877145.9 53094530.6 26216809.5 55421138.6 84441520.4 18099394.1 22917111.2 30207345.7 23702455.7 42685839.4 54286915.4 52839867.9 35601185.3 49667400.4 15994679.3 34830019.9 68185941.3 28250611.2 69551852.1 20668701.7 64617327.9 66851847.7 71808408.6 12687832.7 126211020.1 23072861.8 21789515.4 22947313.5 29663945.1 49795728.7 62887237.3 36233533.6 77696847.9 83076594.3 67076922 58711046.9 28333925.6 31233592.4 29204311.2 50152085.8 19819338.9 58648393.7 42861737.3 42884129.7 101156263.7 54771933.4 23502033 1451622.3 114397259.4 8600398.2 6794221.7 Hippuric acid 1427463724 1508275291 13529343085 13566195566 10104242717 6642057742 14536273282 8641943699 3659105117 5742975704 4078391247 7303688472 49573844454 7669799437 63431321283 7593705444 6514697853 5526404418 13863641858 20235454860 9499669504 4681411686 7017940224 8607860339 11522903001 3456693395 1463180966 5556071602 3126999535 9926255438 3362741195 14663278798 2527142657 3537132512 8412398443 23026812001 8933898849 4180342843 8197440437 6709209107 5784808426 30906339215 14035744751 4574146029 3177371168 3358349647 6252656150 8598017645 13317423171 13301974514 1502917257 0 9695832015 8221923066 2704039448 54349735682 5099685609 5368819497 4852408032 15316824157 10955341589 22144356872 24015446972 7396589976 25509385090 0 47616210394 11861120418 18616861128 2968311441 12122277286 1766505350 207953301.6 0 3370710169 11302830245 10528660956 9171205326 8923152556 1618270792 2606066466 16413307782 13521340013 19080888107 26954709396 5693986957 7572220562 1507786970 6317616879 9410736680 20797139509 9059660316 2461159665 15190858581 1697069606 1358726682 4369836171 12587430888 2885229147 9579375990 9922029274 0 0 10032427437 11302382005 2058678620 1571348686 30914091393 72352302.6 9531412394 1264293879 5174969168 56567216128 18604863495 3268406482 24644950137 10064252275 6959181082 6546924860 13398924307 19276985461 0 1630387736 17357159960 18368621177 10996680684 10614750261 9395524549 4868864389 30887801628 3494370897 13467562686 9000008619 961745294.2 15290606780 20331390648 14149708441 8399762415 25096589938 8202856221 17113281885 8716494893 6122538130 5252428120 6362169973 1579081935 0 9192128293 9182096301 0 2143581113 9548667975 9818825634 8597603398 8625051086 8269107990 27856165230 6505097553 4779055076 11803726540 6636430383 3537811935 7026784106 14362683345 5484734759 6441497642 6315264959 12317768299 12307685521 3523698433 4151627880 5497012431 27865263328 4644079545 9175652301 2723898513 9720329609 7728831304 48221324454 14679136968 8541167787 3443276312 5464421306 8807841909 8827549699 14309575773 5658642350 12484004629 7892492879 6907843115 71645647485 9272396906 6315229297 9188039445 7913360107 10727451732 24455756500 10007689298 5403369218 2211835525 9206175953 2160303042 2084198763 Caffeic acid 883457.5 0 28088783.3 28199705.7 43944334.9 46028857 24345777.7 11613227.9 12524106.4 19617185.2 33542454.6 17179670.3 12866563.1 67202541.6 34645242 24435759.9 20529366.2 41431917.1 44403133.3 32677881.7 39133255.4 67432400.3 14083103.7 6733001.3 24264014.3 12930232.4 0 23289693 24880120.9 12892788.2 24318703.2 17863040.9 16430907.6 8067510.8 2356395.4 11289545.9 18128342.8 9776476.1 52021910 15452834.9 26513866.1 28567433.1 19671493.4 6363065.3 14512913.6 19955489.8 11225619 35895228.9 27148779.2 29228130.2 0 0 36017774.7 32436964.7 11799117.3 5605560.1 8889255.9 26176758.3 18783021.1 64664438 33606468.9 49090520.6 40410796 28187019.2 39921618.7 30022224.8 1468210.4 40207226.6 19032093.2 3212313.4 16818684.4 14550521.7 17680847.5 23371.9 22624450 39245743.4 34934027.4 21527862.8 12903337.1 11187151 10581551.6 25430749.1 32752699 797940.1 20411333 14396962.8 30887425.5 30113216.5 21939550.4 8993808.2 16853566.7 15922040.4 10704505.3 55771270.6 6366454.8 931797.2 38321711.3 33212084 16483204.4 34769758.3 33447079.2 0 0 33392811.9 31961689 37020327.3 43026304.1 49307632.1 0 27333213.7 15130929.1 16267167.3 25806724.4 33713064.2 12642371.2 25044516.8 19352183.6 45704600.4 27178939.2 24740483.7 5546646.7 0 16304860.9 30094588 35240988.4 33782981.3 35727797.1 31649819.4 5321522.3 48029432.8 17998903.5 33294639.6 11849842 13541609.7 9950093 32624556.8 34730200.5 58776563.9 17679779.9 16157197.6 9568193.3 22115421 26733501.2 13394328.1 321074 11479287.8 0 29642664.3 30923216.3 0 3861574.5 28993008.2 29968714.1 15754801.7 18697916.8 20423920.4 39489748.7 6495832.1 4685155.4 19550422.2 24562274.1 18350560.4 32291846.9 24539290.2 15126462.6 22174607.3 15447905.9 30077071.8 81340099.8 12928475.6 35952018.7 18839958.9 36530007.5 71266760 16272000.4 4907804.3 30121533.7 22901200.4 47459159.4 21661063.4 25723677.7 15532417.8 6327134.7 38791760.4 20492436.7 42566007.8 17456321.3 30071812.1 17069932.5 5917281.2 5077953.2 10881736.2 28836252.3 18207156.8 27887679.8 6211581.6 28460965.8 9579970.7 10611037.3 4369609.2 28040144.2 3897005.7 4673560.4 Tyrosine 18444999.1 23894018.1 54495323 54396147.3 36427799.7 70427478.1 35479718.5 8424961.4 8849080.1 20276082.1 26638093.4 22346360.7 257780463.4 79392718.8 25373622.9 17906656.5 27763600.5 45909904.2 96881866.1 20413022.1 16150362.2 35723202.5 20928263.1 27554527.2 50765716.7 17623358.7 0 24591863.1 15341122.6 25627501.3 23437480 110476960.2 24736452.1 12913112 28349063.2 134461666.3 39785517.7 16279434.6 31629020.3 9294542.8 22098022 80547244.8 15250292.9 20793394.3 18513925.5 41552439.9 17860548.1 14395871.6 51385581.2 49819147.5 22822204.4 22503440.2 63063897.5 61240864.7 8630477.4 164919157.4 42229727.1 45706639.8 21107708.1 13777934.8 55931015.6 104405544.7 47587580.2 2744900.3 17307739.9 45819751.4 187952540.9 17577192.5 7936843.8 0 15318867.3 20517991.3 14800928.2 2854733 77525725.3 68949099.1 69345284.7 10712274.2 66780622.3 18140998 8427161.4 7405845.7 35907166.9 17169440.4 101773133.1 281956.9 29573831.9 30157467.1 16882655 16103643.5 4707565.7 21377363.9 14340654.3 67800801.7 0 5835633.4 69119420.8 44665094.5 26636297.4 63741094.2 61031046 27442767.9 11297632.4 60329298.1 61053757.2 32709218.2 30248985.7 44428895.7 20289284.7 23387074.1 47106403.7 15364382.7 38192052.9 47655525.3 19953089.4 99651686.6 38072692.7 21043842.6 28685650.9 41410639.5 0 4017580.2 39776489.9 38208148.6 55081688.8 59511018 60689410.1 39157762.1 29499772.1 83339348.8 22278084.6 19280776.6 10526366.3 249543022 21576226 75253425.1 28981649.9 21052289.4 43200271.2 10931722.5 31948112.5 65950621.7 26159095.1 15206809.6 21767371.2 2848815.3 0 52783118.7 53379368.4 18163653.1 29806642.9 45609560.8 46684023.5 23796518.3 25502451.5 26048770.6 92510459.6 22844518.2 17434291.4 32124176.6 17492506.1 11985337.9 24124698.2 27872006.5 33514581.1 27856649.7 21630503.7 31848457.1 48379320.7 24892115.2 29585782.6 25058539 34834536.3 42616520.8 27815036.3 15103139.5 46175025.9 29486891.6 222400952.3 50368992.1 32225256.7 23328685.5 32845454 28546506.6 36689775 34188760.2 25818101.5 32510968.8 26664547.7 32270529.7 259107630.8 26666459.9 25153618.5 26562600.4 27096424.3 25191066.2 48797290 29760419.3 21416579.1 12417372.6 43907793.4 32083077.5 25678656.3 34-Dihydroxymandelic acid 0 2886636.9 10350305.2 8941952.2 15895003.8 78126011.2 10764144.1 23060545.5 25880.2 2032598.6 16301607.1 13342244.9 12778133.1 23919947.5 22492447 2367228.7 22865051.8 62164517.1 59012446.3 23578845.9 18377606 12474499.5 6788952.2 11994922.2 9972327.1 1385189.5 0 21400223.2 56478198.8 4275842.8 13477198.5 21658843.6 35549719.6 19042909.9 8026074.6 11593867.1 25017905.5 24018658.3 42725561.8 5261148.3 2953449 10141069.3 10767361.3 3140997.4 12983012.8 12016232.8 8783562.6 47577376.8 9365923.1 9662341.2 0 0 16582038.3 17706704.5 9867956 0 0 42558004.9 37217488.7 16163072 241126.2 51556111.3 49613687.2 33092386.5 36237739.6 7078078.2 22193215.7 475644.2 18508576.5 50277184.9 20438138.5 8536069.9 11667341.4 24610794.6 5194597.4 17714473.8 16237656.4 18425058.7 0 7702387.6 0 47437926.1 36953388.8 0 9596500.8 12750516.9 20086725.7 0 19583244.1 0 54247055 0 14977261.2 48041101.7 0 0 20060648.6 28602352 19790289.1 13789407.1 13947855.1 0 4457524.6 13956038.2 12924492.5 4748052.5 30673508.8 19508205.9 4271071 9903289.1 10430827.5 11898359.2 37403704 10816323.8 13121144.8 17407138 19919814.2 56374132.4 106725584.8 7508822.1 3393426.6 11601586.2 11569106 24590481.8 19041696.5 14114216.4 15731949.8 16853787 8043249.8 4180845.3 10076434.4 29434088.3 6290901.6 10486882.2 10103326.4 13341810.8 5276423.9 29579470.1 59440837.4 13899193.1 21212232.7 8768553.3 13019182.6 9373069.2 4719907.9 41170098.5 3223288.5 13702391.5 13029111.5 3061384.8 2756354.2 18392410.8 16636193.4 21710940.8 9166319.1 15745932.1 57896267.2 16341842.6 3526783.3 26235180 6047015.5 3912182.8 17156585.2 28295537.2 8810386.6 16197098.8 3626193.5 7355316.4 64542941.7 8688912.1 22902906.6 9249984 43667453.2 22170776.3 14031970.1 4539491.9 15399404.4 12544218.4 5447942.2 4301062.8 3353852.2 0 12437270.1 15323662.9 34343685.4 39784196.8 18936678.1 19314480.3 20575394.9 4400829.3 3286003.6 10607566.1 3884114.4 8633702.9 18672121.5 18739603 98014364.2 8650966.2 2851641.5 2974029.6 16544148.3 3407780.8 2645999.2 N-Alpha-acetyllysine 619803.5 627834.7 6135678.8 7230800.1 0 6616501.1 4900197.7 2873088.4 2408852.9 3498643.7 0 5705508.2 4135734.2 3355426.6 9252339.4 1976158.6 0 2722868.8 3670083.3 2700505.5 0 2394681.1 4296131.8 0 4377595 2692448.7 835288.4 4749380.1 2892909.7 3024022.8 3641860 4286107.4 2438106.6 3556603.7 4934511.9 3165675.7 3842434.8 4421339.5 11692763.9 3276920 2285469.9 3426906.4 0 0 6519902.1 3699856.7 3760454.1 0 3401525.4 0 612894.7 43110 4503138.7 5858301.9 4410588.8 0 1842332.9 5664561.7 2747609.9 0 5879977.9 6667935.3 2788230.1 6026289.6 0 1481415 0 6961567.2 0 0 0 2100508.3 0 2360760.4 2340152.2 3263910 3562893.7 2633177 0 2764549.3 0 10768364.4 7223842.6 0 0 3538688.5 2439415.3 2054019.6 3163577.4 0 4177945 0 3524252.8 3142230.5 3815593.9 0 2944010.1 5130703.1 5845584.6 5924999.2 3179564.8 0 0 3042530.6 5808985.3 3724424.8 3496325.2 5307324.9 2488555.3 1989447.2 0 5831988.3 3146655.1 4251898.6 3645579.6 4505572.1 0 7382854.9 0 1724922.1 2996104.6 3627129.7 0 0 9050990.4 3436404.9 6502749.8 6057162.1 7440274.9 0 0 3188723 2409247.3 3510887.7 2171410.4 0 0 5496400.5 1567810 0 4397085.8 0 5157248.8 0 0 1380108.7 2497947.2 3132089.4 5489089.8 240610.6 0 2595238.4 6542289.4 0 4195219.1 5018709.9 4809055.8 0 0 0 0 4508891.7 0 0 0 6896813.6 0 0 0 2328004 4590783.6 0 0 0 0 563416.3 3245100.3 3443598.9 2826341.8 3592342.6 6392515.5 2574810.8 0 3952847.9 0 2656114.6 0 6557675.8 2523987.2 0 0 0 0 4744696.2 3338021.3 0 4820374.9 6785450.9 4838452 344486.4 3961456.2 0 0 Kynurenic acid 0 0 28029445 31991120.1 65962189.9 56901518.1 76470964.1 25810022.3 34045460.3 27795988 35361848.8 47692718.4 21566124.9 60997633.1 81786625.5 48344972 62569180.1 47912504.2 64025979.5 106104651.2 37731503.5 44681479.4 42643826.7 32092450 27948267.5 41951416.1 4413239.7 92438792.3 38625587.4 99938436.7 43454047.1 59024889.3 29115662.3 19167067.7 19060517.6 36952143.6 51351170 46905463.3 66061618.4 29579510.9 38445993.3 70196560.1 50385773.6 27121704.2 26729847.1 69557585.8 47621732.9 46970183.8 34641952.1 32540732 0 0 33930931.9 28909460.1 17387447 29448984.2 17648934.6 73414691.1 14927427.2 67480714 60540122.3 67059774.3 70122397.7 52298850.3 35540043.8 45508252.5 29568841.3 51833981.9 49032221.1 21721404.9 70450065.8 26570608.2 72987116.4 39568325 58860304.3 41462490.3 38318712.9 51219536.3 50430623.8 38525876.1 21204492.9 37575457.6 36599047 77715080.2 38479573.4 38436392.3 28388853.6 62866434.5 43727133.6 81478170.7 36380517 38835695.4 23276405 111474448.4 22619637.7 20489724 51158494.5 97061416.4 41554210.3 39869215.6 39648599 0 0 36064302.7 36328697.1 34497349 56588843.7 77606271.2 32940717 58664237.8 20740881.3 21138182.1 39744710.6 56374645.4 36189072.5 64645402.6 84042891.3 38434119.4 49128546.4 32600311.5 17903997.8 6251345 35546844.8 47252381.7 88685462.5 40696018.4 38030776.8 36468882.9 35047949.9 64425232.6 43897662.4 74203224.7 45132442.3 29150990.9 30292579.5 76258443.7 95119634.6 64397249.2 66102216.6 49601499.2 68414222.6 64950929.3 43079862.5 40179943.2 47432187.5 43944791.2 10630669.1 36674859 37664049.9 0 0 33933249.5 33684073.3 37414737.6 39032901.4 34728974.5 55725764 27966720.6 42781022.9 70175468.3 40721836.6 29249667.2 52578536.8 61051524 29513333 39007590.5 27033055.1 81394361.3 79831754.7 26600734.1 54054005 31313747.4 41612392.9 95820700.9 62835833.8 10344796.6 40509727.1 76243781.1 53773635.1 51919023.1 36216965.5 47079000.9 30026969.7 70287816 33179071.1 60678024.5 60346165.2 113814189.2 37661037.9 30123281.8 42284193.8 53543155.5 38009948.2 24739894.2 62295639.1 55829415.1 41625160.2 31214173 44789055.9 4814211.9 39434444.7 2369092 0 Diaminopimelic acid 0 19380.8 1285433.6 0 0 0 1328745.7 4306006.1 653696.8 1921261.5 0 0 0 3584245.2 0 1852764.2 2270003.4 0 0 0 0 1409111.3 0 2004671.6 1438787 0 997971.3 0 0 1594300.5 0 1735618.9 0 0 2945622.3 837447.4 0 653740.2 6218936.7 1932091.7 790514 0 1812891.5 0 0 5206286.4 1283036.9 1853307.8 1143544.7 1647130.8 37603.9 430210.5 0 0 1380029.9 780597.5 0 2275147.5 0 2064013.3 1333492.2 0 0 0 0 0 0 0 1720787.6 0 0 0 2270327.3 0 0 1300659.3 0 0 5386368.7 5344301.1 929822.8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3880609.4 0 637439.7 0 368261.2 232257.9 1200333.9 0 0 0 5338184.6 0 1175597.1 2295053.3 0 0 3144310.4 0 3432545.1 0 0 0 0 4593424.8 2535046.6 0 0 0 0 990026.6 0 0 0 708434.8 0 1725173.9 1673152.5 0 0 1980114.4 0 0 0 0 963224.9 0 0 2073208.7 0 1832066.7 0 711866.1 0 149886.3 0 0 7000891.5 0 2219487.4 3126193.9 510197.8 0 0 2481752.6 0 0 4299382.3 1649262.9 1023238.1 1465438.8 2243076 0 882436.6 0 2398754.7 0 0 1439144.1 498015.7 0 0 1945160.1 1563455.1 2227075.1 0 1556218.1 0 1957086.7 0 861269.2 0 0 0 0 1738699.9 2344904.4 0 2154426.7 0 0 0 0 155640.3 0 835400.7 139725.8 5-Hydroxyindoleacetic acid 809339 0 52166172.8 52779340.4 134526305 46728399.1 183020143.6 118449287.4 41725274.9 61898444.5 126506643.1 68997473.1 57072097.6 395453397.8 152727102.2 295435905.2 131617006.4 284859074.2 50583023.5 231328403 230008669.2 167352306.3 49643686.9 80059354.2 52565585.5 29870223.3 662450.1 221418694.1 46940840.5 96895528.9 293170307.7 62436427.1 227991449.2 59673205.5 38982651.5 100645631.5 147680085.5 37582495.3 54591907.9 41323587.3 29243939.4 72444534.9 90187499.9 75610558.9 84022723.9 184049651.6 39593011.8 142573812.7 57871569.4 51561187.3 1380984.5 0 67657443.4 66758214.5 37249442.5 45634661.1 38677107.9 49105400.9 64902277.1 193093266.2 109777699 304171808.6 75125288.8 550042584.2 56397962.5 70804517.8 61728603.4 141428109.5 225706702.2 37540995.5 175082245.3 52377020.1 97729111.6 49566963.4 150051491 71546907.2 70298485.4 199068508.5 77834422.9 40602363.8 23471531.1 162148750.8 76401164.3 91444506.8 52209221.6 77828316.3 98070745.9 213082039.8 160826344.7 66384454.8 71122621.1 126744026.2 86095219.2 151560510.7 61546234.3 86263962.2 51159996.6 144698366.9 43482720.6 69160318.4 68139946.9 0 0 50879344.4 53230812 51250534.2 94059704.1 130713758.1 13750752.3 171763876.2 150210917.1 50540944.8 129863057.5 161193179.7 63048186.1 123685345 109463394.4 114193150 64892018.3 36025251.4 44574651 34190303.8 169468704 59189552.7 225298594.1 58841257.2 66276495.3 309884775.2 42180101.4 197117336.2 66755957.7 137909126.9 309163280.2 40943328.1 79555199.2 91216368.8 209481616.2 455108820.5 118252209.8 63645750.7 62753524.1 41294916.3 123421658.6 74766845.6 47809622.5 25618509.6 17212043.1 62039683.8 58599855.4 0 0 52098038.8 47141458.7 154868580.5 157585841.6 68260504.4 122288324.7 7676330.4 35812115 112693155.8 164165600.5 276042129.9 61951515.8 283644454.7 50113792.3 83985678.9 150042752.4 188553647.4 192299756.3 373439.3 196538678.7 64588571.3 95140945.2 266921950.6 263232119.7 15074206.8 44665946.8 74149897.3 350305776.4 42671807.9 30631573.8 164307037.3 93271381.1 178907554.4 140055269.8 135888615.3 60045550.1 99385517.6 42337965.2 56532794.2 26606664.2 31654446.8 101663214.9 166720928.3 286886612.7 52885192.3 95536315.2 46030416.7 123908702.4 0 43794223.6 0 0 Quinic acid 0 0 108375767.4 99617193.1 12786180.4 99404256 14553625.1 8869213.8 0 4546728.1 7300247.3 3504722.9 10791903.7 41169623.3 16432396.1 31514822 15628413 43241845.5 67920449.7 18451394.6 18642474.1 13800319.1 0 10060159.3 98089636.2 0 0 20640411.9 4937570.9 4933312.8 29545514.4 6218620.6 28931380.5 9772438 4140435 87535132 37822467 2446812.2 2436265.7 1932809.3 0 5202148.5 8771527.9 11246878.8 6412353.2 16735111.3 6186642.9 8230045.6 94969751.8 91245177.8 0 0 110573531.1 83179378.2 80086424.3 47145998.2 0 7682966.9 22817044 15954832.1 17226507.6 92787887.3 0 60919022.3 0 10976829.1 1229932.7 19211879.8 18427410.8 0 15301766.9 2941604.3 10480211.8 0 10569153.9 98444300.1 104840353.6 16163519.3 25651469.1 3032377.7 0 11554869.5 67211892.4 0 11232160.4 4313685.8 14785073.7 19178447.9 29060727.6 0 5230281.4 2416362 4571890.6 10644583.4 1726262.7 0 10786405.6 12225359.3 5105724.7 77836603.2 68260307.1 0 5653761.8 69878294.3 67559792 4523094.8 9969102.9 20214843.2 211447452.9 16804541.2 17258981.7 5499315.9 9737205.2 14279356.2 8650153.8 9799010.5 11861002.3 24600178.9 24187405.3 8909634.3 5919577.9 8745933.7 18408807.9 8650175.4 18310816.8 61682551.9 65095263.9 31733464.5 4770726.5 22794520.4 7058251.8 13313304.1 23513220 12196101 9786742.6 15697617.7 18037687.5 37364526.5 22789746.2 10720363.4 23632560.1 5004586.6 11830454.8 8363765.6 6381438.7 5800942.1 6521741.5 65977047 70758848.7 4880080.8 2733139.7 108972205.8 106197693.2 14646445.8 16772403.6 8386680.8 34586286.6 1311781.1 988249.1 10996143 17886080.7 25897626.3 7461625.2 29974399.9 8439145.9 26456514.7 14462018.1 19242864.6 84420161.1 1059851.6 17946093.9 8182802.4 11497164.2 28562980.2 25049643.7 2707441.4 64594374.5 12669631.4 36353043.5 29130607.2 9673348 17047618.8 17901567.5 17332274.3 19931569.6 12974467 3595832.9 15091239.2 180844568.9 3290883.3 3030710.8 16616291 1864176 17977102.1 26889387.8 1190981.6 16876237.5 6950417.2 13071786.6 1730563.1 66903646.9 3030854.5 2983950.1 trans-Ferulic acid 0 0 84300346.6 80495032.5 93819996 96638111.6 12054087.4 7850387.5 1063059.4 22657107.9 19698321.2 10912251.2 6484707.3 17406895.2 9069220.5 33472470.3 13583189.3 49627195.8 67134774.4 32783416.6 10556807.4 1114925.2 4337130.3 8865805.6 82215909.2 47532464.4 0 7032263.9 21725364.8 19678345.6 17461485.5 42580697.4 50556445.9 13704781.3 5279298 107306952 14280413.3 28004093.1 37845002 5015542.7 1999342.3 5386869.6 16729372.1 11201887.8 33426210.3 12831280.1 4344241 27778694.7 74986020 80764242 0 0 98634983.8 93979209.3 12908707.1 1989146.5 0 11330564.3 22942264.1 13327445.9 12498492.4 54083082.2 13108945.2 39614241.2 34429467.5 5535340.5 18610203.5 8067759.8 8136524.2 40251039 0 30697170.1 20656339.5 2663392.8 63420829.3 106293125.9 97272342.5 20864701.5 1848255.6 8320906.4 12936611.1 23341516.3 18499068 22660708 6962237.7 3987318.6 46737532.4 17708424.3 17257681.4 4203970.7 17283887.8 27962349.8 18351223.2 16291939.8 4112720.5 20659353.9 62512950.5 13337286.8 55558747.8 87855148.2 90447341.2 0 0 76969005.8 79124602.7 2705791.1 18046394.7 39628491.5 0 0 0 26543819.4 35127590.7 30918144.6 13087213.7 32105731.7 8761545.5 10803250 20254353.6 35577631.9 39236771.2 0 5454584.5 0 57437306.1 89289808.9 94190560.8 57123852.5 8694970 69120246.1 26748061.9 23956043.7 90867287.2 4055961.6 1463968.6 8777790.2 7886687.3 43875951.7 30482466.9 4961237.7 37394643.6 59062483.3 7535001.8 4532554 9855904.1 10628322.4 0 83634962.7 79039094.4 0 7371094.6 64487820.4 61130240.4 18778708 11025493.7 11492598.7 145970421 10418608.4 11473542.1 13798025.4 13386426.3 7057889.8 24662625 18716429.3 17738081.7 28134365.5 7068753.9 17179103.6 152378667.7 9141019 28038250.6 13256447.9 14934471.1 25901751.6 26543615.2 8140133.3 57595237.4 17280130.6 13301334.7 27529018.1 14897068.4 7016903.2 10953764.8 44223202.7 25911130.3 41824473.1 23071335.7 14356992 46201285 22209418.7 18509884.1 118439595.9 22638117.9 9736991.9 16736097 19088187.7 42494677.1 14327361 12446325.3 7963434.6 59356680.2 7430293.2 7994478.2 Gluconic acid 51028728 55427862.4 711940558.5 705944072.8 272078587.2 229424242.1 1320020797 160742839.4 172086412.9 202979996.3 246830138.8 174410269.2 190142252.6 801256657.3 983624060.6 210585524.9 297209032.7 450006850.4 290121602.8 271098229.6 327207562.3 249945270.9 189669766.5 172758384.6 715691566.4 123109038.9 49644716.2 195049959.7 252809894.6 206480696.6 162141340.4 217948039.2 180725234.8 228063516.2 124354692.8 151268100.9 281948497.7 204185799.1 342176075 157489635.7 208646066.7 326025173.2 205770745.1 162022244.2 183561394.6 270290262.3 198693235.9 214089095 668638853.2 675925512.1 52548938.5 0 1220781405 924031640.5 116409806.5 168435565.9 200583398.6 212276588.5 222531984 347368291.4 265981658.9 431982782.9 231656655.7 257982333.3 76152869.8 224936470.2 339972327.7 282467715.2 238538765.7 187774016.9 133921233.7 161960542 158140283.2 159625328.3 138021815.2 905649403.5 823775137.2 170034016.3 201673526.4 199944696.6 125264924.2 105021510.5 375415972.3 293267732.6 203178270.5 254419838.2 330928181.8 227291589.8 300717996.1 159334013 257471813.1 188222324.7 246064861.6 337340821.6 160674009.3 184079709.4 313640850.1 498172731 349708431 734486692.5 737614009.1 0 0 877596352 943346547.1 194112993.6 134251360.4 440048637.7 131322617.1 281147271.6 206221011.6 121407980.5 187900923.7 168259029.7 114773755.5 256125070.9 140309177.6 280363637.5 365870750.6 95066614.5 169731067.3 414491628.9 511465255.4 543593406.5 657541996.8 823378917.3 886220489.5 265128776.9 144043730 411877377.6 129659544.2 242909048 149638099.2 375119156.4 238379943.4 334056434 193953428.6 249366083.9 73179570.8 195469058.5 305633158.4 350801127.7 112083592 77291252.8 228028605.1 80066122.7 141935021.6 740892753.3 731378108.6 0 8027630.2 935871652.8 1128684255 404326457.3 209549677.4 312766775.4 815888807.9 54405830 141941678.2 939787948.5 170332302.4 164991799.3 404246979 286663747.8 256053846.5 374499938.1 254488205.7 342728553.7 506419800.9 157367468.1 189701278.3 135788548.6 169872312.1 315531645.5 247274926.3 25829623.2 643183464.5 286232808.7 136267009.8 134289086.9 597598179.7 345165561.8 198618291.6 133525865.6 292712058.3 103804882.4 186134899.9 386357122.8 118469773.5 205392319.3 181548877.4 229756843.3 196416871.3 447575317.7 225728715.5 207398283.6 331973235.9 279895424.6 337270193.7 9753437.6 746934760.7 10039528.7 3598805.1 Vanillylmandelic acid 0 0 55385690.6 54023320.5 149220578.6 52621625.2 76790247.4 37276965 8022693.3 51829197.6 35532852.1 48481973.4 105223446.1 193278689.6 236910534.3 69119217.9 99410613.1 106663345.1 76095847.3 127672810 79366485.8 116757751.3 36309893.2 32467535.4 47389983.4 27188834.6 0 72850574.4 98967790 88021852.4 80178732.1 102168726.4 64428781.6 26603674.6 42805349.9 48758710.8 133947691.2 34757238.1 135208572.1 46207847 14557127.9 90341862.4 97493401.8 2482831.3 72229922.7 98636627.4 33720795.8 117752069.9 47693219.2 52295032.9 0 0 56441301.5 50779324.6 13071629.9 50915838.1 1126334.9 52245841 48347218.8 152179743.2 100420612.5 177626338.5 87318839.3 192931928.9 53969445.8 43998571.7 67020940.7 86402106.1 63946084.4 47032572.3 71165103.4 32552712.5 96213631.7 50333196.2 48189442.7 51744547.6 60586193.4 93194889 32454632.1 61905180.5 1461710.1 90541809 91214669.1 115499403.7 73623135.5 21983409.8 46908220.1 86955073.9 64646626.4 42018536.7 153579062.9 55124583.1 116227648.2 225799762.3 30545182.3 54456089.5 45608326.8 129851244.5 32181720.7 52791744.9 44787730.1 0 0 53424798.8 47108394.7 25698627.9 65697111.2 124982455.3 9912923.8 119245913 56832895.2 114157129.1 73050877.1 123231695.9 25960588.9 100641556 122823233.8 84840590.8 104030085.5 27203779.8 3582379.6 10854792.8 75641719 125790032.7 75583507.2 54794693.7 58057868.7 96878231.8 48174036.8 250896921.3 17823027.9 133385363.8 96704898.3 32123236 23222890.1 59479630.9 95294843.9 118604198.8 89943899 38677002.7 92466086.9 108440849.1 37729479.8 55149097.4 122215995.2 26597393.8 13927450.7 42021268.4 45438022.6 0 27097436.7 55034569.8 54889598.9 80813458.3 60150588.9 45203861.8 85778642 419467476.2 52251586.6 96622137 90678398.6 59459835.5 56306257.8 96978361.4 54641645.5 63330892 50465630.1 120021695 129375844.9 31845000.1 99078193.9 49405653.8 80512072.7 126285107.3 63507188.3 25726870 54993196.5 51848536.7 90455703.2 58623196.5 57556701.9 50159769.1 39920113.1 68436913.7 71950356.8 76340418.7 61435881.2 84506016.9 50030443.5 51366517.6 45904739.1 48832232.4 58013186.6 54031950.1 74808077.1 74721508.8 76002505.7 57230321.7 54888458.9 22788162 54414013.3 28570274.3 31651681.2 Tryptophan 42319440 45087042.9 20410585.7 19919416.8 41940761.6 27073899.1 30566494.6 9460871.7 10648002 34102832.6 26211801 26876535.5 16954675.3 53196588.4 19421510.6 25265997.5 23084256.8 46917461.7 23963633.7 41109397.9 18189423.2 32631654.5 31794740.2 25771054.5 21735611.9 20198705.1 4063463.1 36534800.1 22751554.5 30991627.1 22607318.6 69901863.5 17955954.8 8934418 23743556.5 13961496.5 51100929.9 19325617.9 27074750.4 19591362.7 12562574.5 36595360.4 24798857.2 16513836.4 24492877.1 33633900.1 21039092.6 20572251.8 20604087.8 20192485.4 48783621.8 40385739.5 20589185.2 21604677.2 12901201.6 12712131.2 15964100.6 45151607.3 9564263.4 30557403.3 38767665.5 27595198.6 46583738.4 23488313.2 15156913.2 42911659.7 18933529.1 23535107.6 28008285.9 12545581.1 13133798.1 29634807.2 29015162.6 21820841.2 40621560.2 23516830.2 22443243.3 16047679 28851923 22056930.4 29811280.5 23051207.1 28209616.4 9554136.5 39507281.7 9625604.1 24401358.8 61040118.6 19086555.5 26832934.4 19566599.9 20891392.1 23864660.7 60112575.5 23087581.7 8079625.7 48694975.1 26890535.4 42814369.8 21600277.5 22799627.1 50305176.5 49250134 17524593.1 14216203.7 22455458.5 24464387.4 31687524.3 22894834.6 22478490.7 23106904.7 47736847.2 24713955.5 24566079.5 38357293.5 39801560.6 18901557.7 20350868.9 11507090.3 18154494.8 9707119.3 6110938.8 32720175.5 11381090.7 49140646.9 22536124.8 21906801.6 19044077.3 18440662.8 43520008.6 9557877.6 35023383.4 31806311.1 27940176.2 21240776 16186581.3 27571239.1 43027000.2 53206872.1 23445746.9 23287836.4 47499191.8 37792109.3 22521994.5 33369905.7 33988541.6 8196834.9 20679586.4 19237589.3 55048932.4 55359690.7 19426219.5 20170505.7 19436459.9 30712155.5 32227049.8 22711822.7 45100392.4 27878439.9 29076709.6 15430609.3 14505595.3 28531753.2 25600640.7 17653920.3 18059030 20816522.3 29515761.4 31362250.1 17695749.6 33178781.5 20406578.8 35861626.4 55858226.9 27134233.3 5202626.9 21636385.6 35449468.1 31198647 26910855.3 20610046.7 25921622.4 12131358.7 42046567.2 29098105.5 16253891.9 31274487.7 41187965.1 11191648.9 15124090.7 23653706.9 20370303 22656317.1 29319280.1 46111767.8 17506351 31915171.1 17694417.8 22907344.5 1245867.1 20559487.6 65837241.5 48889102 N-Acetyl-L-phenylalanine 0 0 26734029.8 26250076.2 34063484.3 23108192.9 34318165.6 14603812.8 5661806.7 22709424.4 28680264.2 15241723.3 15417164 19761971 31429931 20232362.8 41711565.7 13494832.7 28196965 50876106.1 59324950.3 39307097.6 25278269.3 40677689.4 21775531.3 12014367.4 0 14444712.9 14028242.7 12579205.8 18694862.7 22181330.2 25523769 31364411.8 21888563.2 10000531.1 20240875.8 11052859.7 48610196.6 16251414.4 5082728.5 19200272.6 18792814.3 8346579 8342668.1 17842948.3 13373492.3 32615482.1 23696566.2 22639199.9 0 3274998.5 22491556 22262047.5 13834774.7 12086058.3 8698429.6 21898930 23437159.8 21261585.8 30542834.5 31843403.1 15735908 21415070.6 27300690.2 16308457.8 16267618.4 26648485 17323398.2 19939328.3 90144071.1 10882616.9 20399305.4 8489031.9 11282063.5 25433355.2 23834841.1 32067601 11996206.6 11698552.8 10411761.7 15630669.1 15609609.4 47832937 19262453.9 14268069.3 22600167.1 15862853.4 19232681.3 20782915.4 17655350.3 49001684.4 9289289.8 27498372.9 8936664.2 16950127.3 16911613.6 36067117.5 19336137.4 24107049.6 20691698.1 3360371.1 0 22339597.2 23437749.8 9516621.6 24335137.7 28962535.8 13404128.9 32075232.8 11496671 16495404.3 18794414.5 37417233.7 63809574.1 27998257.2 44032154.1 29285563.7 38714869 10527144.6 5341886.9 4052790.2 12227805.7 15708045.6 24446826.3 22973805.4 20593723.6 24128393.9 15634428.8 59673598.6 16580671.4 28294953.7 24011456.3 8698932 12059391.8 14730389.4 38621381 26754811.1 13504776.6 8847810.3 24068332.6 31189183.3 22235517.8 15320109.7 30751613 8950351.9 6367552.8 19985615.8 18860133.6 0 1132723.1 24921166.4 22564951.3 15626532 8270086.1 10819986.9 51736336.1 8838581.2 19126719.1 14092030.1 24405525.7 40112622.4 45204377.3 14942984.9 9748049.6 17827675.1 16351011.2 30321187.9 54746550.3 3933205.2 18307066.6 5523952.1 53177641.7 24053102.2 29884086.9 2459308.8 22091790.6 15182600.1 24360028.7 28483674.6 29058412.5 6313529.1 21594244.2 22278850.7 48213922.4 20892327.6 32047408.7 24500040.1 9672109 27938379 10966767.5 27080769.2 17075962.5 20171552.8 16985390.1 36364430.1 29189014 24586098.1 15157730.2 1303206.6 22214973.2 1083765.6 1190094.6 3-Methoxytyrosine 0 0 15100930.9 15049986.8 11463147.7 22318323.1 18029773.6 7166369.8 3065479.4 0 6959968.2 7032345.2 5858418.2 11362209.4 27045726.3 18184315.5 16048689.9 17687420.1 26107543.8 8461335.7 15016537.8 2853709.4 12960710.1 29400052.3 2828607.9 6872635.2 1781960.1 16922123.9 16046117.6 1721270.4 16447445.6 15644124.7 26505584.1 18438839.4 11747148.4 8107240.2 17842641.7 3604455.2 16892194.8 7819087.8 14280438.2 4482301.4 14906160.7 2619727.3 6109142 14488787.9 9327257.9 13067617.7 11741531.8 10843314.6 0 0 13638327.5 12676490.7 4945775.3 5379630.1 0 8852163 15020907.2 0 4907960.6 25156648.4 5834164.8 19413981.1 21469093.1 11300552.6 0 13151662.5 13274493.1 0 16750720.2 7587543.2 19128784.3 0 9443263.4 14515404.7 13119292.4 17923107.4 0 8815556.4 0 10107650.4 23054498 0 6136554.7 10500975.3 16103290.2 0 9139063.4 0 5789735.6 6932213.2 10183659.7 44829071 4582812.3 2176455.3 10975485.8 11801372.4 7142948.9 11672054.9 11514477.1 3248926.4 0 13869921 6884617.2 6764718.7 46172331.9 7315281.9 6442988.8 2328254.6 0 12217080.5 19749997.3 24203884.6 7141228.5 9069792.4 7100262.5 12355256.6 18283197.3 3754282.6 0 0 0 20999496.9 14316774 10800041.7 13878414.1 6977924.5 6990630 18842143.1 7253325 16217061.5 14216390.8 0 7897518.4 11654971.1 10654810.4 22507655.6 11806222.8 5670354.8 8640144.5 22012931.5 0 6749716.1 9110976.4 6979000.7 6786324.2 12235108.9 13218379.8 0 1512587.7 14653598.3 14088431.5 29950633.5 6920783.3 14336745.4 4943715 14871004 0 1090031.6 14561927.8 14486895.6 0 20507757.4 7359096.5 10517949.7 0 5491332.1 24212413 0 23407468.1 0 17338749 28799381.7 15113317.7 3790920.5 11083906.3 9484256.2 5331907.9 5950458.7 0 0 2936309.3 16805105 17752771 30557312.5 6630879.3 13917376.3 9695625.7 0 0 0 0 0 10305144.2 11850107.5 8357856.4 7988602.8 0 0 10037856 0 0 Pantothenic acid 0 0 17910807.1 19264251.2 27242421 21337784.6 16797932.4 30375625.7 5003807.7 16582061.8 27322395.5 14653947.1 29999889 40620241.2 132428132 4061652.7 41058540.2 70961808.1 38733716.4 50140953.5 26584256.4 55797316.7 20189206.1 19040812.3 18590708.2 36986006.8 0 48826860 51925593.3 40284064.3 27723267.8 22076116.4 23844397.8 6361966.4 22103568.5 14917106.9 27051332.2 25756334 76100441 32572946.4 13093393.3 52172983.4 23399893.7 11307239.6 16595159.4 22537738.3 9617664.1 29056395.9 17254411 18737803.1 0 0 17708118.4 13155697.6 8786203.6 9294379.9 8458312.2 39577355.5 24011954.1 44845971.3 35426235 42077704.7 59240824.4 71951092.8 28271506.5 37695203.4 23328366.8 23605079.5 0 27626606.6 42863871.8 27407560.5 26811563.4 61111244.7 45493910.4 18105518.6 15639614.6 26379281.1 19686681.1 14618533.8 6417190.5 57392539.5 12893736.2 33543798.6 28891791.1 5932612.6 25247788.8 28863593 34034730.7 10371397.7 118791456 27785651.2 47158968.4 69386902.6 22033459.9 14299082.3 10914604.9 69544838.9 10522417.1 16064036.3 17335652 0 0 18853524.4 20411449.2 41225285.4 17113998.9 62529515.6 17868396.8 151507076.4 30394821.4 18511173.3 53068332.5 41722210.4 23552833 61909202.9 39845965.2 80848840.3 27079741.9 20655397.3 7825484 47109711.7 26478260.9 25143753.2 46008898.4 19061633.2 20544061.7 9990684.1 15115212 34069176.7 11653477.1 39417305.3 19025368.1 17055387.9 48655482.2 23960290.3 33376124.3 16529448.9 24132616.2 9998591.2 26727062.8 26637768 19646582.6 26348883.8 21015572.6 11293737.6 12213258.9 19585222.8 19921009.4 0 0 17626398 19827629.9 16159721.3 32392680.3 6222643.1 41910430.7 13632216.3 63174697.9 46403014.2 36368156.8 36477117.2 10506114.5 21325056.3 11610023.2 11312744.7 100510181.6 42899634 81894240 3012729.2 24877564.7 14907274.2 47820035.3 56167960.3 42549739.9 5051489.7 19259639.4 14593070.7 68076895 28543378.7 3758425.9 14750414.5 12208542.5 57802841.9 36594061.8 43611782.4 18738050.5 0 35338719.4 6398806 18193886.1 9956132.2 60816282.8 43171817.6 47182448.2 53826597.8 30229718.9 31140709.3 13429079.2 0 18922178.2 0 0 Ribose 5-phosphate 0 0 7916244.4 8004561.3 4617861.5 4539717.4 3296847.9 3147122.6 3084161.1 5379548.5 2526353.3 3764243 3797227.9 7516073.5 10508335.1 4275468.9 9182226.5 4548040 3693748.9 5950741.3 2891278.8 4403112.1 6056257.4 5712003.2 7350025.1 3419583.1 0 4306958.2 3561076.4 4360566.6 3595145.3 15148896.1 4836614.4 5177327.9 4290985.6 4287309.3 3523870.3 3062656.4 4191097.3 3905623.5 4589404.4 7895069.2 6572777.1 4913329.1 6265634.4 8072244.4 5207846 5558669.6 7362603.1 8178303.1 0 0 11618089.5 9886547.1 3007616.5 5446047.5 6971884.5 5716979 4984468.1 4830238.4 5153624.2 437891.7 5803285.5 4690814.9 1262010.7 4150154.1 8115186.6 6416621 7202620.3 3133314.1 3218452.4 4462213.7 3925805 3939399.8 2322873.1 9851064.3 9491933.8 1529570.1 5394363.8 6276329.8 1720501.6 1879216.2 8056404.1 3049368.8 5766084.3 4392679.9 4845978.5 6004538.3 5713841.1 1670519.4 6420133.3 5400903 7645084.4 6212110 4397728.8 6145119.3 2665451.3 5514214.2 6169064.7 6428218.4 6603590.1 0 1153305.6 6496391.8 7380964 3927202 3183560 6437426.8 6183241.6 5299765.4 4961217.9 4320072.3 5493237.1 5823520.5 3429794.5 2855050.1 3238029.3 6845358.1 4274694.2 5285036.4 5328147.6 10666423.2 4163428.5 4366695.3 5416639.2 6263299.1 6730508.1 4686901.4 4788049.9 4157215.5 4153704.3 5391149.2 5030922.9 9626811.6 8937347.3 3140990.6 3440305.3 3031804.9 2882464 3119747.7 3524023.6 3261258.6 3411619.9 2011492.8 4297912.5 2134875.1 19812807.6 5962727.8 5993188.3 1102997.5 654745.3 8960910.3 8538267 3788522.4 4533516.4 4574099.8 6161277.3 1987195.9 5236906 3253037.2 4138060.1 6320935.7 5463627.3 3326117.8 6852835.6 3751170.5 5222232.1 3485300.5 6668833.6 8272817.3 4665773.3 4022268.4 3005678.6 3960993.3 5352241.3 1176153.4 5481907.9 2478764.6 2576029 3754295.8 16672997.6 13378678 5278128.8 3550031.6 4891794.3 1652041.1 5133326.3 3408078.3 3245723.3 6647917.4 3660149.2 3691677.4 7219918.5 6730667.7 4760814.1 5513557.1 3790680.5 5666394.9 7632411.8 636439.8 6176282 867527.1 0 Cystine 2845619 2555900.8 1371545.1 1359670.1 0 0 6558413 0 1926443.3 1414771.8 0 3107864.6 0 3854633.2 5531822.6 1809531.4 1081615.7 2028528 0 2555241.9 1774151.3 1653125.4 2507760.1 416534.5 711281.9 1226121.2 166770.6 0 1585250.8 2359649.9 0 0 0 0 1869874.4 0 4932692.8 1142145.2 0 2583911.3 0 3874647.8 1822077.7 0 0 1966371.6 0 1287116.8 537095.3 1096795.5 1886108.2 0 793725.2 4784991.6 0 1213621.2 2270610.7 2478948 209872.1 0 1250598.6 0 0 0 0 0 0 2534328.3 1365190.1 2097432.9 0 2586449.1 0 3882462.3 1291549.9 2668684.5 4573319.5 399590.4 1728278.8 6311536.4 705865.7 0 1267764 1656053.5 1162402.2 0 0 0 0 0 1034099.3 0 1993386.8 0 2767620.1 2761628.9 0 0 0 1629802.1 1669181.7 0 942721.9 1342641.4 1509037.6 1128817.3 447362.7 828012.3 636308.1 954586.8 3018397.8 1303329.1 2165551.7 2100187.8 5523894.2 0 0 2434126.2 0 0 3400650.9 5935971.8 0 0 1447205.9 1926373.4 1139924.6 0 735013.1 1587781.4 0 4708113.7 1753218.2 2252047.3 2932679.7 499694.5 4122822.4 0 0 0 0 0 4281423.5 0 1523720.4 941757.8 2362774.3 1932626.8 756064.7 0 1979879.4 0 507833.7 0 0 3339585.1 0 0 1937587.1 0 0 2470161.3 0 0 2152169.1 0 1302695.5 0 4198135.2 790093.1 0 0 0 3147863.3 0 1021619.3 2963016 0 0 2596688.2 0 4412003 2890066 0 0 0 2564628.8 0 0 0 41003.6 0 748725.2 4309905.4 2330833.8 0 0 0 2517978.3 910584.6 3563427.1 2982839.6 0 Uridine 19942572.1 18525843.9 107939555.6 110532006.6 125826927 141281294.6 112619374 82593947.8 94981234.3 97629714 110503807 120713625.7 125217107 259649196.1 293326184.5 128302980.4 171712319 141290525.6 134160967.3 168680874 122360137.1 144225766 120833916.2 91672538.5 105787529.3 78929865.9 25950745.2 138781101.3 141495638.2 154643031.9 101770247.8 137569198.2 97148246.5 77061110.7 72124249.2 107024160.2 170048180 90462009.7 137312897 89263227 73235756.3 160043483.3 142852158.3 77631028.7 104269551 172006138 107423344.6 129030991.7 107795384.5 105053755.3 19443281.9 4943561.9 104005842.5 98304753.4 59966316.1 105157014.3 86900979.7 90871103.4 86761288.1 227800540.4 135702357.6 141847846.1 170962455.9 140311243.4 84666912.9 145574605.5 132756119.3 134399046.7 154466074.8 85723966.8 107479563.1 72038116.1 109216350.5 116789529.3 129094869.5 105723581 108902445.8 83993171 116864203.2 110776958.3 63964551.4 106788469.4 135344810.1 108379583.1 166734178.2 62869387.3 103467341.5 262874851.7 125382461.8 110526468.1 133793644.8 155472459.7 91890485.1 280133534.4 75191607.6 105634311.9 136326384.6 172465782.7 100259668 110942465.3 110503182.2 4574090.5 0 99012592.9 104751779.1 86149045.8 45850984.1 181636828.4 98125430.3 148623069.2 103624498.4 99382970.9 176027634.8 170947079.5 43526026.5 94135138.8 122696245.5 105900234.2 123005599 78830791.2 78474150.6 108848227.4 144411898.1 147588591.1 204550244.3 105757087.1 117013342.7 83875730.9 103746478.7 191139567.7 93023334.1 208193399.2 161808107.2 98134131.2 142819948.9 153687276.6 178747251.6 146382324.1 156686519.3 153590751.1 164571741.4 139720223.5 111910419.2 98220825.6 99633058.8 94174341.1 84264712.2 100992717.7 104901613.4 0 0 96202390 100330126.9 142359321 92713539.5 102414730.5 187651408.6 126063461 114355805.1 189278061.3 164832988.7 132068982.9 103351388.2 182032396.4 132483113.9 122105879.6 109897746.8 127537062.7 212422277.5 84634523.4 175894696.9 126351263.7 113732161 102426821.1 183336798.7 53033716.3 106619503 78825029.5 89674769.2 102057957.8 98411522.8 151638104.5 102915325.8 157170243.5 148876051.6 97359093.5 87572390.2 111182634.4 97468990.6 116392564.9 137550148.5 138005171 130553082.8 120205952.5 228497887.2 148991922.7 142859556.7 116389318.9 112578014.6 5485525.5 107883954.3 0 0 Palmitic acid 2670455732 1424299859 526726354.5 490588835 199524781.9 400995512.2 335009763.7 259215262.7 250836103.1 775747879.6 451598013.1 227301199.7 212203650.4 4467281734 211567276.9 221973344.9 247357411.3 292768631.2 357681631.4 272955022.6 510154671.3 216467816.8 225899981.2 229655855.8 385291865.4 204432923.1 73299628.6 462299851.5 473594093.7 237709058.7 717592442.5 414405480.6 238101733 252267482.1 227959833.9 269887452.3 249262798.4 248014495.9 241970241.3 239522420.3 244518362.1 301327101.5 234518110.9 220525608.2 300721508.7 295145995.2 272387533.4 273079602.9 501953097.8 514976088.6 1522123563 2682392375 858056548.7 768835575.5 151941350.1 139185093.4 129412645.8 87596118.5 187613206.2 221362350.4 586544320 260221982 162365462.7 273160582.6 165093716.6 276671348.5 229291131.2 320323865.8 278517460.4 151435024.4 146814983.9 232458469.4 383081950.5 161600139.4 307281715.3 1137655110 1318817353 321188579.5 380206731.1 244577940.8 234668354.2 149336485.1 189698035.6 429765006.5 406734400.6 402463376.2 275960979.7 285171903.4 303427726.9 372973661.8 289918499 297242683.6 282417167.5 530602682.7 304671639.8 228362094.8 373300481.9 312123766 220618559.4 825840047.5 814505640.5 3683450199 2821800345 560800453.5 690814777.7 230389390.7 251223177.4 384322683.2 174829489.1 235367249.3 136989075.3 211427063.1 200373525.3 257837279.9 233987890.4 223404632.3 189830552.3 318304466.3 311197774 226373652.3 232700499.8 148894092.3 1167415454 214391710.4 337319908.1 645938850.1 647077362.3 262636205.2 490910417 371224236 268283111 414419126.9 220852531.8 287160564.8 169431531.4 252335339.6 298313327.9 294686036.1 275926246.3 395735312.6 233785766.9 252640664.8 268029611.7 397560579.4 452813173.7 406929851.4 261784238.4 945191691.7 806660539.9 3280781403 2243265976 397657096.9 392550260.4 319413434.7 188940217.5 198059897.3 403750267.2 219414306.6 204292028.1 277132848.7 561526849.8 255553781.4 533201004.4 241875883.6 247335322.2 264360440 243736000.1 256036824.2 240110618.9 284647504.9 493719490.5 346986180 244860191.4 222873943.5 276612415.1 47659213.9 420698313.6 250160902.6 232695873.1 350968241 323676698.2 264501516.6 230540624.1 263510089 325242330.8 210875692.3 277469760.6 295662708.9 247054401.7 666379338.1 274331750.7 275020143.4 304560865.2 248109635.2 725759861 283077205 365070102 389663892.7 323259938.6 268774405.2 397589122.2 2486792809 4248347410 Heptadecanoic acid 55733553.6 23018396.4 10873045.8 9387468.2 4741422.7 13363791.7 13545057.7 20902718.9 6543678.6 9471999.2 12961058.5 6319007.2 9639069.1 790589211.8 6394330.5 6654035.3 10428260.3 9438627.3 9230797.6 7445257 14239107.5 8091602.7 6030086.9 4327022.9 10038624.7 5543379.7 3334780.9 11313986.9 10221172.2 8999754.3 10133043.4 7245334.7 5642260.6 7449718.7 5405549.4 10324073.7 6675467.8 6344407.4 6563928.9 7424836.8 7114886.5 10315804.2 5898651.9 5335337.3 7306793.2 6830161.3 6612922.2 7876942.8 12506048.8 12649236.6 23569435.5 113427398.5 22828749.6 18845665.7 6942606.2 7769119.6 10242257.6 7419506.9 8463492.6 24263982.6 16972009.5 16079760.8 12861848 72408000.2 25471365.3 14427109 17929855.8 16827049.7 17599813 9990578.3 11636074.1 11514598.8 17561075.1 11565804.1 14806619.8 29867803.5 33117455.1 15293355.2 31720290.2 30706960.3 23690250.6 9810925.4 12683526.8 20350721 38468754.7 15473253 14152963 14984998.4 21380306.7 16233514.4 15199975.7 14108251.7 11831967.6 14936896.6 23895301.4 21918102 13243784.9 17183818.3 15153481.1 32436712.8 32659531 105366538.5 83351095.4 19843675.9 28338117 11692930.6 15047984.2 38251251.3 6745328.3 33437362.1 7836670.9 11821785.2 14825188.5 19647118 14727827.4 16519388.1 13366022.2 25811778.8 15879047.9 12971517.4 16512882.3 10597946.5 23864824.7 11638688.6 11931268 32511781.8 34667372.5 17060369.4 87318713.3 14192197.4 16620427.1 42081455 11234569.1 17479137.6 7175722.1 15506398.7 20787126.3 16388615.2 16250384.1 15329447.3 10900038.1 9605493 22794335.4 15032369.8 15050676.5 10414830.1 8603940.7 36719341.2 36568108.5 95753372.4 90431937.2 17616038.7 15375431.1 1897680.4 0 0 18390244.1 0 2108639.2 15791396.3 31834782.2 5624024.1 100629771.3 1809918.4 5190158 2480561.6 7596462.1 5627526.2 3759364.1 22768168.6 15236642.2 14961737.1 4826788.7 7805563 2573816.7 0 32149369.7 4988390.8 4101211.8 9193533.4 33929686 3987461 511547.7 5432075.7 6036729.8 1074594.9 15733974.8 5308783.5 4710708.9 117230171 8179216.2 8746525.6 39972580.9 0 48691746.7 17971539.6 27660812.2 1083283.9 3373112.3 0 31777770.9 107969181.8 259370402 Gamma-Linolenic acid 431807287.5 279643266.1 0 0 0 0 0 0 598519.7 350088.3 453279.1 275353.9 502907.4 49808396 451903.6 304752.8 0 0 0 233126.5 417056.6 346837.8 297046.5 0 0 0 564665.1 0 0 0 425320.5 0 309834.1 0 44485.2 0 232870.2 0 34185 0 357937.1 119105.8 0 53776.7 266579.1 362448.5 151258.2 0 0 0 304647188 356519954.4 3782284.7 4053532.5 4682981 4320158.8 4423393.9 4395998.1 4491556.2 4304895.4 4405407.4 4505940.1 4463418.9 4913423.7 4509302.4 4391507 4396852.4 4427279.8 4409380.8 4153945.1 4092716.6 4604331.1 4519106.2 4116567.5 4229916.4 4167625.9 4441896.5 4474400.3 4260945.9 4763652.4 4391585.6 4339170.2 4062422.7 4148317.9 3820805.7 4192090.9 4209126.7 4529954.2 4339370.4 3799412.4 4423585.2 3946838.7 4283646 4264204.5 4456185.4 4184643.9 4408563.6 4416399.2 4353591.1 4050569.1 4482359 442160761.9 349316268.6 3782667.5 3477808.8 3535023.8 3856145.1 2737455.6 3855071.4 3771489.9 3604938.4 3933382.4 4749748.2 3255145.2 3961594.8 4133443.1 3634039.2 3802522.3 4069686 3853795.6 3891056.1 3996020.1 3765675.5 4011815.1 3375107.2 3656055.4 3939631.2 4028783.5 3801285.2 4002484.8 4246784 3862665.2 3868539 3968877.3 4092789.7 4129438.6 4147983.1 4362754 3877176.1 3340370.6 4211315.4 3734907.4 4497734.8 3880203.7 4545694.1 4246328.8 4010132.5 4128158.7 4384579.3 431716592 308025464.7 2020478 1506601.7 1175763.9 1178013.9 1174684.1 1214009 1009995.3 1021863.3 1296634.3 1236609.2 1204727.1 1041279.5 1077491.2 1166535.5 991116.1 288367.9 1083314.8 911679 1141642.4 1025390.7 909641.4 891421.9 1157569.1 1077125.5 1101688.3 1141064.3 1050073 826615.1 262931.2 904252.7 1200845.5 916728.4 974319.8 1050311.8 1245892.8 947569.5 1285373.3 1134932.6 1482132.8 989129.6 1166632.7 1052375.7 1069013.1 886620.4 1193020.6 1070097 970085.7 975153.3 879827.4 1664773.4 343610294.6 398925729.2 Stearic acid 1223917861 759064638.3 504433959.4 464084368.6 232097590 361861754.8 328691466.7 264941625 317856129.4 581685563.8 486465635.1 312641984.8 301309878.6 922974982 276581370.1 298529908.6 346234620.4 363345598.2 398645401.4 358460074.7 496227634.7 297026857 269594072.1 294771350.4 450800539.4 280578975.2 26621761.5 564106950 445946141.3 338167673 492146495.8 586371651.5 327165234.6 332007466.3 347042787 418662910.2 343832385.1 320644884.5 412146792.1 360451035.4 364182813.2 383701767.3 324677573.4 377356383.5 358922374.6 431217622 380337791.6 376684621.8 566976043.2 597372645.9 763901689.6 886835036.8 624555572.2 580606264.2 250507101.9 267906248.1 396340004.3 298047854.4 295568862.7 334846826.8 376557583 319926138.5 290008363.8 439025066.5 366915705.2 305903067.5 314193109.5 318741801.9 271560281 397015413.1 377344354.4 283844538 354943220.8 331396275.9 346477073.1 820670715.6 832302083.5 324681165.2 450661250 344784945.3 347160119.7 389067266.9 298287050.2 378917998.3 315935985.6 342234588.6 331577871.1 341885029.1 376856463 318385200.9 318581372.2 362833557.8 309217654.5 407647880.1 311545957.6 329626342.2 336776298.9 306564270.5 314443622.1 504278212.5 605575060.2 916563391.1 1057213329 402040257.5 475056533 371077173.7 478172419.6 453576770.9 240812778.6 430943243.2 262702539.1 370878139.2 420684338 387330667.3 342789225.9 399840804 276697449.9 385570849.8 328420344.5 303715228.6 410771331.1 183316083.2 653379117.2 339978149.3 439690596.1 545999166.8 542671568.2 292923475.2 409025172.9 365793331.9 376946705.6 427668735.3 333402720 363065679.3 286288310.7 254355013 277600262.9 419293161.2 400410326.9 402771134 319053140.1 236223460.1 417277326.8 493189271.6 345386101.4 183734708.5 199895053.5 571512688.6 488107097.3 948360162.2 736752637 407866286.7 410908968.5 381363485.7 307513542.6 347061302.6 411744391.6 299588430.9 340032095.3 364098525.7 442696749.5 369211093.4 408484813.6 324853030.5 378321477 326651557.4 303498763.3 329453403.8 327169404.1 349511938.7 419531465.8 317901088.5 306726864.7 307226543.1 326705237 188040343.3 397156206.3 341971071.6 324829067.6 423040831.4 331441566.8 323056398.7 318324690.5 338323177.1 333209143.1 346799756 401352660.5 359003263 331141114.4 413528320.6 371721198.6 346003775.7 335610346.5 302722659.7 598790669.6 369223676.1 369968585.6 346681193.3 380223764.9 151511902.7 343277529.5 753982345.3 1504228204 Retinoic acid 852369 649884.9 451763.5 406210.7 5240270.6 82233.1 8956793.4 104518.1 278257.3 57492.7 97048.8 949560.7 207170.2 0 241374.4 263836 0 1194566.2 206754 95297.4 294349 89911.9 46899.3 293458.5 255281.2 65849.1 52182.3 1638137.4 366312.6 70670.4 59974.5 1838600.8 44408.5 262738.7 147900 520303.6 0 1771462.9 167513.5 35308.7 0 7666389.2 69015.7 0 510580.6 0 121864.1 1078941.4 300432.3 337758.8 463002.1 0 835894.5 685489.4 0 560619.3 829198.8 522236.1 0 0 0 0 0 458406.7 761634 501503.5 398523.4 446251 589856.6 560321.3 0 435424.1 304132.3 0 437258.7 676253.3 778691.5 543072.7 0 0 2548327.7 690290.3 0 718672.8 0 0 426320.5 633114.4 770012.3 553849.8 0 0 0 624984.5 664391 534847.9 0 0 612917.5 1660904.5 1830781.1 0 650775.4 364629.7 675823.5 419110.1 1525947.9 1906235.2 310311.8 216827.4 473131.7 253772.4 526333.7 1666794 0 240171.5 1022569.5 0 0 551654 240663.3 357625.5 534751.7 1093332.5 172293.2 720499.1 714437.9 650581.4 532450.6 1269147.2 197843.6 1422182 1631302 120861.5 3329860.2 474220.7 0 0 100310.4 305550 720742.8 308971.7 362602.3 419964.4 408524.8 173126.4 572442.7 822485.7 879225.1 2036853.9 2022597.7 817829.6 605928.3 0 282839.7 2415630.8 439326.6 377289.7 537700.6 456255.4 0 0 783952.2 440437.6 193719.5 246032.3 662384 666270.7 1968841.7 459650.6 863095.8 0 0 344463.6 0 387873.5 558563.3 0 0 264517.5 0 661498.2 683262.9 692735.6 529896.2 0 541749 0 386554.7 356843.8 210469.1 383650.9 0 96915.6 423920.7 705703.1 0 0 436720.2 372819.6 573533.8 23769.9 4395259.3 Acetylneuraminic acid 5066527.3 5807177.8 16880183.9 18778585.8 18715150.2 19139955 13444050.3 19408800.4 25737039.1 23985695.3 18695720.2 17777122 14897055.1 31258861.7 106786098.5 22990943.1 29840857.8 20667691.4 19057607.5 26726139.8 13262860.2 23809450.7 28367020.6 20579241.8 17213780.6 20209103.5 6114568.6 18014236.8 18691937.7 22288157.5 16719124.7 19040381.8 15150799.5 15416779 15229808 14684671.1 25868798 18971405.4 26966835 22066777.7 17901797.9 32438036.3 29705850 17698004.2 24496206 24792111.4 27149909 27766618.7 14517402.3 16129009.7 5877275.5 0 17877587.2 17679419.3 15206705.4 31979485.6 26882609.4 15801495.9 19081731.3 36441625.6 24955841.7 31866378.4 19930426.9 21502929.2 2001046.4 21789157 33640881.4 29478604.6 20744961.9 35675167.1 4184842.1 23132286 9798544.7 23549380.5 18235544.3 18420534.3 12439173.8 6118477.7 15193649.7 29602047.2 20453923.7 4811804.8 31008820.2 24327374.8 24656335.8 32976462.9 22235137.8 26519121.1 31824159.1 1797325.3 31446302.1 43623620.2 24750429.9 33250872.8 20396346.9 52411870.3 2799794.6 39586997 21498889.7 5261220.4 7466638.2 0 0 15732696.9 21877091.5 28002406.4 6719167 32502927.7 26008406.9 24793385.1 47527348.9 21742419.7 22500166.7 30653502.9 12361511.5 18144654.8 14496013.4 37633373.2 27021028.6 18192695.4 38388211.2 45578485 42815958.5 16187146.3 35696860.6 12181624.6 24009351.5 18621603.3 11219225.3 32767627.1 12915813 34072590.4 31358548.3 28981553.7 48408388.5 6604490.7 15671132.7 6300632.7 3194699.4 23797148.5 13010991.3 13729243.5 9740852.1 1202693.1 16766055.5 0 32389563.5 18362794.9 10694682.5 0 0 24835493.7 25837328.9 19065249.2 24591403.4 29874244.7 24662825.4 3909725.1 40784562.7 29661932.1 26822749 34718410.2 13070411.1 15558886.1 28596538.8 14204879.6 36588175.7 13581984.3 45337779.3 24485452.7 14945376.4 27834975.7 12783594.7 17657911.3 24500643.9 1217416.6 9793204.3 8828928 9079530.4 25523993.2 34805249.4 47229388.3 33879041.1 9594685 36441461.8 4388737.9 13780911.9 13819205.8 23863453 15678084.2 11402079.3 14342206.5 16209223.7 43457075 34141299.6 23359612.9 18405832.2 25911908.9 33089447.7 0 12325762.6 0 0 Arachidic acid 0 0 393470.3 0 378126.5 0 0 1416488.5 66644.1 454551.7 733078.6 95081.1 184492.1 0 154244.5 0 193612.5 0 167952.7 0 71585.8 0 191744 196949.4 8470.3 87074.4 481725.7 0 109222.5 223676.7 0 63067 657874.5 0 286128.9 268989.9 206737.9 220027.4 315244.5 120969.9 631602.1 543415.5 1614.5 167277.5 60802.5 145718.5 0 343413.3 84130.7 1160364.8 141116.2 681795.2 235910 151019.9 101560.6 276420.9 292431.8 194005 325525.3 305449.2 146122.8 0 123360.7 0 0 110487.7 94338.7 122665.9 193920.2 168596.2 0 152197.2 159249.2 127840.4 0 480207.9 169844 128001.9 0 147900.1 101509 187278.5 308643.7 0 0 680031.7 214352.9 1775821.9 282464.3 154240.5 661477.8 336988.5 266520.1 0 94811.1 78483.4 464701.3 110776.3 218640 353146.7 170369.3 1084914.3 903362.9 262363.2 338163 207391.7 0 336243.9 95438.8 293890.6 325790.9 260757.2 539447.3 250811.9 369990.2 150893.4 209117 248707.9 221049.2 227165.9 262382.5 215530.5 190052.6 232741.4 0 86602.2 191402.1 80170.9 309891.5 167803.1 422666.8 0 86083.3 184073.1 246810.4 275501.7 140003.5 0 1659220.2 238946.1 0 163457.8 44615 978043.6 139727.6 0 96805.5 256817.5 0 403258.6 385273.7 0 0 0 197749.4 0 135226.2 59406.2 35676 0 33474.9 113950.3 0 0 119993.5 10746.3 0 86170 0 210269 0 67255.6 350001.5 0 0 442862.5 0 303887.1 193211.3 217014.5 0 176700.7 112525.5 0 983866.5 214476.2 94592 733642.2 0 712877.4 149895.1 100762 206604.7 165029.9 925297.8 221471 110508.9 160430.3 222722.4 740446.3 0 417940.4 1295686.8 Docosahexaenoic acid 298424686.8 234781539.9 301956.6 277075.7 177207.6 54789.6 450653.9 402366.1 393879 228490.3 3358.7 220412.3 284817.2 1250829.6 458633.3 635985.8 100263.7 221786.8 195748.4 14890.4 71209.4 218354 69470.6 51992.8 380410.4 862553.7 209154.3 614376.5 56198 1205028.2 424204.4 37690.1 596951.5 652751.9 346064 38917.3 354127.1 12909.7 40258 0 314834 18842.8 38579.9 406542.5 272912.3 691705.6 775428.7 542687.8 520459.4 633226.8 290885464.9 225640370.3 676575.7 675301.5 0 870920.5 0 712537.5 1265126.3 715734.9 545689.1 0 0 800326.7 0 0 0 784440.5 0 739061.1 387382.4 395949.8 626819.1 1219398 0 635734.1 616318.6 0 1227471.4 970575 910180.9 0 952588.1 623707.4 838258.5 622554.5 678366.3 605718 0 1195317.2 4733408.4 2342643.1 0 0 447720.8 0 683535 0 616206 796359.7 794615.3 317050769.7 263349919.1 1903373.1 1928045 1712257.4 1678382.3 1991168 1760162.1 1835203.7 1590803 2066084.7 1839739.5 1964928.5 2195956 3253803 2024772.2 1894313.5 0 1774120.3 0 1699854.8 1722613.1 1781459.8 0 1941941.9 1998931.5 0 1715418.4 1735325.7 1732466.1 2159659.9 1749128.9 1757358.5 0 1785283.3 1750007.6 0 0 1855988.5 2155213 0 2007932.3 2070762.8 1655118.8 0 1686677.3 2048454.3 2079187.6 323233512.4 233133392.2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 123674.2 0 0 0 0 0 0 0 0 0 285598887.1 240918108.8 Cyclic AMP 0 0 0 0 3253366.5 4254405.3 0 902018.7 1127340.1 2041946.4 1940103.1 1323996.7 2832955.5 5170743.5 0 1725622.6 5668343.9 6299540.4 0 4873188.7 2749924.1 2873207.5 2468154.6 1976190.1 0 1524357 741328.6 648799.6 3828882.3 3154653.3 1803922.5 6107053.7 2527418.5 0 1123642.3 2069320.1 3046170.2 1736961.1 3062506.2 1294211.8 893631.5 0 3743587.1 1882488.3 2481090.5 3446772.3 2791360.1 1846648.3 0 0 0 0 0 0 746331.9 1706312.8 1586212.3 1561262.7 1804704.3 5997369.9 3905586 0 4720303.7 3827685.9 1262046.9 4441975 2186988.5 2020836 2849231.3 1544184.4 1501821.7 1401512.8 2466906.5 2031750.2 2730728.1 0 0 884758.5 2307462.1 0 1126387.6 0 601969.5 1236635.2 4853856.3 0 0 4532680.2 3049066.9 1779462.8 4253879.2 3367888.3 3620628.2 6229260 1582858.9 1961058 4431073.8 0 2240003.3 0 0 0 0 0 0 1333856.8 0 4823191.6 1173182.1 2781449.5 2087633.8 1941191.9 3077574.8 2603396.6 0 1049565.3 1368470.4 1982531.6 2854783 1659286.7 994929.5 1173070.7 3079828.8 7164077.4 4056355.1 0 0 1367560.2 1608756.8 6371314.6 1506705.6 4271601.6 3670038.3 2062612.7 2207456 2634592.8 4340073 1710466.5 2088520.9 1864126 3633219.9 5601642.7 2738142.7 1666503.8 2553066.4 982031.1 2160425.6 0 0 0 0 0 0 5967924.5 2365627.4 1345531.2 3876551.6 2252258.4 1914125.1 3512087.6 1551613.5 1677691.7 3782686.6 2721364.6 2312324.5 1519434.2 2232117.8 2123659.8 4402714.4 919080.6 3917502.6 3006828.4 1983424.8 2899422.6 2416301.3 1276594.5 0 1106098.5 0 2038791.4 3602016.4 3620910.7 1487441.5 0 3517684 1054254.3 1373003.9 1927830.8 1616864.3 4656083.6 4057894.6 2413989.9 3930360.3 0 5840322 4278990.6 0 7346629 1887361.9 161588 0 0 0 Cortisol 1334627.5 0 0 0 0 0 0 0 274109.8 0 468705.6 807682.2 0 489932.9 0 4395246.2 0 0 0 0 0 0 0 0 0 0 0 752352.4 0 0 3807350.9 0 800969.4 0 0 236203.7 0 1082603.6 0 243646.5 2075174.5 0 0 0 0 3319111 829573.3 488976.3 0 0 0 0 618481.7 0 0 0 0 0 0 0 0 0 580335.5 448509.7 0 739308.7 0 0 0 0 408514.9 855920.5 788540.7 0 731877.2 0 1041197.7 745922.2 0 0 0 485385.2 699726.3 0 0 0 886398.3 5945476.5 0 0 0 0 0 2079812.8 0 0 1402701 0 0 0 941978.2 0 0 0 140627 0 0 0 0 0 0 0 0 531517.4 495102.7 0 0 0 1186719 0 525123.2 0 0 329495.2 0 0 0 4242521.4 0 0 411776 882991 0 0 466759.1 1273485.1 2942520.1 2772762.2 2782447.2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2542577.6 0 5083519.2 0 854223.7 0 0 0 1845599.4 0 3622694.6 879821.1 708902.4 0 169994.5 0 0 0 541619.7 731425.3 0 0 0 0 0 0 212174.6 0 0 227156.6 471414.6 1136026.2 0 0 145057 0 777893.7 0 0 0 0 0 766969.2 0 439443.4 0 0 479972.6 0 1795630.5 Tetrahydrocortisol 0 0 0 1405861.2 0 0 1253387.2 437915 1543187.5 1209187.7 2049777.7 5157452.4 0 2851524.4 0 9169964.7 2998673.1 3072881.9 0 2953975.2 1767251.4 1235237.6 0 0 1402252 0 0 1696277.2 0 0 6938935 8029519.4 3204187.7 0 0 1754292.6 1396713.8 0 1890920.4 0 2886028.6 0 7204750.3 0 0 6313466.9 3214484.5 2821171.6 1478253.6 1514996.8 0 0 0 1714524.1 0 639045.8 0 4011079 0 0 2419151.4 0 4347921.9 1232125 0 2463092.5 0 0 1657042.5 544948.4 2641749.2 0 2472231.6 0 0 1755892.8 1700775.9 0 507575.3 0 0 1941516.2 0 2290707.4 0 0 4475987.3 9307021.8 0 0 0 5567262.9 0 9914508.6 0 1917042 2667069.4 0 0 0 1563743.8 0 0 1308307.6 1326230.6 0 0 0 0 0 1166189.2 1523970.6 3565368.9 2876890.1 2260453.9 1962694.5 493231 0 4949265.3 1857449 0 0 1575586 3682176 1454000.9 1304868.7 1598863.9 10762658.4 0 1112277.9 0 5533563.7 0 0 3471749.1 7115951.8 7637309.9 6741098.8 3759934.8 0 0 768637.1 1518832.3 4423963.2 0 0 0 1374211.4 724397.3 0 0 0 0 0 0 6995145.4 2517072.3 0 0 608474 0 3167118.7 980798.9 6780758.3 5455395.6 1727268 0 4317246.6 0 0 5229277.9 4667583.2 0 0 2522910.8 0 712691.2 0 881916.2 0 0 0 0 4194508.8 0 0 0 5721355.6 0 3442243.4 0 0 0 0 1120478 0 636912.1 0 0 0 0 0 0 Glycocholic acid 8302078.2 6629453.8 12091878.1 12521229.6 10576700.6 2609616.4 6331434.9 8860389.5 6280730.2 5345594.5 6095046.6 7373967.5 3933156.3 35167622.4 60261128.9 7756686.3 28146427.7 21440559.4 4489144.1 14515659.2 27163184.7 14089115.9 13914141.3 26482981.6 10305945.9 3933707.5 0 23466561.4 8511001.3 0 9540107.2 8279538.3 10849105.6 3811804.3 6850077 11660219 10092860.3 6028707.5 27549692.9 8992051.1 8748652.8 1407864.8 12671860.3 4920614.5 5266409 15552642.4 16869293.4 13365319.9 10846452.9 9946543.9 7358160.2 7298283.5 11963951.6 10588947.9 9882976.9 3988297 3012626.7 9723580.1 8041357.4 6549565.6 14260449.5 19593431.6 9401049.3 13964813.8 26424561.5 8682386.5 8589709.8 12227376.7 5171918.1 10989112.5 33073404.4 5877697.2 15698307.6 9110900.2 4707719.2 12819174.2 12035265.5 9307433 5920907.5 8844055.8 4845970.6 23274234.4 11563702 71315509.2 13077746.2 7300161.6 11795169.5 10879476.4 16323550.7 9291147.5 8967672.9 13520152.8 3704159.5 14927345.8 3882030.3 14005341.4 9195001.6 13092402.3 12234894.4 9138472.3 9680701.4 8815529.1 6365383.8 20510221.4 15970565.3 6161225.5 7096017.2 5454927.5 5661226.2 8212076.2 16650460.4 3254178.8 4917337.9 9641795.4 11187822.9 17066528.9 21838929.1 18969810.6 42254377.3 7233909.5 9290561.9 0 15606022.6 453529.5 30547781.7 15555834.2 17915052.6 40765706.2 0 16519737.8 13716225 16352460.3 7053317.7 17178941.8 98341.9 10437156.9 18955669.6 13830998.9 12468065.1 17634613.8 1572577.6 11516751 5879394.8 2778620.2 11090798.6 1501867.9 1624684 16755179 12653609.9 8454408.8 7267563.1 11773301.4 10584527.7 57408873.3 4385382.3 7858292.6 25535964.8 0 8308080.5 17442039.3 7360236.2 9239935.2 23632142.8 43401591.5 2173736.7 18645106.8 7002002.6 11415942.9 26273726.5 3189796.2 24302831.2 7113717.6 21543316.8 5776856.7 9093804.7 953635.5 10041210.6 18923037.5 9736088.7 9547114.9 0 0 8129196.1 15982447.5 10244619.9 8439463 12095340.9 27997528.8 3735951.9 15795350.9 6079470.7 8276912.9 6733606.9 9700534.4 10679276.9 6925470.6 10208793.8 13464693.7 9823356.6 755996.9 8960532.6 8553498.5 8317481.2 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name chemical_ID Adduct InChiKey quantified m/z times MSI_confidence (1-4) Oxalic acid HMDB02329 M-H InChIKey=MUBZPKHOEPUJKR-UHFFFAOYSA-N 88.988 35.3 1 Serine HMDB00187 M-H InChIKey=MTCFGRXMJLQNBG-REOHCLBHSA-N 104.0352 22.4 1 Glyceric acid HMDB00139 M-H InChIKey=RBNPOMFGQQGHHO-UWTATZPHSA-N 105.0193 24.5 1 Uracil HMDB00300 M-H InChIKey=ISAKRJDGNUQOIC-UHFFFAOYSA-N 111.02 28.2 1 Creatinine HMDB00562 M-H InChIKey=DDRJAANPRJIHGJ-UHFFFAOYSA-N 112.0516 33.2 1 Acetylglycine HMDB00532 M-H InChIKey=OKJIRPAQVSHGFK-UHFFFAOYSA-N 116.0353 20.7 1 Imidazoleacetic acid HMDB02024 M-H PRJKNHOMHKJCEJ-UHFFFAOYSA-N 125.0356 25.6 1 Ureidopropionic acid HMDB00026 M-H InChIKey=JSJWCHRYRHKBBW-UHFFFAOYSA-N 131.0462 23.8 1 Aspartic acid HMDB06483 M-H InChIKey=CKLJMWTZIZZHCS-REOHCLBHSA-N 132.0303 29.8 1 Phenylacetic acid HMDB00209 M-H InChIKey=WLJVXDMOQOGPHL-UHFFFAOYSA-N 135.0452 45.3 1 6-Hydroxynicotinic acid HMDB02658 M-H InChIKey=BLHCMGRVFXRYRN-UHFFFAOYSA-N 138.0197 35.2 1 Caprylic acid HMDB00482 M-H InChIKey=WWZKQHOCKIZLMA-UHFFFAOYSA-N 143.1078 74.8 1 4-Acetamidobutanoic acid HMDB03681 M-H InChIKey=UZTFMUBKZQVKLK-UHFFFAOYSA-N 144.0667 27.2 1 Oxoglutaric acid HMDB00208 M-H InChIKey=KPGXRSRHYNQIFN-UHFFFAOYSA-N 145.0143 30.6 1 Glutamine HMDB00641 M-H InChIKey=ZDXPYRJPNDTMRX-VKHMYHEASA-N 145.0619 27.3 1 Lysine HMDB00182 M-H InChIKey=KDXKERNSBIXSRK-YFKPBYRVSA-N 145.0983 34 1 Glutamic acid HMDB00148 M-H InChIKey=WHUUTDBJXJRKMK-VKHMYHEASA-N 146.0459 25.1 1 Citramalic acid HMDB00426 M-H InChIKey=XFTRTWQBIOMVPK-UHFFFAOYSA-N 147.03 26.7 1 Mevalonic acid HMDB00227 M-H InChIKey=KJTLQQUUPVSXIM-UHFFFAOYSA-N 147.0664 28 1 Xanthine HMDB00292 M-H InChIKey=LRFVTYWOQMYALW-UHFFFAOYSA-N 151.0262 26.2 1 3-Hydroxyanthranilic acid HMDB01476 M-H InChIKey=WJXSWCUQABXPFS-UHFFFAOYSA-N 152.0354 31.7 1 Dopamine HMDB00073 M-H InChIKey=VYFYYTLLBUKUHU-UHFFFAOYSA-N 152.0718 28.5 1 Histidine HMDB00177 M-H InChIKey=HNDVDQJCIGZPNO-YFKPBYRVSA-N 154.0623 26.9 1 Indoleacetaldehyde HMDB01190 M-H InChIKey=WHOOUMGHGSPMGR-UHFFFAOYSA-N 158.0612 55.5 1 Oxoadipic acid HMDB00225 M-H InChIKey=FGSBNBBHOZHUBO-UHFFFAOYSA-N 159.03 24.4 1 Pimelic acid HMDB00857 M-H InChIKey=WLJVNTCWHIRURA-UHFFFAOYSA-N 159.0663 30.2 1 Aminoadipic acid HMDB00510 M-H InChIKey=OYIFNHCXNCRBQI-UHFFFAOYSA-N 160.0616 25.2 1 Tryptophanol HMDB03447 M-H InChIKey=MBBOMCVGYCRMEA-UHFFFAOYSA-N 160.0769 38.6 1 3-Hydroxymethylglutaric acid HMDB00355 M-H InChIKey=NPOAOTPXWNWTSH-UHFFFAOYSA-N 161.0456 25.8 1 Phenylalanine HMDB00159 M-H InChIKey=COLNVLDHVKWLRT-QMMMGPOBSA-N 164.0718 27.6 1 6-Methylmercaptopurine HMDB60412 M-H InChIKey=UIJIQXGRFSPYQW-UHFFFAOYSA-N 165.0228 22.5 1 3-(2-Hydroxyphenyl)propanoic acid HMDB33752 M-H InChIKey=CJBDUOMQLFKVQC-UHFFFAOYSA-N 165.0558 37.8 2 Pyridoxal HMDB01545 M-H InChIKey=RADKZDMFGJYCBB-UHFFFAOYSA-N 166.051 28 1 Uric acid HMDB00289 M-H InChIKey=LEHOTFFKMJEONL-UHFFFAOYSA-N 167.0211 22.8 1 Homogentisic acid HMDB00130 M-H InChIKey=IGMNYECMUMZDDF-UHFFFAOYSA-N 167.035 32.5 1 Pyridoxine HMDB00239 M-H InChIKey=LXNHXLLTXMVWPM-UHFFFAOYSA-N 168.0664 25.4 1 Glycerophosphoric acid HMDB02520 M-H InChIKey=DHCLVCXQIBBOPH-UHFFFAOYSA-N 171.0066 27.4 1 Acetylleucine HMDB11756 M-H InChIKey=WXNXCEHXYPACJF-ZETCQYMHSA-N 172.098 35.8 1 Aconitic acid HMDB00958 M-H InChIKey=GTZCVFVGUGFEME-HNQUOIGGSA-N 173.0092 29.4 1 Shikimic acid HMDB03070 M-H InChIKey=JXOHGGNKMLTUBP-HSUXUTPPSA-N 173.0456 23 1 Suberic acid HMDB00893 M-H InChIKey=TYFQFVWCELRYAO-UHFFFAOYSA-N 173.082 33.8 1 Acetylaspartic acid HMDB00812 M-H InChIKey=OTCCIMWXFLJLIA-BYPYZUCNSA-N 174.0407 22.1 1 Guanidinosuccinic acid HMDB03157 M-H InChIKey=VVHOUVWJCQOYGG-REOHCLBHSA-N 174.0521 21.7 1 Formylmethionine HMDB01015 M-H InChIKey=PYUSHNKNPOHWEZ-RXMQYKEDSA-N 176.0388 23.8 1 Gulonolactone HMDB03466 M-H InChIKey=SXZYCXMUPBBULW-SKNVOMKLSA-N 177.0405 26.2 1 Hippuric acid HMDB00714 M-H InChIKey=QIAFMBKCNZACKA-UHFFFAOYSA-N 178.051 34.1 1 Caffeic acid HMDB01964 M-H InChIKey=QAIPRVGONGVQAS-RQOWECAXSA-N 179.0351 32.7 1 Tyrosine HMDB00158 M-H InChIKey=OUYCCCASQSFEME-QMMMGPOBSA-N 180.0667 30 1 34-Dihydroxymandelic acid HMDB01866 M-H InChIKey=RGHMISIYKIHAJW-UHFFFAOYSA-N 183.0299 31.7 1 N-Alpha-acetyllysine HMDB00446 M-H InChIKey=VEYYWZRYIYDQJM-UHFFFAOYSA-N 187.1089 23 1 Kynurenic acid HMDB00715 M-H InChIKey=HCZHHEIFKROPDY-UHFFFAOYSA-N 188.0354 33 1 Diaminopimelic acid HMDB01370 M-H InChIKey=GMKMEZVLHJARHF-WHFBIAKZSA-N 189.0883 22.5 1 5-Hydroxyindoleacetic acid HMDB00763 M-H InChIKey=DUUGKQCEGZLZNO-UHFFFAOYSA-N 190.0511 32.6 1 Quinic acid HMDB03072 M-H InChIKey=AAWZDTNXLSGCEK-RKGSPJAZSA-N 191.0558 28.2 1 trans-Ferulic acid HMDB00954 M-H InChIKey=KSEBMYQBYZTDHS-HWKANZROSA-N 193.0507 38.8 1 Gluconic acid HMDB00625 M-H InChIKey=RGHNJXZEOKUKBD-SQOUGZDYSA-N 195.051 29 1 Vanillylmandelic acid HMDB00291 M-H InChIKey=CGQCWMIAEPEHNQ-QMMMGPOBSA-N 197.0454 31.3 1 Tryptophan HMDB00929 M-H InChIKey=QIVBCDIJIAJPQS-VIFPVBQESA-N 203.0827 28.4 1 N-Acetyl-L-phenylalanine HMDB00512 M-H InChIKey=CBQJSKKFNMDLON-JTQLQIEISA-N 206.0822 37.7 1 3-Methoxytyrosine HMDB01434 M-H InChIKey=PFDUUKDQEHURQC-UHFFFAOYSA-N 210.0773 35 2 Pantothenic acid HMDB00210 M-H InChIKey=GHOKWGTUZJEAQD-UHFFFAOYSA-N 218.1035 26.2 1 Ribose 5-phosphate HMDB01548 M-H InChIKey=KTVPXOYAKDPRHY-SOOFDHNKSA-N 229.012 22 1 Cystine HMDB00192 M-H InChIKey=LEVWYRKDKASIDU-IMJSIDKUSA-N 239.0166 39.8 1 Uridine HMDB00296 M-H InChIKey=DRTQHJPVMGBUCF-XVFCMESISA-N 243.0622 25.1 1 Palmitic acid HMDB00220 M-H InChIKey=IPCSVZSSVZVIGE-UHFFFAOYSA-N 255.2329 259.8 1 Heptadecanoic acid HMDB02259 M-H InChIKey=KEMQGTRYUADPNZ-UHFFFAOYSA-N 269.2485 269.6 1 Gamma-Linolenic acid HMDB03073 M-H InChIKey=VZCCETWTMQHEPK-QNEBEIHSSA-N 277.2173 223.7 1 Stearic acid HMDB00827 M-H InChIKey=QIQXTHQIDYTFRH-UHFFFAOYSA-N 283.2641 289.7 1 Retinoic acid HMDB01852 M-H InChIKey=SHGAZHPCJJPHSC-YCNIQYBTSA-N 299.2011 216.6 1 Acetylneuraminic acid HMDB00230 M-H InChIKey=SQVRNKJHWKZAKO-PFQGKNLYSA-N 308.0984 22.3 1 Arachidic acid HMDB02212 M-H InChIKey=VKOBVWXKNCXXDE-UHFFFAOYSA-N 311.2956 300 1 Docosahexaenoic acid HMDB02183 M-H InChIKey=MBMBGCFOFBJSGT-KUBAVDMBSA-N 327.2331 233.7 1 Cyclic AMP HMDB00058 M-H InChIKey=IVOMOUWHDPKRLL-KQYNXXCUSA-N 328.0446 21.6 1 Cortisol HMDB00063 M-H InChIKey=JYGXADMDTFJGBT-CZFMHFDVSA-N 361.2027 60.5 1 Tetrahydrocortisol HMDB00949 M-H InChIKey=AODPIQQILQLWGS-OBRSLYEHSA-N 365.2336 66.5 1 Glycocholic acid HMDB00138 M-H InChIKey=RFDAIACWWDREDC-MZMBZMQMSA-N 464.3018 41.9 1 METABOLITES_END #END