#METABOLOMICS WORKBENCH cararolopes_20250320_043622 DATATRACK_ID:5750 STUDY_ID:ST003884 ANALYSIS_ID:AN006379 PROJECT_ID:PR002436 VERSION 1 CREATED_ON April 30, 2025, 10:03 am #PROJECT PR:PROJECT_TITLE Respiration defects limit serine synthesis required for lung cancer growth and PR:PROJECT_TITLE survival PR:PROJECT_SUMMARY Mitochondrial function supports energy and anabolic metabolism. Pathogenic PR:PROJECT_SUMMARY mitochondrial DNA (mtDNA) mutations impair these processes, causing PR:PROJECT_SUMMARY mitochondrial diseases. Their role in human cancers is less clear; while some PR:PROJECT_SUMMARY cancers harbor high mtDNA mutation burden, others do not. Here we show that a PR:PROJECT_SUMMARY proofreading mutant of DNA polymerase gamma (PolGD256A) increases the mtDNA PR:PROJECT_SUMMARY mutation burden in non-small-cell lung cancer (NSCLC). This mutation promotes PR:PROJECT_SUMMARY the accumulation of defective mitochondria, reduces tumor cell proliferation and PR:PROJECT_SUMMARY viability, and improves cancer survival. In NSCLC, pathogenic mtDNA mutations PR:PROJECT_SUMMARY enhance glycolysis and create a glucose dependency to support mitochondrial PR:PROJECT_SUMMARY energy, but at the expense of a lower NAD⁺/NADH ratio that hinders de novo PR:PROJECT_SUMMARY serine synthesis. Thus, mitochondrial function in NSCLC is essential for PR:PROJECT_SUMMARY maintaining adequate serine synthesis, which in turn supports the anabolic PR:PROJECT_SUMMARY metabolism and redox homeostasis required for tumor growth, explaining why these PR:PROJECT_SUMMARY cancers preserve functional mtDNA. PR:INSTITUTE Rutgers Cancer Institute PR:DEPARTMENT Rutgers Cancer Institute PR:LABORATORY Eileen White PR:LAST_NAME Cararo Lopes PR:FIRST_NAME Eduardo PR:ADDRESS 10 LANDING LN, New Brunswick, NJ, 08901, USA PR:EMAIL edu.llopes@gmail.com PR:PHONE 732-235-5795 #STUDY ST:STUDY_TITLE Respiration defects limit serine synthesis required for lung cancer growth and ST:STUDY_TITLE survival - Effect of Polg mutation in NSCLC Em tumor derived cell lines (TDCLs) ST:STUDY_SUMMARY This study investigates the impact of mtDNA mutation burden induced by the ST:STUDY_SUMMARY PolGD256A mutation in NSCLC tumor derived cell lines (TDCLs). We characterized ST:STUDY_SUMMARY the metabolic profile of TDCLs harboring this mutation compared to controls. KP: ST:STUDY_SUMMARY NSCLC TDCLs generated from conditional animals PGKP: NSCLC TDCLs generated from ST:STUDY_SUMMARY conditional animals bearing PolG mutation. Here, we show that PolG mutation ST:STUDY_SUMMARY causes mitochondrial dysfunction, impacting serine/glycine metabolism as well as ST:STUDY_SUMMARY energy metabolism through glycolysis due intensive usage of glucose over time. ST:INSTITUTE Rutgers Cancer Institute ST:LAST_NAME Cararo Lopes ST:FIRST_NAME Eduardo ST:ADDRESS 195 Little Albany Street ST:EMAIL edu.llopes@gmail.com ST:PHONE 732-235-5795 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENDER Male and female #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS - 24h_04-1_1_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-1_1 SUBJECT_SAMPLE_FACTORS - 24h_04-1_2_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-1_2 SUBJECT_SAMPLE_FACTORS - 24h_04-1_3_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-1_3 SUBJECT_SAMPLE_FACTORS - 24h_04-2_1_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-2_1 SUBJECT_SAMPLE_FACTORS - 24h_04-2_2_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-2_2 SUBJECT_SAMPLE_FACTORS - 24h_04-2_3_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-2_3 SUBJECT_SAMPLE_FACTORS - 24h_04-3_1_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-3_1 SUBJECT_SAMPLE_FACTORS - 24h_04-3_2_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-3_2 SUBJECT_SAMPLE_FACTORS - 24h_04-3_3_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-3_3 SUBJECT_SAMPLE_FACTORS - 24h_04-4_1_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-4_1 SUBJECT_SAMPLE_FACTORS - 24h_04-4_2_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-4_2 SUBJECT_SAMPLE_FACTORS - 24h_04-4_3_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_04-4_3 SUBJECT_SAMPLE_FACTORS - 24h_26-1_1_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-1_1 SUBJECT_SAMPLE_FACTORS - 24h_26-1_2_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-1_2 SUBJECT_SAMPLE_FACTORS - 24h_26-1_3_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-1_3 SUBJECT_SAMPLE_FACTORS - 24h_26-2_1_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-2_1 SUBJECT_SAMPLE_FACTORS - 24h_26-2_2_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-2_2 SUBJECT_SAMPLE_FACTORS - 24h_26-2_3_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-2_3 SUBJECT_SAMPLE_FACTORS - 24h_26-3_1_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-3_1 SUBJECT_SAMPLE_FACTORS - 24h_26-3_2_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-3_2 SUBJECT_SAMPLE_FACTORS - 24h_26-3_3_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-3_3 SUBJECT_SAMPLE_FACTORS - 24h_26-4_1_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-4_1 SUBJECT_SAMPLE_FACTORS - 24h_26-4_2_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-4_2 SUBJECT_SAMPLE_FACTORS - 24h_26-4_3_PGKP_24 Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_26-4_3 SUBJECT_SAMPLE_FACTORS - 24h_31-1_1_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-1_1 SUBJECT_SAMPLE_FACTORS - 24h_31-1_2_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-1_2 SUBJECT_SAMPLE_FACTORS - 24h_31-1_3_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-1_3 SUBJECT_SAMPLE_FACTORS - 24h_31-2_1_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-2_1 SUBJECT_SAMPLE_FACTORS - 24h_31-2_2_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-2_2 SUBJECT_SAMPLE_FACTORS - 24h_31-2_3_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-2_3 SUBJECT_SAMPLE_FACTORS - 24h_31-3_1_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-3_1 SUBJECT_SAMPLE_FACTORS - 24h_31-3_2_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-3_2 SUBJECT_SAMPLE_FACTORS - 24h_31-3_3_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-3_3 SUBJECT_SAMPLE_FACTORS - 24h_31-4_1_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-4_1 SUBJECT_SAMPLE_FACTORS - 24h_31-4_2_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-4_2 SUBJECT_SAMPLE_FACTORS - 24h_31-4_3_KP_24 Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=24h_31-4_3 SUBJECT_SAMPLE_FACTORS - 48h_04-1_1_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-1_1 SUBJECT_SAMPLE_FACTORS - 48h_04-1_2_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-1_2 SUBJECT_SAMPLE_FACTORS - 48h_04-1_3_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-1_3 SUBJECT_SAMPLE_FACTORS - 48h_04-2_1_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-2_1 SUBJECT_SAMPLE_FACTORS - 48h_04-2_2_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-2_2 SUBJECT_SAMPLE_FACTORS - 48h_04-2_3_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-2_3 SUBJECT_SAMPLE_FACTORS - 48h_04-3_1_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-3_1 SUBJECT_SAMPLE_FACTORS - 48h_04-3_2_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-3_2 SUBJECT_SAMPLE_FACTORS - 48h_04-3_3_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-3_3 SUBJECT_SAMPLE_FACTORS - 48h_04-4_1_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-4_1 SUBJECT_SAMPLE_FACTORS - 48h_04-4_2_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-4_2 SUBJECT_SAMPLE_FACTORS - 48h_04-4_3_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_04-4_3 SUBJECT_SAMPLE_FACTORS - 48h_26-1_1_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-1_1 SUBJECT_SAMPLE_FACTORS - 48h_26-1_2_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-1_2 SUBJECT_SAMPLE_FACTORS - 48h_26-1_3_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-1_3 SUBJECT_SAMPLE_FACTORS - 48h_26-2_1_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-2_1 SUBJECT_SAMPLE_FACTORS - 48h_26-2_2_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-2_2 SUBJECT_SAMPLE_FACTORS - 48h_26-2_3_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-2_3 SUBJECT_SAMPLE_FACTORS - 48h_26-3_1_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-3_1 SUBJECT_SAMPLE_FACTORS - 48h_26-3_2_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-3_2 SUBJECT_SAMPLE_FACTORS - 48h_26-3_3_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-3_3 SUBJECT_SAMPLE_FACTORS - 48h_26-4_1_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-4_1 SUBJECT_SAMPLE_FACTORS - 48h_26-4_2_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-4_2 SUBJECT_SAMPLE_FACTORS - 48h_26-4_3_PGKP_48 Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_26-4_3 SUBJECT_SAMPLE_FACTORS - 48h_31-1_1_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-1_1 SUBJECT_SAMPLE_FACTORS - 48h_31-1_2_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-1_2 SUBJECT_SAMPLE_FACTORS - 48h_31-1_3_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-1_3 SUBJECT_SAMPLE_FACTORS - 48h_31-2_1_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-2_1 SUBJECT_SAMPLE_FACTORS - 48h_31-2_2_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-2_2 SUBJECT_SAMPLE_FACTORS - 48h_31-2_3_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-2_3 SUBJECT_SAMPLE_FACTORS - 48h_31-3_1_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-3_1 SUBJECT_SAMPLE_FACTORS - 48h_31-3_2_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-3_2 SUBJECT_SAMPLE_FACTORS - 48h_31-3_3_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-3_3 SUBJECT_SAMPLE_FACTORS - 48h_31-4_1_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-4_1 SUBJECT_SAMPLE_FACTORS - 48h_31-4_2_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-4_2 SUBJECT_SAMPLE_FACTORS - 48h_31-4_3_KP_48 Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=48h_31-4_3 SUBJECT_SAMPLE_FACTORS - 72h_04-1_1_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-1_1 SUBJECT_SAMPLE_FACTORS - 72h_04-1_2_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-1_2 SUBJECT_SAMPLE_FACTORS - 72h_04-1_3_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-1_3 SUBJECT_SAMPLE_FACTORS - 72h_04-2_1_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-2_1 SUBJECT_SAMPLE_FACTORS - 72h_04-2_2_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-2_2 SUBJECT_SAMPLE_FACTORS - 72h_04-2_3_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-2_3 SUBJECT_SAMPLE_FACTORS - 72h_04-3_1_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-3_1 SUBJECT_SAMPLE_FACTORS - 72h_04-3_2_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-3_2 SUBJECT_SAMPLE_FACTORS - 72h_04-3_3_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-3_3 SUBJECT_SAMPLE_FACTORS - 72h_04-4_1_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-4_1 SUBJECT_SAMPLE_FACTORS - 72h_04-4_2_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-4_2 SUBJECT_SAMPLE_FACTORS - 72h_04-4_3_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_04-4_3 SUBJECT_SAMPLE_FACTORS - 72h_26-1_1_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-1_1 SUBJECT_SAMPLE_FACTORS - 72h_26-1_2_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-1_2 SUBJECT_SAMPLE_FACTORS - 72h_26-1_3_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-1_3 SUBJECT_SAMPLE_FACTORS - 72h_26-2_1_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-2_1 SUBJECT_SAMPLE_FACTORS - 72h_26-2_2_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-2_2 SUBJECT_SAMPLE_FACTORS - 72h_26-2_3_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-2_3 SUBJECT_SAMPLE_FACTORS - 72h_26-3_1_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-3_1 SUBJECT_SAMPLE_FACTORS - 72h_26-3_2_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-3_2 SUBJECT_SAMPLE_FACTORS - 72h_26-3_3_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-3_3 SUBJECT_SAMPLE_FACTORS - 72h_26-4_1_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-4_1 SUBJECT_SAMPLE_FACTORS - 72h_26-4_2_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-4_2 SUBJECT_SAMPLE_FACTORS - 72h_26-4_3_PGKP_72 Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_26-4_3 SUBJECT_SAMPLE_FACTORS - 72h_31-1_1_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-1_1 SUBJECT_SAMPLE_FACTORS - 72h_31-1_2_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-1_2 SUBJECT_SAMPLE_FACTORS - 72h_31-1_3_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-1_3 SUBJECT_SAMPLE_FACTORS - 72h_31-2_1_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-2_1 SUBJECT_SAMPLE_FACTORS - 72h_31-2_2_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-2_2 SUBJECT_SAMPLE_FACTORS - 72h_31-2_3_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-2_3 SUBJECT_SAMPLE_FACTORS - 72h_31-3_1_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-3_1 SUBJECT_SAMPLE_FACTORS - 72h_31-3_2_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-3_2 SUBJECT_SAMPLE_FACTORS - 72h_31-3_3_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-3_3 SUBJECT_SAMPLE_FACTORS - 72h_31-4_1_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-4_1 SUBJECT_SAMPLE_FACTORS - 72h_31-4_2_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-4_2 SUBJECT_SAMPLE_FACTORS - 72h_31-4_3_KP_72 Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC RAW_FILE_NAME(Raw)=72h_31-4_3 #COLLECTION CO:COLLECTION_SUMMARY TDCLs were plated in 6 multiwell plates (Corning) and incubated (37° C in 5% CO:COLLECTION_SUMMARY CO2) for 24h hours. After this period, the medium was replaced and cells were CO:COLLECTION_SUMMARY further incubated and extracted at the indicated time points. Three wells were CO:COLLECTION_SUMMARY used for the metabolite extraction, and the other three were harvested using CO:COLLECTION_SUMMARY trypsin 0.25% to measure the wet cell volume using a PCV-packed cell volume tube CO:COLLECTION_SUMMARY (TPP). One aliquot of the medium (15µL) of each well was collected and CO:COLLECTION_SUMMARY immediately introduced in extraction buffer 40:40:20 (Methanol: Acetonitrile: CO:COLLECTION_SUMMARY Water) with 0.05% formic acid allowed to rest on ice for 5 minutes. For the CO:COLLECTION_SUMMARY TDCLs the metabolites extraction was performed by washing the wells twice with CO:COLLECTION_SUMMARY cold PBS, and 400 µL of extraction buffer 40:40:20 with 0.05% formic acid was CO:COLLECTION_SUMMARY added to each well. The plate was allowed to rest on ice for 5 minutes, and then CO:COLLECTION_SUMMARY the cells and buffer were scraped. The samples, extraction from medium and CO:COLLECTION_SUMMARY cells, were placed in a 1.5 mL microtube with 22 µL of 15% NH4HCO3 vortexed and CO:COLLECTION_SUMMARY centrifuged for 10 min at 15,000g at 4° C. 380 µL of the supernatant were CO:COLLECTION_SUMMARY collected and stored in -80° C freezer until analysis by LC-MS. CO:SAMPLE_TYPE Tumor cells CO:VOLUMEORAMOUNT_COLLECTED 400uL of organic phase of metabolites extraction CO:STORAGE_CONDITIONS -80℃ CO:COLLECTION_VIALS 1.5 mL Eppendorf tubes CO:STORAGE_VIALS 1.5 mL Eppendorf tubes #TREATMENT TR:TREATMENT_SUMMARY TDCLs from NSCLC of PGKP and KP animals submitted to kinetic (24-72h) without TR:TREATMENT_SUMMARY culture medium change. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY TDCLs were plated in 6 multiwell plates (Corning) and incubated (37° C in 5% SP:SAMPLEPREP_SUMMARY CO2) for 24h hours. After this period, the medium was replaced and cells were SP:SAMPLEPREP_SUMMARY further incubated and extracted at the indicated time points (24, 48, and 72h). SP:SAMPLEPREP_SUMMARY Three wells were used for the metabolite extraction, and the other three were SP:SAMPLEPREP_SUMMARY harvested using trypsin 0.25% to measure the wet cell volume using a PCV-packed SP:SAMPLEPREP_SUMMARY cell volume tube (TPP). One aliquot of the medium (15µL) of each well was SP:SAMPLEPREP_SUMMARY collected and immediately introduced in extraction buffer 40:40:20 (Methanol: SP:SAMPLEPREP_SUMMARY Acetonitrile: Water) with 0.05% formic acid allowed to rest on ice for 5 SP:SAMPLEPREP_SUMMARY minutes. For the TDCLs the metabolites extraction was performed by washing the SP:SAMPLEPREP_SUMMARY wells twice with cold PBS, and 400 µL of extraction buffer 40:40:20 with 0.05% SP:SAMPLEPREP_SUMMARY formic acid was added to each well. The plate was allowed to rest on ice for 5 SP:SAMPLEPREP_SUMMARY minutes, and then the cells and buffer were scraped. The samples, extraction SP:SAMPLEPREP_SUMMARY from medium and cells, were placed in a 1.5 mL microtube with 22 µL of 15% SP:SAMPLEPREP_SUMMARY NH4HCO3 vortexed and centrifuged for 10 min at 15,000g at 4° C. 380 µL of the SP:SAMPLEPREP_SUMMARY supernatant were collected and stored in -80° C freezer until analysis by SP:SAMPLEPREP_SUMMARY LC-MS. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY Tumor derived cell Lines (TDCLs) from NSCLC. CH:CHROMATOGRAPHY_TYPE HILIC CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME Waters XBridge BEH Amide (150 × 2.1mm, 2.5um) CH:SOLVENT_A 95% water/5% acetonitrile; 20mM acetic acid; 40mM ammonium hydroxide (pH 9.4) CH:SOLVENT_B 20% water/80% acetonitrile; 20mM acetic acid, 40mM ammonium hydroxide (pH 9.4) CH:FLOW_GRADIENT 0 min, 100% B; 3 min, 100% B; 3.2 min, 90% B; 6.2 min, 90% B; 6.5 min, 80% B; CH:FLOW_GRADIENT 10.5 min, 80% B; 10.7 min, 70% B; 13.5 min, 70% B; 13.7 min, 45% B; 16 min, 45% CH:FLOW_GRADIENT B; 16.5 min, 100% B; and 22 min, 100% B CH:FLOW_RATE 300 μL/min CH:COLUMN_TEMPERATURE 25 °C CH:METHODS_FILENAME Chromatography_method.pdf #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Plus Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Maven #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS ion count MS_METABOLITE_DATA_START Samples 24h_04-1_1_PGKP_24 24h_04-1_2_PGKP_24 24h_04-1_3_PGKP_24 24h_04-2_1_PGKP_24 24h_04-2_2_PGKP_24 24h_04-2_3_PGKP_24 24h_04-3_1_PGKP_24 24h_04-3_2_PGKP_24 24h_04-3_3_PGKP_24 24h_04-4_1_PGKP_24 24h_04-4_2_PGKP_24 24h_04-4_3_PGKP_24 24h_26-1_1_PGKP_24 24h_26-1_2_PGKP_24 24h_26-1_3_PGKP_24 24h_26-2_1_PGKP_24 24h_26-2_2_PGKP_24 24h_26-2_3_PGKP_24 24h_26-3_1_PGKP_24 24h_26-3_2_PGKP_24 24h_26-3_3_PGKP_24 24h_26-4_1_PGKP_24 24h_26-4_2_PGKP_24 24h_26-4_3_PGKP_24 24h_31-1_1_KP_24 24h_31-1_2_KP_24 24h_31-1_3_KP_24 24h_31-2_1_KP_24 24h_31-2_2_KP_24 24h_31-2_3_KP_24 24h_31-3_1_KP_24 24h_31-3_2_KP_24 24h_31-3_3_KP_24 24h_31-4_1_KP_24 24h_31-4_2_KP_24 24h_31-4_3_KP_24 48h_04-1_1_PGKP_48 48h_04-1_2_PGKP_48 48h_04-1_3_PGKP_48 48h_04-2_1_PGKP_48 48h_04-2_2_PGKP_48 48h_04-2_3_PGKP_48 48h_04-3_1_PGKP_48 48h_04-3_2_PGKP_48 48h_04-3_3_PGKP_48 48h_04-4_1_PGKP_48 48h_04-4_2_PGKP_48 48h_04-4_3_PGKP_48 48h_26-1_1_PGKP_48 48h_26-1_2_PGKP_48 48h_26-1_3_PGKP_48 48h_26-2_1_PGKP_48 48h_26-2_2_PGKP_48 48h_26-2_3_PGKP_48 48h_26-3_1_PGKP_48 48h_26-3_2_PGKP_48 48h_26-3_3_PGKP_48 48h_26-4_1_PGKP_48 48h_26-4_2_PGKP_48 48h_26-4_3_PGKP_48 48h_31-1_1_KP_48 48h_31-1_2_KP_48 48h_31-1_3_KP_48 48h_31-2_1_KP_48 48h_31-2_2_KP_48 48h_31-2_3_KP_48 48h_31-3_1_KP_48 48h_31-3_2_KP_48 48h_31-3_3_KP_48 48h_31-4_1_KP_48 48h_31-4_2_KP_48 48h_31-4_3_KP_48 72h_04-1_1_PGKP_72 72h_04-1_2_PGKP_72 72h_04-1_3_PGKP_72 72h_04-2_1_PGKP_72 72h_04-2_2_PGKP_72 72h_04-2_3_PGKP_72 72h_04-3_1_PGKP_72 72h_04-3_2_PGKP_72 72h_04-3_3_PGKP_72 72h_04-4_1_PGKP_72 72h_04-4_2_PGKP_72 72h_04-4_3_PGKP_72 72h_26-1_1_PGKP_72 72h_26-1_2_PGKP_72 72h_26-1_3_PGKP_72 72h_26-2_1_PGKP_72 72h_26-2_2_PGKP_72 72h_26-2_3_PGKP_72 72h_26-3_1_PGKP_72 72h_26-3_2_PGKP_72 72h_26-3_3_PGKP_72 72h_26-4_1_PGKP_72 72h_26-4_2_PGKP_72 72h_26-4_3_PGKP_72 72h_31-1_1_KP_72 72h_31-1_2_KP_72 72h_31-1_3_KP_72 72h_31-2_1_KP_72 72h_31-2_2_KP_72 72h_31-2_3_KP_72 72h_31-3_1_KP_72 72h_31-3_2_KP_72 72h_31-3_3_KP_72 72h_31-4_1_KP_72 72h_31-4_2_KP_72 72h_31-4_3_KP_72 Factors Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):24 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):48 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:PGKP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC Genotype:KP | Time (H):72 | Sample source:TDCLs from NSCLC 1-Aminocyclopropanecarboxylate 18426.07 22252.25 19686.19 22072.48 15825.86 17574.00 7416.71 14953.26 20625.49 18842.48 17996.92 20841.65 13550.68 21116.69 9232.44 18454.21 17035.21 16940.32 18429.21 15793.18 16958.51 14251.61 14300.82 15132.78 21630.05 13300.99 13483.75 20811.45 15786.31 12048.94 20383.37 19208.64 20307.81 18799.48 15440.92 18826.07 19710.87 29035.48 23739.49 17750.70 19440.41 20163.11 21607.73 27129.53 18764.74 19399.05 27209.97 16101.36 18120.32 21322.56 14922.93 23846.98 22655.04 21910.26 26704.01 17943.78 21706.43 18153.88 17960.12 21210.50 21180.92 22522.32 31648.71 18422.04 19496.15 16360.48 15244.37 15131.64 15862.46 14706.15 15427.71 20671.89 16436.52 21097.55 22398.38 21336.40 20737.05 25581.97 20205.46 20696.67 17872.78 20848.86 11618.14 19218.49 18237.96 20451.01 17402.62 12839.84 16195.85 13624.17 17604.45 16657.18 20675.08 17328.69 19469.10 24658.56 18769.41 17683.05 19907.21 22852.02 13749.81 20246.67 13686.61 24962.21 11409.99 25734.09 22625.15 20955.23 2 3-cAMP 1438.40 1257.64 2418.71 1295.79 0.00 0.00 0.00 0.00 0.00 1180.99 0.00 0.00 1101.80 915.33 1251.04 1321.24 1379.80 1240.40 1276.95 0.00 1453.07 0.00 0.00 1652.08 3434.20 1392.34 1443.22 1564.74 2353.06 1136.34 0.00 1210.71 1057.80 1227.09 2210.43 1430.85 0.00 2168.53 2016.29 0.00 3110.40 3403.08 0.00 0.00 0.00 0.00 1666.09 1307.15 1817.81 1722.94 0.00 1833.79 0.00 1799.76 0.00 0.00 0.00 0.00 0.00 1648.04 4110.55 2867.04 3081.92 9246.20 4620.54 2656.08 4692.44 2330.01 3801.75 4158.66 4024.19 5654.09 2064.78 2277.56 2055.11 0.00 0.00 1729.53 0.00 0.00 0.00 0.00 0.00 1860.51 1529.21 0.00 1465.71 0.00 0.00 0.00 0.00 1689.37 0.00 1298.56 1371.49 0.00 2195.01 2066.09 2178.99 1465.40 1548.75 1932.44 1790.81 1572.68 1732.16 5453.50 5376.54 3227.01 2 4-Diaminobutyrate 726.68 762.30 482.48 614.11 736.47 824.64 808.69 654.00 768.06 728.52 788.62 680.91 649.29 714.84 701.02 716.72 1212.29 838.56 741.90 736.20 594.73 787.68 857.38 1298.20 563.71 676.24 860.84 706.25 619.11 750.93 615.35 850.56 654.51 554.00 821.38 864.44 1231.29 990.56 1079.18 784.64 960.44 1302.95 889.44 1241.80 816.89 947.62 1206.98 787.53 995.74 1082.85 1082.59 1564.98 985.65 1069.37 1073.09 1349.51 1669.03 981.98 1377.50 1019.04 1558.76 1017.42 1458.67 762.69 1010.06 1108.01 1164.31 1124.65 1212.53 887.96 1068.05 890.15 864.15 1652.95 999.78 1585.47 751.25 1042.30 1126.62 1617.82 1037.59 1427.62 1619.94 862.14 1533.70 838.91 1488.69 1789.15 800.38 1873.94 1594.62 1889.39 1751.21 940.70 780.71 1055.22 2292.02 952.84 828.27 746.61 1024.08 667.60 979.31 915.62 947.41 3604.70 878.15 1382.08 2 6-Diaminopimelic acid 620.28 802.61 736.61 0.00 1064.38 815.67 877.40 511.69 707.39 643.48 608.84 0.00 817.30 720.16 710.39 0.00 816.45 0.00 0.00 912.67 755.57 622.87 751.67 625.42 928.12 874.92 0.00 649.03 740.69 583.12 0.00 805.36 795.87 1030.79 702.05 580.29 925.37 789.59 917.87 962.06 1075.61 930.63 846.01 812.30 729.01 738.37 774.30 1538.48 804.55 763.10 708.55 725.86 725.14 1640.64 945.44 813.60 727.13 1017.81 715.07 714.08 1081.20 763.38 962.44 782.96 902.93 1851.91 1075.26 832.85 897.44 964.68 833.28 832.98 893.00 763.81 798.07 1039.96 824.03 689.77 751.70 706.40 792.83 0.00 876.67 722.01 839.87 788.18 1017.87 920.70 863.99 834.17 886.32 1012.06 1086.66 966.94 0.00 820.68 938.70 924.37 862.35 1093.07 888.98 1615.15 783.26 947.59 888.94 758.34 866.46 0.00 2-Aminoadipic acid 46868.75 57661.41 57445.04 42126.12 45231.92 54965.91 35377.10 37957.98 29773.23 38769.41 41237.55 42420.34 49182.62 52662.70 49108.40 60221.39 56282.53 60989.97 61167.45 61264.09 63468.84 62585.03 63960.12 57095.98 48660.53 50904.86 45220.79 61946.54 62001.24 62989.88 35168.27 40834.07 46359.44 47721.25 49642.44 56165.16 5378.39 70409.54 65532.05 33968.39 50366.06 54535.89 42186.55 33756.38 34145.11 40934.82 41051.06 44693.73 52012.43 46323.32 48299.20 48248.34 55098.05 58805.00 52726.55 57104.13 58872.30 62868.80 66998.62 65604.10 36116.32 39532.76 50292.38 52640.73 48538.67 37729.74 51137.04 59701.25 56909.04 35054.79 36725.27 37079.22 42576.74 47664.95 37871.91 38765.98 42030.54 40094.89 40667.62 39454.71 38177.81 36096.91 40512.19 39199.87 32966.09 33551.91 40949.16 35487.33 36210.95 40816.25 57490.11 53721.22 51264.54 37999.64 39818.94 42656.12 34590.12 36106.64 39417.22 19968.22 21546.26 20693.74 37986.88 41597.66 41717.46 24767.94 16752.36 18199.44 2-Aminoethylphosphonate 813.02 1349.83 727.40 591.99 0.00 566.52 0.00 0.00 621.12 704.83 0.00 0.00 977.97 849.81 1432.04 0.00 0.00 0.00 609.97 665.82 545.22 0.00 695.69 660.44 712.75 841.92 652.17 0.00 551.92 1583.25 0.00 634.76 0.00 0.00 624.75 656.72 0.00 1127.74 849.22 629.30 0.00 0.00 722.85 0.00 0.00 1118.49 1092.83 1823.07 1047.96 1032.49 1847.27 913.40 735.22 1084.48 1343.98 644.24 1395.97 0.00 781.44 850.53 1031.90 1234.81 1886.98 5702.30 3067.80 4370.45 4072.64 3048.02 4204.05 4228.38 3704.88 4184.62 1189.12 794.26 1615.77 751.67 710.15 1465.33 655.24 720.62 1286.01 1062.25 2412.68 2276.50 1150.27 1566.16 2164.95 769.98 860.20 661.19 661.32 964.77 744.68 0.00 836.56 0.00 2687.15 1219.66 3029.00 4677.91 5557.83 4732.52 5222.37 5700.86 4898.91 7468.30 3883.83 6058.09 2-Aminoisobutyrate 41341.18 45162.46 44822.62 43591.90 40058.31 40855.04 46235.39 43657.34 37082.61 26706.82 31217.47 33042.60 40216.32 34618.78 36762.82 56713.51 58401.89 52400.56 38947.72 38910.57 38325.38 56734.77 54540.93 53488.42 64476.93 55379.73 59372.47 41757.11 38714.97 38575.56 38637.11 38151.23 42079.36 44831.36 46220.18 47357.65 15832.27 61276.18 56172.78 53625.50 51010.17 62329.47 51028.72 49305.92 45355.62 45559.88 64241.60 46897.43 63242.68 75669.68 55064.14 81321.95 79636.23 72269.23 44746.98 54818.68 56241.03 57677.03 63815.19 58157.36 74812.41 82387.18 113386.16 154236.61 162034.06 169136.61 200741.19 176486.83 204034.48 174939.58 150785.70 188544.98 58975.33 63972.74 68231.31 62120.82 60033.67 74768.59 59076.11 55721.80 55341.98 51622.97 61294.26 52503.98 60373.21 65004.48 53445.36 56879.72 60758.19 69079.44 57770.65 55405.96 54782.56 47838.07 51047.08 49448.76 120589.54 140193.14 165842.67 196972.80 170539.77 194028.25 154424.20 166737.58 158295.33 258667.70 195235.42 251118.14 2-Aminophenol 2772.79 4461.81 4598.27 1900.41 3315.32 2361.19 1790.78 0.00 0.00 1658.32 3063.86 2095.67 0.00 2459.67 0.00 3044.19 3779.13 0.00 0.00 2080.11 1509.35 964.23 3232.99 2577.45 0.00 0.00 3061.74 4303.13 2429.62 1455.69 2428.31 1161.42 3744.67 0.00 1684.51 2180.65 1115.59 1413.10 0.00 4371.53 0.00 0.00 77.56 0.00 4272.99 4505.81 3267.65 2681.38 6088.80 4150.77 4179.25 4399.63 2511.11 2814.23 1082.67 1265.68 1290.12 1687.83 3797.45 0.00 4586.68 4098.01 3753.58 2409.55 4612.27 2976.02 3019.52 2854.48 6300.76 6539.89 5150.98 5592.79 3115.91 2573.46 4258.99 1169.43 2211.24 3690.44 2882.56 5888.33 4943.50 1563.62 1703.76 1594.47 2801.58 3890.46 6868.39 5480.69 3027.29 3183.30 0.00 2224.58 3223.00 3252.35 1513.69 6333.61 2531.77 3041.46 2919.92 4332.35 3782.25 2054.90 4035.23 3431.82 2066.26 3749.26 1740.95 1374.28 2-Deoxyadenosine 9240.67 12320.20 11679.29 2150.04 3135.11 5578.62 1710.30 1917.04 1639.48 4570.26 5229.73 4386.47 7555.45 7854.56 7501.12 2958.69 1587.70 0.00 3648.32 3760.15 4111.66 1843.50 2307.82 2978.22 5450.70 6920.89 5994.12 1933.32 0.00 1711.65 0.00 2473.00 1776.71 10548.85 10430.27 8242.04 0.00 2731.26 2556.29 0.00 2945.72 7389.06 0.00 0.00 0.00 2464.94 2286.39 2770.83 2149.10 0.00 1759.01 0.00 0.00 1906.44 1609.69 0.00 0.00 0.00 1777.39 0.00 4741.25 7567.10 7757.63 1817.86 5111.61 0.00 2926.30 5413.13 5461.12 10533.28 9674.16 13950.27 0.00 2579.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2371.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1993.20 2188.57 2213.87 4457.87 6800.04 6615.32 2073.89 2499.86 2611.40 2152.42 2596.98 0.00 13419.66 13442.25 12600.26 2-Hydroxypyridine 6624.88 5325.10 4918.27 6501.95 6521.22 6591.40 1414.38 6114.24 6961.28 5942.59 4178.03 7340.05 6375.45 6777.23 7230.93 6475.26 5225.37 3289.59 3493.99 5501.84 6729.59 3278.68 3923.62 3313.18 6822.02 6818.64 7658.46 5196.83 2801.63 5233.29 4123.20 7067.47 9037.50 7023.64 3941.95 3968.80 5632.32 10737.88 9331.39 13663.59 10905.25 6857.94 7515.19 10682.25 12654.36 9379.90 6912.63 4816.94 11328.95 6719.52 9252.44 8312.02 9155.93 7679.84 15134.89 7456.26 9805.98 11650.58 14128.57 8596.67 7800.22 8881.11 13361.54 14078.15 5308.89 15102.52 9305.17 8009.50 10884.47 11175.44 6476.11 8084.71 4771.24 14310.27 8942.57 9181.23 10618.03 8710.30 9004.20 4658.11 6403.80 6881.87 8489.41 4799.21 6119.33 5321.30 6051.28 6837.92 5717.07 8676.84 8020.19 7653.83 7050.15 9184.93 7061.90 5882.39 12179.15 9986.00 8403.52 11826.77 8557.17 10004.61 6133.00 10128.65 6411.55 8703.10 7379.02 9013.43 3-Methyl-2-oxovalerate 11510.06 3817.43 4045.33 6692.67 2937.79 2899.05 6901.98 2607.30 6785.16 4535.50 3454.48 2824.50 2808.83 4045.17 7586.25 5484.73 2942.80 2718.33 3118.16 4293.50 4262.47 2617.09 5284.36 2577.50 8204.82 6406.52 2418.27 3076.91 4014.19 12512.15 5969.85 9969.90 9604.13 4465.35 6271.14 5176.90 4698.15 14080.59 4024.18 3586.78 7081.42 6434.07 7034.38 6996.32 5350.46 5460.07 4598.54 5473.30 7885.91 7923.49 6410.30 3500.76 7827.95 6646.38 12798.82 10094.04 5427.58 5776.33 13573.45 26826.81 4578.75 4910.25 5058.27 11137.15 3925.77 5527.66 11740.89 6639.89 10694.99 6830.62 10737.12 14232.53 4766.38 18025.33 6672.86 5201.14 6052.87 6728.50 6476.25 4985.83 9253.24 6063.02 7032.96 8186.10 6595.30 3833.29 4168.40 8960.33 6802.30 7117.94 6389.54 6006.73 7897.81 6609.82 7881.78 7858.17 7479.12 5469.37 5566.31 5370.26 7830.67 6623.86 3380.28 4485.90 3269.07 10347.65 8953.39 12297.79 3-Methyladenine 3127.39 1794.72 1740.49 2807.74 1994.05 2135.09 2378.18 2085.65 1688.43 1528.62 2163.16 2797.67 1911.13 1544.04 1735.23 1638.35 2074.73 4157.94 1540.40 1720.26 2337.43 1325.53 3128.36 1488.68 1849.27 1527.28 1613.68 1801.16 3096.95 2406.78 3232.77 5272.11 2001.96 1522.63 3690.65 1407.31 3834.49 5455.41 2555.77 6767.29 2950.88 4033.19 7748.79 4091.05 4689.75 2585.07 5284.37 2652.17 6931.78 5246.19 5965.52 4738.11 5810.62 3053.83 8662.11 4869.51 2909.61 5548.43 5471.17 5375.83 2726.45 2717.58 7650.36 4594.72 2911.00 2610.06 6028.49 2390.70 4530.63 2995.39 7241.00 2795.23 2255.47 8763.55 2547.65 2363.94 5701.05 6560.49 5116.04 5433.75 2722.13 6209.00 4620.77 2455.06 4120.04 4235.81 2416.03 8075.51 4736.26 1855.67 4127.53 2161.22 7307.57 1751.21 2743.96 2151.27 2806.91 7898.66 2488.56 4884.65 4877.81 4378.68 4486.04 4491.38 2597.36 3900.75 4313.11 5668.26 3-Phosphoglycerate 5835.06 13344.36 7866.61 5132.69 2932.60 3802.91 3739.55 1520.30 2530.09 3972.29 2808.92 4220.34 7358.69 1940.02 4360.30 4131.32 4807.15 1850.12 1978.89 1497.85 2582.70 1570.63 1055.64 2689.16 7370.09 8327.26 4861.22 11143.62 8808.73 9334.89 8157.47 8750.44 11909.98 12054.78 12422.34 13617.14 0.00 1241.33 2393.30 4513.93 1597.76 2768.71 1276.03 1034.48 1342.13 1207.93 1935.56 1288.79 1432.61 1323.86 1358.20 1243.23 2646.85 2224.00 1488.93 0.00 0.00 1938.51 2537.01 0.00 1835.33 1828.81 1524.81 2192.75 1670.84 1254.67 2332.55 4791.38 6393.48 2692.95 6954.18 8954.02 753.70 1070.41 997.28 1191.07 980.11 1079.06 0.00 0.00 0.00 0.00 731.67 559.24 0.00 897.51 1131.14 0.00 0.00 0.00 941.61 841.69 0.00 0.00 881.99 0.00 1135.54 1705.26 1134.60 691.48 1091.27 1035.00 2789.30 6975.06 7452.82 5876.54 3801.23 2473.70 3-hydroxybutanone 14501.45 10479.42 14290.46 25110.44 0.00 16380.90 19273.43 8233.21 17826.19 14185.11 6799.77 7464.09 15649.22 8039.30 23618.95 0.00 0.00 8653.14 13134.03 0.00 10455.17 17038.80 8775.63 12487.59 11908.81 21307.66 11592.39 0.00 7331.78 12487.40 17664.84 7465.55 24860.55 0.00 16531.51 14685.09 0.00 0.00 0.00 19974.61 0.00 11889.75 12129.20 0.00 20479.08 11395.13 12954.14 0.00 35256.82 0.00 13129.46 21851.22 35589.97 9963.78 22794.94 29457.02 0.00 0.00 13364.47 33980.12 10782.71 22284.66 27820.13 15266.70 11061.32 11351.46 24221.48 23043.70 0.00 24338.35 23356.78 26143.63 15159.33 0.00 11789.36 24395.08 11332.31 11192.64 19337.20 24136.98 12053.86 21501.96 20114.06 16675.57 14262.14 23592.11 21012.69 35266.43 13835.67 27644.99 31557.19 12863.92 14840.57 12121.33 12695.72 31033.72 15290.72 30642.08 12431.34 8790.68 25944.90 12896.32 33484.46 13524.39 18887.66 35442.40 30758.95 33996.89 3-methyl-histidine 118172.57 154263.00 120388.56 86117.66 65556.37 100737.91 110270.16 125867.46 98000.41 54691.27 54908.28 50361.28 109156.54 96460.80 110296.98 276242.59 241153.27 197393.77 155560.55 128104.71 159137.92 211127.50 263845.56 216274.17 140357.92 139692.16 141076.27 88437.06 93775.34 104222.45 86561.35 104738.41 103040.28 117204.75 114884.00 103702.57 4130.48 335424.78 219186.88 104135.13 162592.23 167660.34 171570.14 150344.14 178113.20 112711.70 101805.05 116602.09 224672.11 282216.97 216277.39 370656.28 338194.75 401810.97 215168.94 219208.45 276188.66 268618.59 241260.98 253909.92 198175.89 187715.75 213568.52 2031256.38 1650023.62 2045492.38 2111413.50 2236810.25 2507659.25 1000039.81 890327.50 1324543.75 254275.83 328292.53 289817.34 234173.06 235174.30 334303.25 280578.59 251877.36 294330.03 146502.69 157604.64 168248.42 287682.78 235019.05 320545.16 200839.88 226187.08 281343.91 280776.22 257591.38 280320.72 179526.58 166754.55 219019.92 608294.06 632036.88 990172.00 2451849.25 2188391.75 2306335.25 5155805.50 4319972.50 5592230.00 3014895.75 1676030.50 2920363.00 4-Acetamidobutyrate 33668.67 30685.16 32185.83 21384.81 23182.80 21232.44 22870.22 22762.02 25644.10 16595.20 14865.08 20151.08 22878.39 20050.11 19036.05 23382.87 24539.95 28804.67 26888.87 25602.51 33393.49 30252.18 29802.93 30332.81 34230.30 30100.15 40390.52 36727.93 29629.07 33995.78 31267.48 35602.53 34773.79 21252.15 28742.96 21352.19 11849.70 64009.78 47538.45 38405.89 38927.04 27236.48 34315.36 21445.21 36914.02 34059.95 56662.45 31563.72 43397.41 48223.16 47245.79 58149.08 56193.87 48423.90 55399.98 40734.52 42727.68 56103.39 51164.22 43452.19 55600.29 44345.49 85740.70 91285.26 79435.18 79248.74 76946.29 53869.22 56031.46 51725.53 45781.84 45354.64 45532.93 49860.34 42465.03 46132.83 34118.85 35856.12 54162.55 37795.14 41824.47 41757.01 36199.68 36789.74 36755.00 37642.14 40799.67 27684.08 28403.35 37655.75 28997.96 33243.08 34585.21 31895.46 27010.14 34115.99 28190.96 29731.66 41101.77 83300.91 77737.13 60700.27 43533.67 47339.45 51629.27 56869.84 40276.43 37139.57 4-Aminobutyrate (GABA) 394484.00 420164.25 381488.28 2713193.00 2547242.25 2874795.75 1253696.00 1283553.62 1015342.50 634622.75 642540.31 677151.81 1583240.62 1404537.88 1489587.50 3680518.75 3714738.00 3832917.00 2832285.75 2702241.75 2940299.00 2957205.00 2896541.25 2472320.25 6562263.50 6878706.50 6430550.00 1644854.62 1675314.00 1749751.00 1791312.50 2193880.00 2520249.00 4050482.00 4182907.25 3946922.25 20428.04 531563.31 460634.66 2866209.00 3706995.25 4205480.50 2026893.62 1883301.00 1859081.50 776665.50 858171.56 883838.81 1768347.38 1781269.00 1769048.88 4928317.50 4737529.50 5048047.50 3100692.00 3166678.25 3752472.00 3721604.25 3925198.00 4063349.00 12057263.00 13413200.00 12595403.00 4297454.50 3973028.25 4213020.00 6387588.00 6401462.50 6953108.50 9663458.00 9811129.00 11067248.00 604019.00 591438.38 664711.56 2952582.00 2986003.75 3725138.00 1746499.88 1442297.62 1922675.38 792844.69 871878.00 1125099.50 2350924.00 2054307.62 2684863.75 3479260.25 3825184.25 4438275.50 4356469.50 4428272.50 4331293.00 3198780.75 3120254.25 2957682.75 13668043.00 14446688.00 15176869.00 4528530.50 4222189.50 4787399.50 8084635.50 7025213.50 8612441.00 15870683.00 12182536.00 14943693.00 4-Guanidinobutyrate 54495.79 68464.72 56509.54 62886.17 57268.04 61729.46 54860.20 69854.48 52287.88 54848.51 57830.06 55631.80 45235.25 57117.34 50029.75 93196.91 98906.79 100206.12 67569.87 69730.62 71145.45 126671.09 118417.53 90780.00 136173.14 136254.45 125471.87 92918.84 78780.91 88678.60 70865.94 89811.07 101295.82 79730.81 81616.85 89910.57 11958.80 96532.97 83978.25 47711.70 47641.66 39833.67 64683.31 48550.30 62756.16 48466.95 54767.47 56354.61 49647.52 48555.64 46572.55 67173.97 67654.32 54457.45 50016.06 54616.36 51686.19 73470.32 71352.15 78969.26 221178.58 255919.81 237106.17 121347.13 118398.85 133221.17 192880.69 197114.98 214283.44 115702.56 129745.52 131149.61 54801.17 59148.04 52220.19 46928.39 47489.38 55892.39 47665.20 50825.38 59414.17 76621.44 81510.73 100832.59 91197.38 81673.31 112306.93 85547.73 82630.48 98729.73 93013.31 87048.30 92664.68 118670.24 112186.44 123271.53 210186.06 172677.61 209525.05 108675.62 103588.52 104736.41 178654.92 160506.30 234216.36 144322.14 131532.30 161249.30 4-Hydroxy-3-methoxyphenylglycol 11206.03 10804.58 11474.23 13734.12 10280.31 8835.98 8463.74 9439.09 9729.83 9644.54 8526.28 11669.87 10130.64 11723.25 7571.36 9743.77 9806.46 8321.25 8226.29 9543.48 9504.54 10082.67 8921.41 7491.25 11659.25 7640.65 9051.79 9384.81 10848.39 7385.59 7846.27 9148.99 5527.63 8709.82 10176.47 10145.49 8710.24 19980.33 19004.58 23423.70 21912.11 17826.68 21258.31 24924.98 16351.34 18843.68 23168.79 25216.34 18074.08 20067.35 24382.86 15654.86 21814.63 19206.06 20846.03 22684.12 22271.43 20952.07 19455.28 22428.16 17073.58 22919.95 13449.21 21414.67 21544.29 25879.42 22560.53 21063.24 21016.02 22458.17 23923.34 22221.41 24850.23 25088.35 22621.57 22408.05 26970.24 26546.44 24549.62 26441.35 21949.59 25401.66 26306.80 20967.44 27285.34 25404.45 24049.93 21095.14 18765.42 25111.81 26088.82 17038.35 26271.72 24001.46 27975.82 26321.81 24146.02 21449.09 21938.41 21636.83 25234.33 24359.54 25775.08 22811.29 25668.47 20821.98 11880.40 23766.71 4-Imidazoleacetate 18729.97 20834.71 20675.89 31868.08 25377.60 36396.99 27997.29 23756.41 20868.01 20070.06 24242.66 28044.26 16992.42 21828.23 16856.47 50126.17 49694.20 43728.88 45743.71 38137.19 47236.50 50155.52 50154.32 53627.53 35368.61 37005.42 27213.70 14134.44 15782.77 15642.54 13222.12 15919.71 18982.88 18729.55 20579.96 18838.22 2225.80 40737.30 37949.52 28897.35 27179.42 43549.29 36955.56 36705.70 38748.14 45984.80 49157.09 43112.85 36716.70 32292.96 37224.83 58192.83 75411.78 65391.00 52326.34 49393.46 63088.35 65172.14 77691.80 80628.54 59279.55 59839.89 62966.82 46091.25 45777.42 48199.03 57478.55 52800.95 51610.73 47753.72 38090.04 42887.97 31247.91 36422.17 35196.76 41541.61 44950.48 49717.82 52951.48 43384.78 48801.16 53022.03 52543.25 53974.82 19449.07 21450.21 23030.90 44168.90 39828.29 55447.82 48979.27 41235.01 44525.77 62777.38 57163.61 62206.01 55812.50 58548.18 92379.38 42942.61 45638.06 38537.92 58210.38 59929.56 58732.20 39479.45 44540.66 40440.94 4-Quinolinecarboxylate 7296.68 11190.25 7497.08 1454.55 1770.48 2379.18 1481.49 1354.47 0.00 3987.14 2983.81 2476.99 5884.26 2032.56 5920.47 1810.68 3327.22 5599.80 2104.09 4671.72 1387.57 3006.57 2196.66 1684.11 1803.83 2224.40 5776.41 5245.00 4458.67 5762.55 3467.79 1994.44 1404.38 2109.30 2248.58 3131.48 0.00 16995.19 11229.24 3306.63 4711.79 5230.61 1707.33 5113.73 2116.57 6478.34 13134.61 13752.09 11509.80 12558.26 14431.66 5585.68 7025.11 8118.73 7017.18 7113.12 8694.08 7261.40 9192.66 3927.51 10027.84 7918.82 11705.30 17269.16 9849.83 13720.67 14434.23 6792.53 7878.24 11206.30 8774.85 4396.63 15470.11 14213.19 14868.16 8046.51 7883.04 6183.19 2524.01 6113.59 7494.17 16307.04 18874.37 18993.34 9902.11 11466.97 12265.05 3036.26 6563.25 7296.23 4395.82 1933.92 2668.70 5826.28 6040.84 5243.09 2580.57 7169.43 4759.86 16388.15 11809.19 18392.30 8214.62 8913.79 8698.18 22882.17 12602.86 12711.39 5-Aminolevulinate 260913.50 318579.22 160202.53 269823.03 197117.98 241461.38 275572.56 366042.38 324849.41 173756.64 150247.50 197929.56 219135.30 204204.42 207883.12 562026.31 524416.56 547527.69 266343.72 235216.17 293029.41 453343.00 463506.75 457251.53 956852.94 924663.31 855172.44 318628.41 352189.09 297817.28 349619.88 377897.34 364268.91 525977.62 620741.50 529307.38 26593.70 391264.38 340944.78 273341.78 302977.84 326944.97 364195.88 341955.91 381495.25 202644.44 220809.38 239474.38 369339.84 378352.50 405542.78 606131.94 540854.75 585544.56 371762.41 317901.62 352959.66 476426.00 492790.78 486497.66 860727.31 885648.00 1153675.38 1805953.00 1573461.38 1766155.38 2123593.25 2027988.50 2251461.25 2015372.00 1636254.50 1981993.38 247896.56 237787.83 269365.16 312584.28 313609.53 371125.97 275390.38 285313.03 327824.09 172671.81 175191.08 177357.88 300103.72 236969.56 248979.88 358988.50 367849.97 436640.12 316676.16 353438.78 331375.53 233863.20 232880.92 301243.44 966484.00 938562.31 1183300.62 1013298.31 1066252.62 1197055.38 2087380.50 1921330.62 2188974.00 1762493.50 1639219.38 1910313.62 5-Deoxy-5-(methylthio)adenosine 209912.75 232531.83 274234.88 288210.41 166414.92 199190.55 123203.27 129083.25 105447.10 124537.09 118940.41 163464.42 160445.89 166932.23 150193.53 209704.69 192913.48 213232.33 289574.47 278313.75 306121.62 344025.97 268715.69 315763.19 239713.12 226091.98 255117.95 201947.64 176628.30 178421.31 133138.23 135809.92 195114.17 174267.42 201176.50 218630.50 0.00 746587.31 563984.19 272936.03 436525.03 497372.75 338258.78 285546.91 307596.41 352394.50 384735.91 361488.22 493123.91 720214.44 652367.25 450006.16 395059.34 398793.34 623266.06 801944.31 921636.19 581290.25 612557.56 593038.31 450349.47 462326.34 587678.44 1190140.00 1225157.62 1288404.12 1202565.88 898221.25 1068010.25 537517.44 469857.38 625968.50 313997.50 240735.38 295429.72 473869.91 687859.94 668504.19 156468.02 118578.09 157523.39 241205.36 192016.31 185267.30 257495.86 297042.53 270645.47 200771.58 150450.52 179130.52 241156.64 325793.62 421093.22 213419.55 161563.23 178487.17 352535.50 363189.72 307168.53 341920.53 302761.50 333286.91 380355.03 337594.62 341447.84 714558.25 335171.22 277765.91 5-Deoxyadenosine 1915.96 1883.56 1622.29 0.00 0.00 1807.80 1604.33 0.00 0.00 0.00 2169.54 0.00 1743.82 0.00 1634.29 2155.44 0.00 0.00 2106.54 2220.42 1665.60 0.00 2368.84 3481.71 1902.12 2308.94 6046.16 1712.33 0.00 2956.09 2184.53 2969.06 4934.80 1581.98 2364.14 1922.28 0.00 3802.25 0.00 0.00 2558.31 1895.61 0.00 0.00 0.00 2517.07 0.00 2489.07 2297.57 0.00 0.00 0.00 1716.89 2034.07 5695.64 1844.56 0.00 0.00 0.00 0.00 5180.73 2359.75 7630.74 7741.76 3427.61 2559.80 11023.39 9224.67 12078.49 9247.90 4230.74 9488.95 0.00 0.00 0.00 0.00 1967.51 0.00 2001.05 0.00 0.00 2005.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2125.80 0.00 0.00 0.00 1971.86 3401.30 6398.69 4734.93 3515.83 2584.93 4003.41 7653.71 3384.17 7160.66 7560.47 5253.85 5442.38 5-Hydroxylysine 1193.41 1185.93 1304.60 1075.36 1231.66 1144.45 1265.36 1273.39 1140.65 1157.97 1109.09 1347.07 1273.79 1229.97 1250.28 1447.24 1379.69 2639.32 1427.95 1272.81 1235.15 2514.34 3126.00 2567.60 2765.51 3091.95 2460.33 1422.83 1259.45 1333.48 1156.97 2348.17 1201.36 1252.29 1543.90 1126.49 1316.87 2703.44 1403.35 1399.59 1517.49 2216.45 1536.35 2873.14 2635.81 1448.62 1446.50 1410.46 2513.63 1276.84 1509.93 3489.20 4991.34 3223.83 1548.31 1539.12 3604.14 4559.39 2557.39 3000.49 5048.68 6072.02 6942.44 7886.53 6156.40 4800.65 4766.30 3315.63 5227.96 3787.56 2391.87 4354.04 3996.50 2477.18 1461.94 1450.67 2955.26 3482.20 1680.64 2421.43 3095.84 1347.50 2130.95 1451.56 1367.87 1431.45 1370.51 1380.36 1396.76 2366.21 2956.60 1619.20 2514.39 2517.49 1409.65 4129.05 7591.01 6946.70 9239.38 5972.13 7319.31 7454.37 5899.04 4543.19 4882.90 6429.01 3255.58 5792.39 7 8-Dihydro-L-biopterin 1563.26 2799.01 3380.88 2039.35 2624.88 1809.39 1419.08 993.91 1642.99 1104.64 1347.88 1459.95 1374.70 1378.95 0.00 921.06 0.00 1241.63 17928.76 19174.99 22346.35 1564.25 1928.15 0.00 1069.48 0.00 987.67 0.00 1043.61 956.85 1176.60 1414.72 1356.05 4084.67 1687.76 1953.67 1828.85 5730.54 1639.02 2060.31 1266.37 1210.77 0.00 1338.07 1113.42 1103.99 1442.02 1263.66 1574.36 0.00 909.01 976.57 1955.19 0.00 15108.14 14536.20 16078.33 1578.69 1017.00 1450.73 1366.43 0.00 1711.85 1966.54 1128.53 0.00 3731.10 4639.07 2494.65 5182.17 2340.19 3539.41 4727.30 2297.44 3884.32 1778.17 3375.10 3171.99 1733.81 3591.84 2122.24 1014.67 864.42 1563.72 1545.43 1013.52 1427.16 0.00 898.07 1632.16 11777.53 12492.69 11488.54 1544.92 1268.33 897.31 0.00 0.00 1478.04 0.00 0.00 1107.10 6079.36 4762.63 4470.86 7603.61 4899.46 10817.49 ADP 428.035.431 563245.31 818676.19 635132.75 532508.38 494609.53 529360.56 509935.16 497793.16 455852.84 684500.81 674220.44 616512.31 521579.34 495295.41 501744.91 670856.94 647783.50 647880.44 846544.00 846369.81 940354.56 778940.69 699429.56 822100.81 674360.31 655198.06 657626.12 537320.94 528251.81 546089.38 483862.00 548316.19 584493.31 545129.31 623273.31 641231.19 2536.03 1612670.00 1288377.00 549731.06 638167.81 630969.19 593874.06 572932.25 585580.75 774514.69 853538.50 895612.56 687254.44 691896.62 618919.44 928813.06 956992.81 993350.75 899705.31 841116.25 939455.50 884795.00 875674.25 824043.00 839420.81 797294.50 817685.69 1015168.50 1052758.38 971464.69 731541.31 800208.69 868489.94 904481.50 1005417.94 1085871.50 898231.00 1001078.25 936167.94 973524.75 969638.81 1072890.62 853292.19 908583.00 819463.75 1319493.12 1342902.38 1381689.25 759232.19 771995.69 822807.00 908126.50 977802.75 889689.81 965032.44 969308.50 988172.81 827349.06 798088.31 863270.50 906818.25 947048.50 981679.75 907432.19 843186.69 874409.56 782301.00 810362.56 874005.31 1294240.62 983595.50 1190.89 ADP-Glucose 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 836.30 0.00 0.00 1670.67 1741.57 0.00 0.00 0.00 0.00 1633.05 1022.61 918.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16749.92 14581.28 0.00 779.72 0.00 0.00 0.00 0.00 1042.05 956.09 1980.69 13057.93 8347.66 11770.63 3054.96 6631.47 6884.12 6085.60 5214.88 7306.88 12174.44 9681.44 11503.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30669.29 31563.15 33303.44 19181.63 20230.06 24703.08 11926.70 12496.25 13163.33 8615.16 6666.13 8810.47 35301.32 35964.81 35193.66 8473.37 14864.36 12940.34 17011.94 16815.72 15094.97 12474.67 15546.26 18194.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 ADP-ribose 3423.39 4333.33 7191.03 1148.01 1002.26 1187.43 0.00 1044.01 1203.95 1180.11 1019.98 3116.88 2600.62 1226.11 1141.45 1793.69 1028.99 1274.32 1293.48 3087.99 1603.84 1696.39 2193.59 1085.69 0.00 0.00 1034.37 0.00 0.00 0.00 0.00 0.00 1051.62 0.00 0.00 0.00 0.00 25597.31 17354.69 3911.18 6996.07 6361.76 4926.10 2224.80 3067.10 7711.24 10551.16 13521.76 7078.35 9715.07 11163.73 5711.58 8633.41 9479.91 9143.78 12300.80 10406.91 9608.71 16157.66 9860.41 1484.40 1461.11 2482.02 7403.94 8914.87 21063.94 3328.49 4473.76 6174.51 1616.19 2078.93 6665.26 9434.62 7412.11 5995.08 1951.97 1846.23 2479.63 3412.74 3610.32 5770.89 5826.41 10388.98 8879.43 2708.05 1619.36 1407.63 2305.62 2888.05 1821.66 1306.02 4348.48 2396.84 2056.97 2332.83 6142.46 1456.35 1925.99 4342.91 16834.14 14633.35 16299.95 0.00 3568.48 2866.42 1030.37 8703.86 9919.59 AMP 58191.04 65489.08 34311.14 49453.49 46135.32 64255.22 52689.39 57226.97 38418.88 48280.77 45685.78 42785.14 43991.82 47484.21 44340.52 93932.38 75721.40 68778.71 71708.30 76785.34 80611.90 74744.34 74120.26 76368.62 72113.96 65494.98 58563.25 40314.64 37533.63 47082.26 41185.15 51289.32 47397.07 48409.23 50015.14 45789.90 1342.41 331611.62 239240.11 50472.35 91754.44 99498.50 64024.25 74551.55 72663.62 79022.62 82589.23 80138.27 115238.82 111636.98 100305.79 118086.31 109430.84 117381.88 104769.52 97289.66 105944.66 100409.62 122483.34 110791.48 77001.15 95068.91 119871.62 75857.28 86791.03 76099.84 77710.31 82368.40 85065.81 80927.37 83495.89 82525.32 144819.09 162182.42 148636.88 162407.11 235746.00 299266.12 121340.31 125818.72 119935.99 229839.39 227753.12 234913.83 174709.27 172411.17 183595.94 105714.62 121188.10 124261.65 161064.52 151716.94 155919.80 98214.90 102312.62 105419.12 161472.69 158558.77 223440.30 67030.62 61913.17 62663.33 76295.97 75675.16 90672.03 71898.74 70102.25 82016.35 ATP 1402756.12 2451150.75 980103.31 1138785.88 754928.31 1125982.12 1048417.19 984005.31 814716.00 1018753.56 978931.00 706765.69 1500898.12 1604909.62 1516956.88 1799270.62 2138059.00 1525342.00 1614168.38 1715772.00 1808019.88 2015880.50 2221462.75 2264231.00 2199265.75 2340200.00 2326044.00 1180405.25 1509336.50 1414050.38 987575.56 1118803.62 1267067.62 1083463.88 1445834.12 1786639.00 5849.66 3159450.25 1827330.38 1064603.88 1306354.62 1291465.62 1106924.00 878567.56 916124.81 1524286.00 1374199.62 1662261.88 1996107.62 1769215.38 1493200.38 2511728.00 2674599.25 3209125.75 1962370.00 1897516.38 2035778.88 2336882.50 1968626.50 1784885.50 3346629.00 3271210.00 3013810.00 3639016.25 4537605.00 3846699.75 2819574.00 3298517.25 3567614.00 2434040.25 2830291.25 2983548.75 1492927.38 1877322.62 1368163.12 863554.81 843123.25 884597.00 1793685.38 1758813.12 1459547.38 1442214.38 1924528.50 1421802.12 362345.03 322120.19 384970.25 1125023.62 1316286.12 1468279.62 1015534.00 889448.94 1012368.31 1385748.38 1489940.50 1496386.12 3059485.25 3531574.00 3646561.75 3700686.25 3542085.25 4370071.50 4565070.00 4381240.50 3906176.00 4608615.50 2854206.00 2923807.00 Acetyl CoA 15154.54 26329.04 8431.02 9309.50 4541.90 16522.03 16287.18 11193.34 7567.10 8482.88 7374.94 3739.68 19183.46 13865.95 13178.07 22646.63 20853.37 18207.86 17467.76 17549.09 18319.93 22895.41 20576.90 26224.31 21735.44 20564.45 18989.67 8511.49 10070.00 16777.94 6401.23 12038.44 8444.42 13965.36 12524.52 11962.87 0.00 44045.14 34358.20 21361.01 25149.50 25695.07 15501.45 18829.06 20143.90 20152.08 17571.09 23032.03 24071.33 28609.38 23355.58 37008.22 36203.66 36359.20 14364.25 24760.42 24200.04 28852.24 34343.28 27011.73 28900.83 29026.32 34690.16 57077.58 61250.18 63206.27 35484.75 41150.39 41959.31 39253.76 44303.79 43959.70 27517.25 28510.61 21833.40 20256.34 22351.36 22556.31 21388.76 17598.12 21185.16 15317.16 27169.88 22312.94 17690.39 11192.09 12213.53 17060.34 16745.18 25174.21 18465.83 9571.11 10983.13 21697.93 13980.00 24299.60 24955.78 30338.64 36301.21 54785.30 52916.39 55472.88 27476.01 30649.53 27953.02 57542.03 46652.18 50134.00 Acetylcholine 5633.30 7385.90 5336.34 3010.07 5505.71 4886.35 4717.04 5887.04 5703.10 4690.85 5252.10 3491.47 5563.27 5987.44 5561.89 8001.52 6576.50 6266.54 5474.54 6670.90 5467.56 11553.61 9206.28 9198.04 4905.30 3770.57 6375.10 3993.14 6156.38 5176.84 2580.17 3983.47 3890.95 4172.91 5849.42 6166.95 6116.94 11387.39 11888.80 6670.39 7651.61 8709.53 8842.21 7364.65 6230.88 5459.63 4527.95 3367.12 6255.31 4476.42 4471.46 5318.69 4427.91 4326.66 1316.12 5219.39 7005.23 6131.69 5439.32 5542.89 5920.50 3670.92 6560.88 6192.54 7729.91 6262.04 3784.49 5686.71 5240.39 3267.40 4602.46 3943.88 5630.37 3936.17 6469.23 4041.97 6667.51 5301.23 4442.19 3297.75 4287.24 10138.17 8209.64 6945.52 13056.80 9834.82 10862.32 11661.17 6490.35 10716.16 8238.59 9650.33 9489.27 11041.53 8508.86 7723.39 4238.62 5931.15 6094.55 6421.84 5260.80 5537.11 6330.39 5176.08 5511.40 5006.43 3829.85 7089.66 Acetylputrescine 54819.55 72813.41 69721.14 153480.30 142402.67 150693.58 38633.57 40760.79 39523.75 56009.27 48282.18 63835.33 84813.32 69823.16 77914.88 167341.38 162106.67 163965.70 27468.73 28798.08 30020.00 90414.12 73458.95 68589.30 93425.96 91545.62 101297.80 277197.06 265439.59 279712.28 268644.00 262810.28 355808.09 468739.50 484169.72 481979.09 4822.75 241734.39 203013.25 130857.12 182651.50 168211.80 57094.23 60455.69 50895.58 57553.11 74259.49 60000.03 421925.53 421192.34 427269.59 223931.80 263825.84 217473.23 31325.46 37308.78 37276.61 82511.81 105254.21 66611.52 97220.88 92966.60 107222.82 620898.38 676347.44 615603.06 658959.44 751794.19 643500.56 329455.09 433206.25 297645.94 132660.52 139893.78 96636.54 124896.60 131844.27 97338.44 33109.41 38563.96 31704.31 80989.69 102657.50 74510.15 228315.33 232009.17 172919.86 135338.47 143307.23 100014.06 51390.31 47759.64 55399.54 43464.65 44605.34 31633.75 82616.51 103877.19 55958.30 762381.19 788449.94 662877.56 148405.97 147030.83 132601.83 278273.53 247653.00 235278.25 Adenine 456535.00 307076.66 250492.55 231831.33 245007.86 250492.69 307808.09 280835.72 239373.69 264120.16 240629.33 218427.17 219092.42 244262.48 292883.75 224454.56 240714.36 230282.75 324615.84 225173.19 267096.16 106890.15 298489.41 278480.50 274242.53 348190.50 259571.38 230946.30 257102.17 399916.00 274069.66 549748.75 299844.78 284157.50 355018.34 326214.19 65373.81 456813.38 252637.56 241639.42 355502.88 489186.16 313612.78 527950.31 240322.83 487714.09 776237.81 348667.66 620335.31 488367.91 741461.81 554244.00 611079.06 300216.75 1141750.12 800552.81 582319.56 164086.14 814936.44 642547.44 411300.34 596155.06 613369.69 493275.41 635292.31 371329.47 545879.25 362987.78 589139.56 619169.81 657339.25 495400.91 407957.34 648492.94 224831.33 185666.83 223676.06 339578.97 301508.47 253999.67 207768.08 276524.94 363110.47 249047.52 298151.41 207879.23 273608.72 362653.22 490262.22 343497.09 472716.22 341133.47 223058.94 149211.64 205737.23 216752.08 410226.34 514880.00 311762.84 333052.34 307088.94 232767.95 462800.25 350370.47 366461.91 712672.75 449383.50 396958.75 Adenosine 71786.68 76213.09 99246.84 56675.81 56217.86 121424.54 73001.26 100358.87 43284.25 45153.75 40722.13 46528.61 46657.45 46359.04 38200.71 82334.84 66751.41 60556.62 61784.95 50185.33 62006.70 40668.03 67306.34 51174.22 161149.12 101567.65 74509.08 29355.86 32760.38 49270.28 28413.33 53158.82 47699.81 37249.93 53352.43 42464.28 20920.32 415746.91 192967.48 47716.50 136315.47 181467.06 96813.98 140158.64 138496.22 69733.54 141239.27 62024.19 95518.82 89048.49 145579.23 105856.13 127444.96 161160.53 146249.81 106315.38 97312.01 82807.97 245313.92 151482.27 161073.33 175023.33 524091.75 80025.79 89481.25 54782.22 78099.88 40677.81 53409.00 114992.10 77544.40 91645.65 288434.72 344893.34 326545.00 151699.75 303786.56 505117.50 175197.33 227293.58 329076.28 166267.39 104787.27 127038.78 111231.44 83045.47 169377.80 74084.07 119117.01 135105.48 117473.52 145745.28 103517.95 81876.37 86555.52 105514.01 546774.81 642601.56 1149894.88 58370.23 45956.00 41731.88 48385.43 46134.67 41445.37 103987.43 84484.23 88999.12 Alanine 167081.11 184339.27 161479.00 86006.94 96408.53 127682.02 138094.64 136759.70 112012.77 98255.72 77855.88 87479.98 86059.12 111010.40 115201.34 247905.48 218423.08 234774.00 59078.57 56655.81 65577.66 132674.03 174749.52 140644.41 296891.22 264507.75 228376.08 148473.62 154086.58 162059.84 171555.77 172935.67 133329.92 150091.09 166112.50 159778.42 14342.70 220106.17 171678.50 108018.81 115645.98 86471.21 169599.55 160058.84 161464.97 69686.26 48852.57 140838.73 219741.69 231265.44 216669.61 241768.25 271442.59 256154.89 51139.16 90752.82 87124.26 155180.48 130289.44 165859.92 260433.83 286050.88 308916.38 326716.03 304648.44 216211.88 609518.69 535176.12 390675.34 279227.72 288112.03 263808.25 173957.70 107523.63 133111.33 149666.28 160222.69 184784.64 83004.05 104467.21 109602.46 73461.59 36689.92 77092.70 124729.53 168331.55 156723.25 155212.72 109473.45 123701.38 36589.48 85216.77 113051.10 77808.40 46119.15 33271.72 197193.20 198246.62 186821.36 29954.17 32650.80 31725.31 474467.84 496132.91 498736.88 41255.68 72737.95 63510.46 Anthranilate 5004.62 1608.61 2173.64 4964.21 0.00 3333.47 4658.70 3602.92 2744.65 3153.75 4047.24 5835.80 4971.59 2792.04 5966.68 2151.07 4239.72 6300.55 2121.58 4928.62 4436.26 2387.53 0.00 5047.17 4995.32 1346.95 2112.79 5888.17 2208.12 2797.37 2643.00 5431.64 6411.44 7165.41 5006.94 2931.28 5731.04 7476.79 0.00 4252.39 3731.41 4368.79 4349.08 4484.56 0.00 4731.50 5505.86 6596.61 3689.27 2821.75 2787.23 3642.90 4614.59 4170.14 6875.44 5207.73 3238.82 0.00 0.00 5178.31 3062.01 5860.40 8827.90 3622.26 6794.49 0.00 6330.27 4084.26 3380.81 9130.38 3137.82 4701.32 6389.31 3450.56 3923.82 4403.25 2995.09 7189.29 7580.69 6316.29 7807.32 8572.23 3805.09 6818.13 7401.82 3685.55 3014.94 5557.83 10364.69 7706.78 9396.97 4483.93 7052.95 7817.65 4571.75 9006.41 6126.48 4539.24 11208.09 5909.95 5500.59 10071.06 13422.85 3724.31 0.00 11039.41 7445.42 5534.25 Arginine 10084733.00 11847748.00 10106060.00 6956034.50 6772635.50 9262124.00 10482517.00 11296028.00 11299448.00 4943903.00 5633371.50 3298920.25 7163972.00 7157906.50 8889351.00 22218846.00 19716674.00 16893646.00 20981912.00 22735818.00 24494726.00 18548762.00 23237558.00 18096262.00 29595158.00 28152934.00 26172712.00 10369587.00 11479613.00 12463263.00 5466899.50 5884632.00 7250257.50 5689126.50 6265969.50 6138269.50 27676.87 15812429.00 13860475.00 6473414.00 10808318.00 10705431.00 13541739.00 10912573.00 13577439.00 7911461.50 8402833.00 7978850.00 17092216.00 13004040.00 12623851.00 32558554.00 30821198.00 33374410.00 25272104.00 24686542.00 25609992.00 22627478.00 21379634.00 25167418.00 31759336.00 39465116.00 46519380.00 61189888.00 58910660.00 69187936.00 49800572.00 45217172.00 56652652.00 25497306.00 26537826.00 30947062.00 15798992.00 15436456.00 15003493.00 16841526.00 15599084.00 16004927.00 21517784.00 21192870.00 19994814.00 9516862.00 10364217.00 8365901.50 12925525.00 10712565.00 14220824.00 17279616.00 20281298.00 20009072.00 18956166.00 18714170.00 21372392.00 19563110.00 18197874.00 18805750.00 51303296.00 46828068.00 58654156.00 73894440.00 68188168.00 69644456.00 77509304.00 78271448.00 84509608.00 60113308.00 42379364.00 49673728.00 Asparagine 1432289.38 1841683.00 1525320.38 1802557.38 1539461.50 1896151.00 2097345.50 2245670.75 1919852.62 1128254.25 1158370.12 1134530.25 1261244.25 1227492.50 1246231.00 3626418.75 3308695.00 3218377.25 1577433.38 1498243.00 1711457.00 2941430.00 3056045.25 2798089.25 4125217.25 3910896.25 3626543.00 2007823.38 1910953.38 1871275.50 1966399.00 2357966.00 2464594.25 3162583.00 3189740.00 3061382.00 2056.71 2724515.75 2171498.00 1743167.00 2225483.75 2394308.25 2525518.00 2364885.75 2658358.25 1180696.12 1197222.62 1398178.50 2219792.00 2306248.00 2307583.50 3683445.25 3563265.75 4085810.00 1897220.62 1789623.62 2093261.12 2279389.75 2310518.00 2384800.75 4097595.25 4248125.50 5670212.50 11559664.00 10207292.00 10925435.00 14323492.00 13823499.00 14359792.00 11975448.00 10521909.00 13572685.00 1969860.50 1831011.00 2171932.00 2283933.25 2220522.00 2634494.75 2067498.88 1839640.88 2219205.00 1203246.62 1158250.00 1464748.62 1636878.12 1582147.62 1850791.88 2485670.25 2370232.00 2947700.00 1928195.62 1996764.62 1860278.50 1501878.38 1282348.88 1825323.12 6454647.50 6627874.00 8218238.00 9725840.00 8633529.00 9511749.00 16805156.00 15012624.00 18523354.00 16103432.00 11965055.00 15720919.00 Aspartate 52379.55 66471.28 49691.59 96350.49 92570.38 103110.38 72584.02 79440.43 77629.54 49123.21 41883.54 48020.50 55249.30 53158.18 53232.77 129186.19 128706.15 112895.15 76270.54 72987.12 77428.98 130085.88 116267.23 135708.59 348336.41 331543.34 365625.78 258804.83 278771.28 273880.66 250112.14 261710.62 271390.59 265358.34 247048.98 224258.08 1543.07 59972.59 60717.18 118743.85 142219.00 157199.09 111230.09 105961.29 113699.54 47186.04 60404.56 51844.72 62855.79 66912.55 69988.48 121299.59 135292.45 126207.78 117595.18 105694.10 99267.93 114339.09 113701.28 109308.95 204495.88 201694.52 219689.69 80707.09 62560.99 52706.50 111521.63 101899.69 89955.41 50055.10 68686.56 56663.23 43284.50 38439.43 38997.82 87648.52 80101.70 80525.20 77102.95 67800.12 74297.37 43734.61 51076.35 43365.46 43633.07 40952.08 54972.59 63518.64 61278.84 71304.40 82901.60 73763.99 81466.40 82157.88 54280.00 58214.88 93586.66 96713.34 199569.08 49480.02 50193.57 47205.36 105653.87 101381.80 116817.81 304065.09 36067.02 40732.84 Beta-Alanine 1056783.88 1682226.38 1127860.25 1233543.38 1182407.75 1499340.12 585881.44 896266.06 794848.81 1836500.62 1981698.00 2192791.25 2912266.75 2800214.75 2890150.75 2037292.00 1704858.12 1702204.38 2855656.75 2868833.25 3333790.00 1510193.00 1650340.38 823805.50 3157282.00 1733184.88 4326096.00 2600968.50 2225197.75 2433312.00 1591681.38 1991757.38 1974186.50 2547351.75 2869538.25 2828802.00 19470.62 2090691.88 815731.31 771057.69 739607.56 1089398.38 1030935.50 521683.88 685348.06 1435968.38 748720.94 983577.00 3009535.25 2940004.00 2983669.25 2221349.00 2062600.62 2481050.00 3285933.75 2423042.75 1343566.62 1017255.19 1644044.00 1916810.38 3861273.00 4309602.00 2370565.75 6005956.50 5687100.00 6233239.50 5805333.50 3677638.00 961119.06 4848717.50 5045344.50 5563255.00 1933715.38 1686424.38 2025311.50 1289533.00 1252354.88 1149255.00 1398972.62 1201001.88 1748608.62 2024732.62 2279254.25 2921126.75 2267498.25 2271735.25 2838754.75 1347744.38 1127415.38 1620832.00 3704077.25 4197655.50 3461917.25 1131178.12 1119641.62 1067011.38 7572170.50 7413944.00 9326355.00 5672578.50 5625439.50 6245188.00 6687802.50 6493882.50 6896118.50 6569284.00 5198260.50 6386360.00 Betaine 6583152.00 6950656.00 6651710.50 8258737.50 7070000.00 8788473.00 7947779.50 9470627.00 7331346.50 4599946.50 4970088.00 5431389.50 6706111.50 6545390.50 6851136.00 15576181.00 13669576.00 15759341.00 20802936.00 18723226.00 21291516.00 13899024.00 13311019.00 11683987.00 47636924.00 49198284.00 44826932.00 16311241.00 14585448.00 14931229.00 9733501.00 12801291.00 12875285.00 18045984.00 20267150.00 18174420.00 16111.84 12513995.00 12279759.00 8370816.00 9318004.00 11152229.00 11381685.00 12135699.00 10986708.00 6532546.00 7269789.50 8580761.00 12945281.00 16185641.00 14560352.00 24834688.00 24845296.00 29256856.00 24835184.00 27384496.00 28892888.00 22123024.00 25972062.00 26178758.00 73952472.00 69866840.00 74878456.00 56546624.00 46836204.00 57773792.00 46847584.00 44145680.00 48891200.00 54556476.00 54514452.00 64313468.00 15238005.00 14809484.00 14925853.00 16116352.00 16229545.00 16629523.00 21672886.00 20605144.00 25542986.00 9549550.00 8299543.50 11024810.00 14428975.00 14302912.00 15400065.00 18820086.00 18866656.00 24605274.00 27674482.00 30649150.00 27285170.00 24071590.00 21722846.00 24859686.00 72136560.00 70464840.00 83957928.00 56429700.00 53359884.00 59789120.00 61823228.00 57674276.00 69764160.00 89670176.00 64963308.00 80069280.00 Biotin 5469.65 7548.05 2446.95 6981.80 7416.31 6742.78 7483.03 7693.23 6325.23 1494.03 1498.53 1909.47 1495.75 1742.47 3795.55 11661.82 12521.24 10613.90 13984.38 11709.91 10196.58 12836.57 14515.83 13027.26 13922.99 13871.64 15594.04 6413.58 6604.26 8323.04 4812.79 2778.90 3530.41 1675.65 3967.48 5676.73 0.00 12717.81 12177.51 6854.47 8222.53 8290.79 13502.77 13823.58 13149.37 8903.44 10816.74 9149.29 13690.10 15267.91 14048.12 30276.02 25200.86 26979.69 22140.52 17204.65 21268.54 32642.69 39227.72 31734.30 32835.73 27203.55 36100.22 24193.42 17123.60 18562.43 16351.16 12242.79 13403.66 11582.27 14729.63 15333.87 11109.91 11326.15 10335.46 19092.96 13506.95 13675.29 36230.20 32942.46 31088.88 13312.43 14561.04 12940.01 7308.51 10000.43 10309.77 12388.53 10654.43 13300.09 8186.31 9109.38 10238.38 21530.77 22485.33 19381.20 17506.83 20297.79 19910.22 19858.43 20597.88 17720.60 12258.88 8909.62 11010.22 23448.58 14847.77 13244.73 Butyrate 7065.49 7818.32 13594.18 20678.86 6753.68 8187.01 11708.44 7311.02 9292.46 15352.48 6129.33 12860.63 11428.32 18793.79 18482.01 15903.67 7586.64 12196.86 18418.60 19000.85 7855.74 19148.09 17576.29 12340.89 18375.31 7673.77 14908.39 14893.10 11590.63 7313.68 17947.10 14805.85 12879.02 13589.05 6980.12 14710.48 39869.84 22228.32 8968.29 23970.17 0.00 30458.98 19739.91 10735.65 30557.57 11874.45 19018.51 9333.29 25926.78 11489.74 11556.17 10223.00 18529.75 11266.21 19202.00 6881.25 11061.32 19714.42 17511.56 12181.98 9819.01 22453.07 17880.74 24532.28 17056.05 0.00 20617.26 24022.45 9573.31 10264.22 34098.06 9693.03 27390.02 15717.10 10044.67 6118.82 15457.14 33109.74 17614.95 10080.97 20269.92 30864.76 16458.45 5536.19 13327.55 20362.31 19083.76 19500.95 20204.29 6741.65 29561.75 12577.69 12126.45 19240.80 3634.42 28049.38 14125.19 17794.28 17861.21 17928.54 27571.78 20461.07 20824.93 9469.72 13807.45 9257.01 20461.32 18829.65 CDP 5405.02 7443.50 2705.79 2726.85 3579.22 2505.71 2395.01 2696.27 4088.48 4717.67 6409.02 3037.87 2027.35 2153.17 3652.30 2732.27 2930.42 2376.01 4938.76 2916.73 6297.20 4665.58 2908.97 2813.85 12072.10 7274.35 7637.74 6814.59 8518.64 5606.19 3986.26 8053.86 4963.76 5262.34 14670.40 9352.06 0.00 9544.66 5993.23 4362.12 3122.79 5437.21 6133.38 7829.27 9636.86 5875.68 9285.67 6413.84 2880.72 7749.42 3950.75 7142.80 4314.34 4841.04 3496.34 6350.52 6569.50 2917.62 10054.61 2412.71 14272.15 15689.98 17043.91 15813.30 14151.90 16039.11 19165.67 19135.39 13542.43 20947.97 18507.77 17966.08 2338.19 4879.51 2598.79 2916.03 2581.09 2502.08 3265.37 5535.86 3814.69 7459.73 5632.82 12328.44 3053.18 3473.21 2047.99 3153.77 5685.82 2850.43 3066.41 3044.48 7019.10 1940.89 2652.18 1575.24 14452.15 13805.47 15761.59 8004.68 12315.14 8956.46 12256.60 11091.58 10436.78 21687.27 13599.12 14338.97 CDP-choline 3865.83 6307.19 4845.86 24934.25 20491.40 23250.60 29817.92 26005.19 27907.55 29775.37 31642.16 27808.99 8966.95 9648.32 10189.61 24774.52 27554.60 24769.16 17678.37 17747.99 16826.00 17225.02 17115.08 17769.42 29470.16 31970.82 25384.65 4685.38 4458.60 5194.99 7026.22 7344.26 6782.50 9119.36 10370.64 8835.02 0.00 14544.40 12857.13 17396.74 21200.46 18863.69 30812.57 30999.05 28967.81 24522.80 19914.49 18173.27 40227.14 46647.41 44731.16 32506.84 40326.58 41390.91 25988.90 27884.73 29141.93 25592.45 22704.95 23305.23 29738.29 33613.78 28875.74 9151.34 7721.06 9282.25 13337.01 16261.69 12207.78 10553.94 10509.20 11860.56 7457.79 6861.25 7500.61 44568.06 52400.38 44190.86 42061.57 45534.46 47549.91 45647.30 30177.38 39296.32 37660.22 36190.00 33419.52 38617.86 37728.40 33896.97 27991.26 29349.66 29181.33 15899.58 14079.12 14891.30 14216.28 16309.15 15834.26 4991.47 5439.96 5653.55 6886.19 7413.33 7316.82 11045.94 6686.54 6992.70 CDP-ethanolamine 843.58 2135.67 1255.63 4970.32 3743.88 4877.75 4086.38 5139.70 3885.21 11800.72 12290.89 10106.88 5248.69 5379.05 4822.18 1092.22 3047.64 2093.53 1784.51 1232.88 3063.37 1271.39 1130.98 1460.63 6020.35 5399.63 5852.86 2290.54 1229.17 3124.94 2723.08 1824.38 2259.34 2705.56 5276.81 3955.91 0.00 5912.23 3066.80 973.72 3563.61 2776.93 3672.25 2434.70 3530.11 7212.55 9116.01 7952.02 7634.02 8007.91 6419.72 4081.37 3034.93 4005.65 3009.37 2138.69 3158.42 3289.07 2889.48 3707.35 5600.89 5407.47 5616.01 1393.55 3806.10 2772.64 2739.29 2875.85 1689.47 3783.40 3968.92 4077.80 3879.88 2643.50 3360.62 8599.32 9539.93 8755.73 8568.03 7444.93 8528.54 15006.88 14692.87 16718.12 8851.84 8311.80 8119.87 2827.49 5110.39 3896.86 4917.73 2440.61 3294.40 2025.52 1816.46 1004.14 3173.71 1999.50 4497.68 2201.13 5113.27 1605.38 3327.07 3023.68 3323.85 3473.09 3585.68 4564.82 CMP 24072.53 20641.01 28395.90 20510.40 23752.37 33070.55 22025.12 32664.42 23183.59 15952.01 16777.53 18202.90 17014.44 11766.08 11052.44 28186.03 16625.08 37247.09 25462.37 20614.26 20914.71 32570.89 32839.26 39761.89 53980.05 65770.16 43985.27 16856.29 22283.69 20368.08 12914.88 23334.74 23068.18 21762.90 27701.73 15902.88 0.00 69289.74 69292.45 49413.19 45690.94 41846.86 49046.32 69200.52 43922.21 20191.13 28794.31 34728.26 35066.92 46702.00 37995.30 39917.04 62840.31 86712.87 30579.19 53514.73 49119.95 56862.94 80115.85 56713.30 186696.14 112385.41 132808.89 107452.31 46666.28 79449.44 66699.12 74587.65 77143.32 63412.39 72887.03 94722.21 37639.43 46084.08 39903.58 28911.44 29249.65 27692.71 39759.70 37597.08 38083.25 27402.18 23039.86 31713.44 24062.78 27051.92 26492.69 34590.39 34794.09 34594.95 29859.10 37155.61 37904.79 30492.40 28006.66 33941.90 82718.10 85049.16 83967.31 39369.73 38957.07 34287.07 42076.79 44925.56 49610.61 13372.70 44560.01 50598.00 CTP 59040.44 90938.53 59935.62 58662.88 43869.50 57505.47 67613.11 59595.09 58178.89 63206.32 59447.47 50748.49 60496.13 61693.20 53761.41 61839.00 81386.00 60449.59 55276.57 58149.14 59874.36 50434.22 54249.23 57367.54 212523.75 220761.48 200842.17 100739.29 122881.25 117810.15 127886.19 135508.20 137986.11 153135.30 175116.17 190494.31 0.00 46744.22 33311.48 44142.83 37713.00 32218.06 41113.48 36204.02 34203.94 37757.02 31379.82 44882.99 27272.97 31687.53 19890.60 36585.81 46719.44 52010.80 32703.51 28187.33 31519.55 34261.08 30867.18 28757.87 200699.86 158817.70 118980.20 183805.30 234561.17 227002.38 184797.50 239893.61 265347.41 176806.81 235393.33 241204.50 23478.16 39568.43 27875.89 11501.73 10952.59 12614.81 29972.46 22607.34 20960.60 19765.12 33013.98 26049.93 9966.20 10005.21 10635.59 15393.60 21033.95 19397.34 17598.39 13798.89 13799.95 20052.83 22992.13 18407.12 191782.77 172534.88 176878.92 152671.27 147809.80 159596.12 221044.23 232697.14 224930.08 449861.25 227484.88 261566.00 Carnitine 2586979.25 2851968.00 2775299.75 2914261.00 2607369.75 3014072.75 2811891.25 3355826.75 2341724.00 2632020.25 2725740.75 2900021.25 4192538.25 4261422.50 4075881.00 6503989.50 5625816.00 5981963.50 9006727.00 8469184.00 9162907.00 3074453.00 3304307.25 2719837.75 7128860.50 7500133.50 6715810.50 4601152.00 4053733.25 4452058.50 2233829.25 2963450.25 2886302.75 3324778.75 4149291.00 3699835.00 24828.27 3866102.75 3141891.25 2145302.75 2941714.00 2672738.75 2849101.00 2808303.00 2735546.75 3716312.75 4194801.50 4744722.50 7011983.50 7605321.50 7075719.50 9699208.00 8798461.00 10158028.00 12326112.00 13535879.00 16134289.00 5178396.00 5372327.00 5708558.50 8739412.00 8698681.00 8797539.00 5156028.50 4795876.50 6506283.50 8122991.50 7500585.50 9324569.00 3880284.75 4721398.50 4885363.50 3050764.00 2671900.00 2751318.00 3819597.25 4422646.00 5442007.50 6530760.00 5773051.50 7709953.50 3567038.75 3398305.25 3953424.00 3855856.00 3529373.25 3823139.25 5802050.50 6175000.50 7358494.50 14619939.00 15973008.00 13470577.00 3831875.00 3729086.75 3837851.25 7177111.50 6807829.50 8057919.50 13265425.00 13517557.00 13784856.00 17679418.00 17264810.00 19581082.00 6380658.00 5544944.50 7048495.50 Choline 10687137.00 14344985.00 12388921.00 18408076.00 15326596.00 16810314.00 11118311.00 12936312.00 10547593.00 11506364.00 13237835.00 13635635.00 18613106.00 18877378.00 19573162.00 6682984.00 7023312.00 6772276.50 12714691.00 12055388.00 15458580.00 16567489.00 14344171.00 18216478.00 2499550.25 2298270.00 2343961.75 13521173.00 12649419.00 13367984.00 6184817.50 4984483.50 6113240.50 1860947.50 1867877.50 1708108.00 36295.61 27027336.00 24100352.00 17537368.00 19180292.00 21487174.00 15359813.00 14731196.00 15919223.00 24968842.00 28753328.00 25234514.00 30609906.00 28972032.00 31269198.00 6378849.50 6747486.50 5948860.00 16137832.00 15322533.00 15357055.00 5618509.50 5904516.50 5125665.50 3421599.75 3297696.00 3451174.00 14219024.00 12374269.00 10879377.00 5284736.00 6508580.00 5846732.00 3396693.75 3721516.00 4030241.25 43580292.00 46474332.00 44641812.00 31684648.00 37712812.00 33729416.00 10833366.00 11023764.00 11414323.00 19741024.00 23072374.00 23821830.00 45614480.00 47184436.00 47109844.00 5016190.00 5558565.50 5134522.50 10793405.00 11754196.00 12955047.00 3719806.75 3503044.00 4930244.00 1969140.62 2287827.25 2932943.75 7190245.50 6108020.50 6608499.50 1996455.38 2184644.25 2427102.75 7950890.00 6024108.00 6169633.50 Citrulline 117625.84 118508.80 107604.28 94092.21 79451.63 97718.73 83942.21 89599.28 78315.32 52606.20 64039.30 63409.25 97483.57 98427.65 84439.65 195057.56 158732.42 173438.20 97150.41 94397.85 113461.69 210891.75 212909.70 184916.39 185490.81 188611.69 193814.44 87839.20 83345.45 80625.16 54290.23 67999.38 67234.71 84172.53 85896.33 86904.84 1748.15 273679.62 205847.19 73825.49 110560.81 105417.62 109471.55 96722.74 99989.35 90900.93 93112.10 102406.78 204310.08 224594.94 216827.81 214771.08 235952.88 257867.44 164802.62 156448.73 161494.08 242857.64 246578.20 262115.86 284638.69 275322.53 321935.75 937415.31 1000119.00 1165665.62 897379.50 880047.50 993994.31 527488.94 382233.66 663744.19 205868.83 189749.20 216268.23 177908.89 207837.95 210700.62 209027.11 192757.11 211568.62 104757.60 114112.73 125564.23 147767.94 142490.27 182607.55 158387.45 175564.55 187924.88 225340.80 156209.98 149658.75 206285.48 185279.62 217250.81 498588.97 537855.69 778919.56 1342246.62 1183747.00 1337624.00 1596909.12 1587011.12 1648571.12 1458072.12 1073276.88 1375644.00 Coenzyme A 3983.99 10270.99 0.00 4446.08 1968.47 2818.78 4074.13 5915.54 2642.40 4692.28 1634.02 2335.41 4499.66 6778.65 5422.49 8098.15 9417.73 7746.69 2436.68 3921.10 5230.75 5379.30 8619.27 10049.43 2550.28 2209.86 7921.98 2875.22 3370.89 4059.63 4237.43 4473.42 5721.13 3351.17 1499.19 4993.32 0.00 13611.07 2971.16 6643.53 10908.23 9197.65 5653.61 4678.22 3472.02 4908.37 7063.80 4698.55 8875.50 11271.62 10493.80 13755.21 15327.57 17690.90 12613.98 7622.67 12302.27 11991.76 13566.68 9740.11 6905.98 11272.58 10938.48 6842.32 10907.52 8718.47 13351.15 11121.31 12192.41 5744.58 6924.54 6656.22 3419.69 2146.49 2921.70 9977.32 5932.14 11227.14 13611.40 12624.38 7316.17 2284.25 4217.11 4072.00 2260.31 3011.26 3353.59 3756.18 6594.40 8053.11 4051.16 2870.49 3230.78 2576.85 7642.18 4262.75 2636.90 6232.36 6515.59 6640.68 6451.91 4503.02 3406.79 3200.28 5757.40 15807.71 4032.88 9282.82 Creatine 887983.50 1020165.69 950725.00 1158559.38 1114750.38 1248050.38 895083.94 923562.00 700695.25 982604.94 1028132.44 1078079.12 1335867.62 1199685.50 1281232.00 1861222.38 1599650.38 1755110.38 2180127.00 2216164.75 2413588.25 2064904.38 2133067.50 1849973.50 2379664.25 2644988.25 2326913.00 2206336.00 2024823.12 2309878.25 1331962.38 1750490.62 1712990.00 1070435.38 1424440.38 1199123.50 95375.53 2342021.75 2095099.38 666014.06 934717.06 935258.31 857550.69 864802.75 834622.69 1136704.88 1235451.50 1437046.38 2286989.50 2377878.75 2764680.75 2621953.25 2436748.25 2726707.75 2223227.25 2850942.25 2954364.00 2508557.00 2808215.00 3024448.00 4173724.25 4360719.50 4370878.00 5248824.00 5758136.00 6183687.50 5363740.00 4868827.50 6075381.50 2729339.75 3094623.25 3441191.25 2470760.25 2085890.00 2672797.75 1727449.00 1996995.38 2506831.00 1734873.62 1575209.50 1970405.88 1672860.12 1707383.38 2005742.38 2615868.25 2693323.00 3134078.00 1752508.62 1613005.88 1769133.50 3519058.00 3919867.25 3039290.00 1979981.50 1992015.00 2168632.00 3434827.00 3659764.00 3665924.25 4993323.50 4865496.00 5454230.00 4664243.50 5087511.50 5452224.50 2803017.75 2911652.00 3591151.00 Creatine phosphate 849771.25 1088476.00 833580.81 1653058.38 1749930.00 1871084.62 1044314.19 1061250.38 922082.75 2018583.88 1907277.62 1765302.00 1100794.12 1145443.38 1039573.81 1657101.62 1591292.12 1435645.00 1499649.12 1646710.50 1860176.00 1083098.88 1091614.12 982985.50 13151472.00 12850973.00 11867135.00 1910582.62 2011346.88 2076736.00 5442199.50 5500500.50 5783537.50 3804993.75 4303000.00 4282927.50 0.00 686327.12 567955.81 542015.31 614832.31 862709.25 531738.25 536575.06 608195.44 1051377.62 1140559.88 1238483.12 588657.75 457449.62 528177.06 1200920.50 1158071.62 1258417.75 918601.81 878055.19 1034113.69 892885.25 984116.50 1048198.06 12780644.00 15675409.00 16395052.00 4165093.75 4856333.50 4478146.50 13332909.00 14119461.00 14477399.00 6653089.50 6753173.50 7498068.50 1015773.56 950248.06 1014189.81 510774.84 535183.81 612176.75 719483.06 701940.94 780934.44 1208031.38 1595843.38 1588279.38 492471.03 459251.16 605184.00 659455.50 673531.19 781060.94 800210.50 895593.94 749956.94 892154.00 890946.75 869932.31 20244704.00 22376800.00 24856170.00 3804447.00 3515127.25 3801530.25 25213560.00 23884528.00 25754646.00 15408341.00 8950842.00 9666913.00 Creatinine 2330561.25 2648666.00 2366587.75 2571525.75 2188213.25 2311217.25 1831007.00 2090342.00 1714759.62 1931351.62 1945479.50 2180739.75 2211711.00 2130793.00 1999516.38 2955181.00 2499188.00 3128194.00 3354010.00 3000954.00 3373600.75 2920678.75 2854188.00 2900023.75 5873245.50 6385620.00 5454107.50 2890936.75 2842308.75 3066641.75 1960893.50 2922020.00 3329077.75 2415913.50 2949963.25 2672596.00 21468.35 4584648.00 4892292.00 2552974.00 2579702.75 2865735.25 2614642.25 2519443.00 2287697.00 2937694.25 3459162.00 3685523.25 4121423.75 4660769.50 4449659.50 5093294.00 5353417.50 6147635.50 4597898.50 5158438.50 5486114.00 5063133.00 5568933.50 5683662.50 13556399.00 11747619.00 15737627.00 10492644.00 8004682.00 9548004.00 12568307.00 13012733.00 14740491.00 7360712.00 7615464.00 9421244.00 4049650.00 3937114.75 3952770.25 3683080.75 3634589.25 3445574.25 4186669.25 3686080.00 4172502.75 3476019.75 3077678.25 3927239.25 3409394.25 3627129.25 3692498.75 3255833.00 2970616.00 3905346.00 3678845.00 4223876.00 4245674.50 3963046.75 3343032.75 3723002.75 10110590.00 10002376.00 10145446.00 7327316.00 7444548.00 8504347.00 11257221.00 12877905.00 13721969.00 4819334.50 6604271.50 7574724.50 Cystathionine 2980.16 3721.99 3532.77 57267.11 47741.42 63971.45 43791.64 44621.71 41052.04 4043.52 3757.16 2601.16 4411.30 3588.38 3906.95 37497.43 31458.09 22072.68 1597.63 2807.15 3081.41 5965.32 5517.80 6432.36 50284.12 52132.50 48074.01 8173.06 9885.16 9397.64 3272.11 4788.95 4517.27 9142.14 10281.85 8638.36 1530.44 3251.81 2749.67 56761.48 55600.22 65078.21 33422.18 31098.94 37875.69 1724.87 1775.27 3775.51 3579.31 5648.36 5809.27 22426.93 24936.56 32001.03 2973.06 4103.07 3545.59 1789.28 2724.75 4152.79 17999.57 20295.58 20846.94 14814.00 13773.31 12609.86 10720.90 10179.85 10877.06 10425.57 8997.05 12237.12 3873.64 4016.26 4432.95 35928.47 33225.28 37994.93 8896.36 7531.77 7506.82 2283.28 3850.57 2399.37 2354.74 5075.32 3946.98 10787.07 12062.87 13756.32 3387.00 2652.34 4087.84 4297.45 1554.57 2647.65 13862.52 12737.06 15248.02 6412.00 5838.35 7277.02 11630.15 14441.64 12596.74 7610.30 7626.36 9228.35 Cysteinesulfinic acid 1605.85 1223.82 2112.29 2546.69 1765.78 1399.80 1595.79 1391.63 1456.79 3714.57 1924.61 1434.48 1048.44 1199.66 1810.02 950.08 1421.21 1571.91 2206.43 1270.80 1377.42 2050.94 1410.29 1297.67 1409.15 1747.36 1449.80 1928.70 1681.03 1324.34 1074.04 1960.16 1839.55 1777.65 2140.02 1659.75 1227.34 1507.66 881.93 1924.02 1381.88 1698.12 2591.52 1440.58 2460.16 1389.75 2179.46 2585.17 3514.04 2257.92 3480.47 1559.34 1643.33 2384.75 1704.13 1834.90 1612.43 1783.42 2811.48 3494.73 1534.98 1593.20 1332.24 1621.53 3183.08 1087.48 1695.49 1071.24 1341.50 1490.83 1779.48 1575.65 3200.05 4501.37 2527.54 2263.60 4590.47 3643.57 2342.41 1870.96 1726.55 2001.17 1978.36 1929.35 1916.11 1669.79 3560.56 2463.28 2437.80 2774.54 2026.39 1934.34 1816.23 1882.06 2152.04 2023.10 2065.69 2047.56 2801.27 2800.13 2684.36 2478.70 1872.66 1584.62 2747.45 1672.40 2084.95 1513.10 Cystine 27759.21 28805.81 16203.58 29025.14 17223.59 19276.43 34578.29 33870.03 37537.50 16841.82 15638.75 9901.86 14023.18 10796.27 19071.80 26368.48 32527.17 21722.54 63072.71 40255.06 41664.44 29039.10 33717.97 37417.09 51250.83 56609.17 85051.49 23405.44 48564.11 42799.09 32423.81 23371.66 20639.37 11121.67 13233.14 16153.74 0.00 30404.35 36076.90 33726.50 34453.06 31278.84 58320.89 45042.79 46344.36 29176.35 29635.19 26708.82 32924.78 34391.64 33238.47 57923.36 64212.73 68855.85 80637.67 63365.44 58100.10 60981.31 38364.65 32976.52 97298.96 71136.77 70146.70 85673.55 50569.74 62443.23 61065.41 58304.30 41785.81 36503.52 32740.49 37264.61 21759.73 23076.43 24303.74 36371.50 32911.25 21722.69 71555.07 52142.67 52412.05 25912.45 30272.96 22829.64 24419.69 25415.84 32212.17 33527.03 33729.66 30897.62 21102.79 20814.60 34283.73 24190.20 22141.25 22633.45 26765.63 31312.22 29443.72 69104.74 57312.74 57518.21 46072.89 35470.13 44902.57 20723.17 34365.06 30759.53 Cytidine 6604.52 6650.96 3146.62 2917.48 4596.49 4224.24 3978.01 5051.64 5586.40 2434.68 1960.36 3204.33 5028.84 4219.00 4287.54 6953.78 7546.17 7837.33 5394.04 1989.81 4199.70 4847.04 5166.18 5941.06 13742.78 14853.46 11723.06 2179.45 2623.29 2259.32 768.10 1978.19 2079.80 1629.58 2241.50 1434.32 0.00 14447.90 14221.91 6608.52 5864.73 6574.37 6485.07 6908.71 6099.46 5384.44 6570.07 6424.76 10670.86 8465.38 8165.17 12585.33 11629.19 14029.70 6246.28 10635.99 9939.29 10753.72 12910.63 13322.13 34984.73 32335.83 35914.27 29951.83 24159.32 28202.99 15515.88 12461.80 11967.89 18131.80 21111.85 23644.53 13287.03 16695.03 11537.71 7708.49 7878.15 7252.28 9463.84 8266.50 9598.06 7426.16 9175.87 6587.55 8061.63 5860.73 7757.54 10228.06 9733.15 10030.26 8579.23 7997.66 9031.22 8858.62 9844.33 10756.03 42173.19 39142.80 47045.97 23190.64 22695.59 25303.27 28021.94 31884.57 31170.88 32062.92 29855.84 35862.31 Cytosine 18104.37 18744.18 15974.53 11627.11 11242.29 13622.64 10546.37 10763.97 10129.32 20107.12 20164.54 20858.49 15746.76 15069.97 12606.09 11834.12 13878.86 12715.14 11376.78 10116.00 12557.16 9274.31 10698.73 9937.81 24141.99 22515.32 25136.08 26473.58 30412.88 31277.49 29473.32 33390.70 33596.74 37706.68 37055.94 34713.74 8211.40 13358.35 11446.11 11112.77 10709.30 16232.57 12230.36 12736.12 12462.85 23595.66 26730.28 21719.80 19500.60 17564.41 19605.48 12909.45 13649.34 14317.55 14321.53 13766.64 13774.11 11512.94 10542.46 13292.57 23458.96 22575.76 26510.63 63327.59 55145.58 50291.64 104783.71 84905.87 92201.80 42531.07 53817.40 56055.89 10459.69 14020.31 10484.50 10059.25 9805.50 11034.54 13044.28 10710.68 11623.29 18036.17 24535.05 21051.16 13328.73 9308.79 11289.95 7069.62 10780.52 10067.73 13500.07 10771.34 12608.79 9675.43 11617.24 12006.42 24564.49 23801.70 25959.44 23670.45 22547.84 22408.85 115001.68 100614.35 83731.65 45309.01 38550.18 40246.77 D-Glyceraldehyde-3-phosphate 39804.54 78935.17 58580.64 19343.24 14884.35 18341.04 17698.68 14986.46 13362.84 21531.44 19210.95 14887.92 30804.33 22133.24 24964.72 20340.13 17749.44 16695.91 17657.29 18841.07 26826.70 25086.10 23447.47 29714.24 24522.35 23354.27 20007.74 21813.33 20650.86 23868.39 13616.00 16285.07 20905.19 22342.86 22911.12 17300.65 0.00 30858.24 12219.23 44983.61 56349.19 51679.50 40606.32 36140.63 36715.04 54823.11 68024.03 71778.43 42255.49 27774.31 33009.89 34804.02 39522.79 43653.64 31374.17 25965.71 26079.54 51935.46 61663.86 54995.87 75427.16 72713.12 83118.15 123017.35 118823.59 113617.87 36853.81 46201.43 48448.82 110370.16 104517.16 132703.05 8482.51 9072.74 7434.94 2523.97 1024.85 2116.32 14966.34 12659.95 9599.52 3951.93 9976.96 2558.39 1209.74 1110.25 1829.66 4839.01 6260.87 6238.19 1078.64 905.46 2121.72 14369.67 13405.51 12064.95 41520.01 46038.81 41876.77 71322.80 71332.72 75552.96 29941.49 30002.53 36187.88 147913.64 106524.35 100523.09 Deoxycarnitine 497826.00 590506.81 564365.75 498296.84 446764.00 457135.25 625528.81 665805.75 493003.22 443831.66 458786.78 508095.16 620525.25 618567.69 555145.50 1206400.88 1078311.12 1184248.88 1418794.00 1372986.62 1648690.12 1306579.88 1155515.62 980060.31 4546837.50 4283234.50 3807530.75 924647.75 767092.00 846370.25 510801.53 590492.81 648422.00 706823.25 741000.06 736762.50 7105.86 1047150.50 980581.44 517849.00 652305.38 722662.75 730021.44 709411.25 777123.00 673052.44 812473.31 868973.00 1042063.00 980140.75 1030265.25 2139333.75 2072917.12 2466346.00 1888135.88 1981343.88 2348984.00 2926200.75 3030849.75 3457134.25 9395981.00 9514676.00 11347004.00 3900301.00 3801255.75 4224940.50 2880280.75 2708853.00 3141886.75 2291949.75 2331947.25 2831902.25 1258963.88 1170396.38 1331211.62 963332.19 884356.00 1023299.81 2091652.12 2004175.88 2255327.25 865943.00 876690.69 1164304.50 877145.81 870314.81 1022208.75 1332558.12 1366466.88 1870453.12 1871264.38 2073898.00 1866289.38 4079000.00 3229303.25 3875392.75 12904699.00 11916460.00 14104521.00 5132271.50 4680927.50 4893773.50 3852480.75 3743673.75 4803599.50 4080783.00 3308800.25 4268064.50 Deoxycytidine 1474.49 3146.80 3919.53 1168.61 2438.91 1874.91 1307.17 2511.78 0.00 3731.40 5684.18 5319.59 2744.33 4415.35 1493.51 1288.22 0.00 1421.79 1150.37 0.00 0.00 1109.76 1402.42 0.00 4549.37 6299.98 6027.42 8206.80 8643.63 8395.77 8217.55 9545.20 7967.08 8720.40 8026.93 9750.49 0.00 0.00 0.00 1246.83 988.79 1058.48 0.00 1119.18 0.00 3728.74 6409.22 6120.99 2012.54 2274.03 2528.15 1055.78 0.00 1143.64 0.00 0.00 0.00 0.00 0.00 1576.88 3055.69 3655.59 7484.12 16709.30 13170.12 12709.49 23468.93 19859.73 23532.15 11849.69 12777.18 14458.68 0.00 0.00 0.00 0.00 0.00 0.00 1381.70 0.00 0.00 3328.44 5575.80 2033.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1257.40 1021.72 0.00 3387.15 2653.78 2635.72 3241.98 2631.14 4058.75 30307.77 26061.77 25996.31 10776.25 9484.96 10591.19 Diethanolamine 919205.00 792336.75 884994.31 1041078.06 862158.19 1341560.62 816529.56 1047270.69 921169.00 903853.19 767640.81 1159578.50 994062.94 1188892.12 980966.50 1408096.88 1196616.62 1341694.00 1092305.38 1126127.50 951236.81 933115.50 906939.31 814492.31 1234739.00 1083656.12 999714.31 1024840.69 1046570.44 1235000.12 965086.25 1897689.00 1037786.00 1490793.62 1245224.25 979688.19 93420.66 3458136.75 1466281.12 1227864.75 2185556.75 2301056.75 3060050.00 6031881.50 2586255.00 3016163.00 2033683.00 2456868.00 2439218.00 4143867.00 2651143.00 1141204.75 2278116.75 2107671.75 2855727.25 1992867.38 1483125.12 1726824.88 2182816.00 2451540.75 1725453.38 1494292.00 1928801.12 2195132.75 1299769.50 1907662.12 2068975.12 1898250.88 1214762.25 2083228.88 3116564.00 3092814.75 1169984.38 1104889.00 1044311.81 951781.06 1460525.38 979313.94 903270.00 1074418.38 1073500.75 1266882.38 1100709.75 1153565.62 2230982.00 1349685.12 1056303.50 1166770.62 1212364.62 874743.75 1323940.50 2013676.88 1115886.12 1115407.38 966444.25 927182.31 1075085.62 1167430.88 3456482.25 1407642.38 1582221.00 1057178.38 1053429.88 1024723.19 814729.69 2264028.25 1559103.62 1149433.12 Dihydroxyacetone phosphate 2727.66 5355.74 5570.89 1088.26 1322.48 2478.10 1751.78 1832.46 1019.23 2592.70 2556.29 1843.85 3590.41 3862.71 3320.38 1988.51 905.50 858.47 3972.54 5505.12 5819.70 1788.31 1608.07 829.54 912.38 824.88 1823.78 1700.67 946.38 1043.12 560.79 1072.73 1041.90 3079.97 2061.63 1857.38 0.00 2421.73 1052.68 2539.10 3133.07 2617.71 1884.67 3166.79 1099.02 4877.96 3755.65 5119.50 3573.34 2201.91 1463.52 1873.74 1724.49 1390.66 6973.61 5906.62 6433.03 2384.48 3799.62 1537.13 5013.64 4498.04 4950.24 6336.55 10381.99 10759.02 3728.57 6507.55 6561.30 6137.35 8145.22 7904.08 758.80 831.43 794.35 0.00 0.00 0.00 1718.67 956.44 1456.18 760.14 916.47 0.00 823.14 0.00 0.00 730.58 680.38 763.04 627.34 0.00 1627.43 670.34 953.11 1876.52 5772.47 6064.62 5983.86 11461.12 7152.78 11766.28 3099.43 5379.98 5980.99 16002.81 12344.22 13431.39 Dimethyl-arginine 79275.70 109442.01 88337.87 54636.96 44119.63 57321.17 59754.41 60024.72 51538.26 39096.96 37168.57 37960.25 55286.05 58767.89 56504.16 143759.52 130140.48 127867.71 174296.70 152434.08 184695.02 148921.56 163051.94 132407.62 282319.50 262258.47 250049.05 61249.18 53668.40 62843.34 41702.32 47724.20 54737.46 37180.35 42495.18 36608.93 0.00 254174.45 180452.58 88235.80 100703.62 112496.60 117561.48 101997.76 107781.28 101532.88 121136.27 105733.81 171154.14 170086.05 180183.25 308335.72 307153.16 327032.97 323946.97 293813.00 329345.41 281030.22 278775.41 257181.08 482580.66 511680.72 628491.94 658108.25 627107.00 694505.94 742976.75 694095.75 751879.19 346649.91 324011.84 432679.25 215173.17 212931.88 222370.38 178859.33 171466.58 165179.17 206201.75 194361.25 197116.36 132844.80 137809.03 146263.70 143736.50 136022.95 173079.95 181286.08 194350.64 234651.08 228708.98 249807.62 255468.42 225807.80 199758.23 235400.14 679718.19 642028.31 802757.19 917224.69 936154.81 925735.81 1677262.88 1691874.62 1709897.62 984769.00 677802.38 815090.50 FAD 12450.07 16333.96 9594.18 7272.53 4706.93 4426.29 5648.07 2449.50 2318.40 3655.57 3113.82 3569.86 7920.66 4071.32 3353.89 8011.63 11131.17 10637.14 7613.40 6965.45 11715.14 9012.39 6647.50 8421.38 4900.11 11865.20 7929.12 5609.58 4636.16 4831.70 2169.22 2682.76 6280.85 3232.04 5466.39 4023.20 0.00 26248.95 18815.15 6568.26 8548.09 9310.89 3508.25 5793.78 8120.80 10020.62 10431.70 4470.90 12392.03 15973.21 16838.40 17664.56 19001.50 17307.62 15047.84 14970.35 18252.37 15347.85 11583.80 14953.83 21908.89 16122.34 19937.80 16061.95 20731.61 17586.29 16516.94 17867.24 16228.32 16681.42 19155.71 10984.22 13389.78 19645.63 19415.11 11204.39 9176.05 11084.05 14960.14 13580.58 15705.25 12348.79 17426.34 15828.91 10971.51 5510.24 13776.30 4442.36 11667.35 4616.61 13961.63 11462.41 9994.79 14965.20 6694.27 4314.51 16196.11 19034.01 19082.84 11873.55 19654.99 19379.28 13770.54 20075.00 23174.88 25919.10 19606.41 22338.73 Folic acid 962.12 815.04 0.00 0.00 867.64 0.00 724.50 861.85 0.00 0.00 0.00 0.00 1320.02 886.01 728.96 0.00 990.22 0.00 1875.88 2123.56 0.00 0.00 2349.86 940.98 3919.73 1492.57 3474.33 935.58 3557.58 2851.66 900.06 0.00 0.00 791.32 0.00 958.51 0.00 2231.30 2007.63 1387.00 1005.93 0.00 1074.02 2163.47 826.79 1043.71 0.00 1232.34 1793.41 1375.07 1136.76 1100.17 2385.65 1541.08 1932.65 0.00 2563.73 1245.99 0.00 1126.92 3108.40 2722.14 2998.87 4348.02 2283.10 1321.58 2608.52 1152.79 1391.53 0.00 0.00 1000.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1073.93 984.17 0.00 0.00 0.00 1091.22 0.00 945.24 0.00 0.00 903.00 0.00 0.00 988.25 0.00 0.00 789.56 0.00 2925.28 0.00 4457.64 1576.51 1104.78 1807.61 1207.49 1190.85 2453.10 2159.35 1127.73 GDP 18599.39 32342.37 20849.76 20690.62 11398.76 18361.55 19045.19 17313.54 18146.17 17214.69 19366.63 13053.65 19493.56 21871.60 20129.86 23458.58 23837.56 22438.21 30554.65 33772.64 31862.46 25472.27 25035.24 29286.38 28557.88 25818.48 23845.51 15552.24 21239.69 20106.22 17798.07 18109.91 19996.45 17139.06 19136.96 21836.68 0.00 65572.34 45208.53 18514.44 23982.04 22988.20 18086.59 16960.44 18788.88 22293.17 27233.29 28385.44 27510.74 31607.91 25751.08 38424.22 44259.40 50079.04 36100.82 36432.29 38303.70 39637.68 33074.89 28572.90 48108.62 44763.93 46094.29 43786.35 55584.02 51291.87 43212.48 47857.27 53363.62 39281.75 49831.28 53802.86 43469.46 46634.58 38862.14 30789.81 35439.66 39081.93 36860.67 33387.31 31424.91 38650.21 45885.16 38320.39 31389.74 29230.14 33026.69 28944.66 33988.18 33833.89 29973.00 25003.71 30750.90 32706.04 34215.23 31576.05 41855.70 51193.77 56457.36 48702.03 44991.38 51948.47 49342.03 52858.07 54199.30 79537.18 45249.56 53615.89 GDP-Mannose 24422.11 32804.70 26151.56 20298.33 20045.14 22022.24 19919.18 15178.04 14854.11 17153.30 17040.66 13675.34 23779.32 25698.36 26019.15 29261.49 31510.35 27578.73 37478.18 37290.43 39552.92 31050.34 30287.80 30940.64 26311.42 26209.74 25975.37 15141.28 17103.44 13297.03 14506.61 11996.32 12085.01 12907.37 15789.60 15389.98 0.00 57756.70 37463.14 20164.71 28039.93 24812.12 24170.62 18639.77 18464.78 28841.45 30088.82 29961.52 49076.36 47796.22 46846.78 47392.89 49898.39 50871.20 53715.75 57140.87 53758.43 45305.27 46485.12 39419.68 38914.28 44083.64 42384.89 46019.56 53687.69 58347.92 42529.44 44818.97 51220.83 32649.52 38716.96 41735.64 29787.72 28942.55 26414.51 31821.70 25619.29 30411.40 37384.75 40655.93 36154.53 20739.04 33073.66 22236.90 15206.27 15027.65 15425.45 30880.82 30967.55 32694.21 34864.60 26348.38 36850.06 36880.28 36928.57 30956.87 35946.06 42412.87 35334.10 48062.62 55029.20 52618.93 47155.19 49949.42 45369.02 66552.91 52269.33 50770.89 GMP 8573.06 11049.32 10088.32 5629.16 6947.56 8272.62 6418.18 5921.55 5415.94 7202.67 7419.32 7062.13 9008.84 6991.69 7455.27 12063.09 10664.05 11542.83 8958.51 11799.60 11397.28 12108.04 12116.47 12622.03 8988.90 7646.03 8910.59 4899.07 5294.87 5548.52 5566.37 7034.00 6518.73 5299.96 6991.93 7428.77 0.00 65453.16 53486.59 7825.81 9026.00 9633.34 7374.62 9347.67 8224.26 12955.48 14853.33 17211.37 15406.98 16672.17 14343.88 19426.96 22664.84 18064.58 16236.35 15293.75 18063.65 15170.24 19823.44 17783.52 12253.84 12565.39 14433.65 7877.23 9473.40 8571.38 9867.87 10479.49 11431.60 13079.69 13298.23 14641.05 65275.04 68600.89 66612.27 27067.20 34806.61 39055.43 16350.81 20764.14 19983.93 43470.17 40615.96 49051.80 58210.19 56491.36 56970.84 21075.48 25060.42 20999.47 26314.08 24571.11 25081.01 19437.53 21870.62 20983.43 12174.96 18499.73 19990.06 7859.64 7224.16 7497.32 9664.76 13514.57 14267.56 16278.02 14202.63 16468.21 GTP 39833.54 71694.85 43683.03 33089.54 20752.75 30924.94 35315.20 34678.79 28770.63 38283.31 35492.81 25198.08 44284.38 48025.03 48149.75 38258.41 57237.92 35396.54 46403.66 52252.31 56219.95 47415.14 56981.94 62773.70 74557.71 68092.50 67409.90 34943.81 57786.00 56263.82 44382.98 45375.38 55752.00 40731.80 48764.94 57402.04 6987.65 56922.04 44401.83 37203.31 36192.52 29290.70 34563.12 28137.02 24654.18 37570.12 34203.36 43270.79 37057.00 38240.96 25948.66 46785.28 52028.54 60894.09 44943.14 43428.15 47285.95 51745.65 39059.37 38422.95 87708.21 69415.49 39002.14 97620.09 144760.95 116439.16 76105.86 103305.70 119976.97 78698.49 91512.65 116457.84 31780.34 49554.20 37068.64 32719.70 24876.41 26436.26 43724.23 37559.25 36978.98 35431.86 45843.50 37004.41 18303.54 16637.16 15282.86 24874.40 32803.35 37386.64 24477.00 23491.51 20024.92 37722.03 37895.28 34464.46 90918.66 83752.48 88377.29 137308.22 125789.35 169517.17 145125.88 169411.48 150299.80 351904.75 167007.83 191139.98 Glucose 6-phosphate 27494.54 39008.20 26259.03 52897.87 46952.09 36390.67 50395.36 44222.05 43569.72 41755.33 45371.43 33484.07 33488.82 32202.03 39312.59 61299.51 61724.22 57177.86 82219.12 78834.93 78946.66 80569.46 80421.57 101151.52 51747.48 49945.89 47689.31 47270.81 48970.28 51449.14 47158.86 52167.80 55008.61 78416.89 85677.62 75671.05 0.00 57459.54 32786.94 44783.30 51967.88 39051.45 54953.02 47717.86 42240.89 88375.15 84977.46 85558.84 148860.80 148287.98 132727.31 145303.45 143944.80 152026.70 110728.15 95483.13 93147.65 125770.90 121983.12 117113.65 92533.45 93952.12 105545.16 202963.12 148587.44 125086.59 205558.38 203280.19 187410.25 137131.00 149918.55 170759.31 24497.31 26848.51 25722.33 64369.19 61525.98 64334.08 69601.34 72460.40 62897.54 22592.70 29050.47 27658.17 38678.79 39427.64 45195.80 81174.54 80906.87 97618.31 55245.86 44938.21 62748.47 79370.60 75102.57 73963.20 95524.59 100603.81 104591.35 176648.31 148932.56 140283.02 342602.00 258778.31 232619.12 172199.94 105108.13 88529.26 Glutamate 16777966.00 23218720.00 20047682.00 14973185.00 14674896.00 15618636.00 16862044.00 19306726.00 15761944.00 15124577.00 14984819.00 16104248.00 17577188.00 15829429.00 15708775.00 21216678.00 20444168.00 20948110.00 19773942.00 19261814.00 21735648.00 27092904.00 28672224.00 25911142.00 15231384.00 14587293.00 14088488.00 25962160.00 25073338.00 25515954.00 16592467.00 19473086.00 19514166.00 22825062.00 22497704.00 22119602.00 11756.89 26129066.00 21368246.00 12007697.00 15170184.00 16123080.00 16296732.00 16871102.00 16930390.00 14006396.00 14354072.00 15821043.00 16276265.00 15359819.00 14832347.00 16843332.00 17381994.00 18744676.00 14708005.00 15416415.00 17954078.00 25390522.00 27159186.00 27447144.00 11772669.00 11285063.00 13572823.00 13315469.00 12535867.00 10583206.00 15398397.00 16485600.00 17147030.00 8893455.00 11291956.00 10512496.00 15246416.00 14904849.00 15287404.00 12803080.00 13593373.00 13188979.00 14319480.00 13326028.00 14665760.00 12678229.00 14340611.00 15263483.00 12589536.00 11312072.00 14218017.00 12251701.00 11862395.00 13599140.00 18007344.00 18833544.00 17877878.00 15842732.00 15046668.00 15682117.00 8043245.50 9029617.00 9904664.00 5116271.00 5026138.00 5449028.50 13631811.00 14419927.00 14942513.00 5565628.50 4496482.00 4936130.00 Glutamine 5939542.50 7640266.00 6599094.00 8428897.00 7921339.50 8798958.00 8960892.00 9824996.00 9208175.00 5804526.00 6969914.00 6321696.00 8033685.50 8110770.50 8102392.00 13003957.00 12648784.00 12922117.00 11437819.00 10686515.00 10993917.00 12497348.00 13265345.00 12865728.00 1731456.50 2162595.75 2394871.25 6386076.50 6230799.50 5565528.00 7167408.00 6838447.50 6810552.00 6939534.50 5505464.50 6708377.50 13156.55 9169898.00 6986723.50 7661006.50 9772759.00 11154987.00 10972873.00 10267695.00 11157647.00 6267746.50 6906710.00 8212072.00 12571243.00 13591563.00 13337153.00 11408337.00 11434108.00 12474765.00 12981157.00 12478196.00 14078723.00 5953006.50 5949667.50 5854738.50 1666647.50 1596486.38 1263308.88 739606.69 611828.56 524788.19 552628.94 570010.56 576591.06 1156994.62 1332904.12 1191058.12 2602292.25 2145681.25 2375523.25 6309094.50 5784752.00 6455571.50 6158021.50 4856975.50 5270018.50 3418117.00 4196467.50 3811410.00 5400527.00 4961403.00 5559732.50 5236707.50 4257109.00 5644168.50 7367386.50 8749060.00 8173532.50 1127719.12 890566.19 924853.81 1006500.25 982958.94 1062720.12 284229.03 257569.19 326329.09 1438931.38 1319112.88 1341010.88 863724.81 719761.25 769924.75 Glutaryl-carnitine 1507.13 1832.58 1465.06 1474.71 1360.62 1342.59 1021.69 2520.09 0.00 1249.48 1170.44 1536.90 1139.89 1476.75 1219.51 2912.63 2457.97 2840.05 2900.18 2830.70 2979.50 5119.65 1690.38 1695.79 1908.63 2612.13 3330.41 1610.96 0.00 1054.37 1090.90 1440.51 0.00 1236.70 1250.46 0.00 1524.47 6572.96 1776.33 3683.28 1595.58 2052.57 3178.37 1972.91 1686.33 4088.98 2147.46 4566.13 3110.69 4415.61 2326.78 3017.79 6404.15 7048.65 7734.54 7479.03 5910.74 4076.56 4614.65 1913.20 4049.29 6536.28 6783.15 4903.06 2410.96 2794.80 5538.32 2087.82 1534.53 0.00 2194.35 2196.23 2519.34 2207.24 3481.18 2284.50 1691.94 3446.34 2693.01 2905.11 6214.10 2111.78 2330.63 3919.66 4984.63 1715.92 4108.94 3696.70 3114.64 3918.02 2480.37 1957.69 7056.82 3365.55 2812.15 3286.67 3377.77 4255.76 4694.17 4310.66 4129.72 5849.36 4305.13 2477.52 2422.24 2412.58 1542.61 2336.46 Glutathione 13538679.00 19710388.00 15462316.00 9464169.00 9862717.00 11023307.00 3971761.25 4041209.75 3240138.75 10723403.00 13262553.00 10595851.00 18829922.00 16864966.00 17492044.00 12638272.00 9976784.00 10849471.00 7643207.50 8306310.00 8846423.00 10210557.00 10682983.00 9153577.00 9500444.00 10199871.00 9240199.00 9432089.00 9070396.00 9754026.00 6558645.50 7221492.50 7479077.50 6157816.00 6200633.50 5870267.50 5254.70 24643856.00 17476730.00 8497836.00 10898732.00 12106163.00 4249008.50 4314381.50 4422638.50 13783595.00 15354304.00 17258742.00 22826056.00 20296532.00 21366108.00 13241819.00 13753040.00 15059613.00 8311390.50 8715407.00 10187289.00 12489985.00 14617423.00 13391083.00 12691877.00 13059384.00 5272365.50 15904769.00 15520737.00 12554576.00 28002422.00 31404568.00 30949280.00 21383120.00 25822778.00 26652192.00 11681119.00 11719868.00 10517041.00 10000787.00 10672812.00 12082460.00 7484779.50 7320955.50 8404524.00 12870016.00 16213184.00 14606763.00 11134072.00 11030713.00 12176635.00 8018123.50 8690155.00 9113143.00 9465411.00 9146038.00 9326924.00 9009250.00 9180097.00 9301689.00 11484621.00 12767021.00 13578016.00 6136625.50 5791805.50 6054831.50 26269792.00 22844576.00 24571168.00 20146414.00 15775085.00 15985513.00 Glycerol 3-phosphate 386676.34 551797.06 393884.62 82839.79 61064.59 78495.63 88348.00 72114.81 68081.99 125774.75 155112.73 116296.00 144810.62 143305.42 129955.85 96331.15 100805.63 78884.74 115738.19 128353.13 126445.46 102643.69 98235.10 99256.16 29147.48 25961.98 24475.19 25665.82 29136.48 33150.02 46757.86 56418.09 55320.74 52988.30 56766.49 48783.69 0.00 637848.69 370244.41 96154.16 146345.05 145443.53 117877.81 116251.77 102163.87 290861.38 294454.88 307899.84 367741.66 317730.22 319833.28 210115.33 210159.42 223295.88 303650.78 299283.28 319173.47 146701.31 155205.94 145352.14 91974.59 90825.12 87785.85 425148.91 464110.75 580856.38 385618.47 422338.91 436502.09 276896.59 257127.31 346934.25 243670.27 234639.38 220011.55 91240.09 113066.21 111792.15 280743.38 239218.06 233676.08 143484.80 211598.83 150964.48 54179.50 53259.76 59396.56 104846.34 106270.84 117424.03 61235.21 58755.30 62161.01 122422.21 110368.59 114395.44 89083.00 84595.54 82218.76 658059.44 584166.81 584519.00 343390.97 284955.16 319298.88 683544.31 394345.28 447538.53 Guanidineacetic acid 0.00 0.00 0.00 0.00 0.00 0.00 103164.16 80177.49 66595.21 0.00 0.00 0.00 68597.04 66031.66 39493.56 158778.30 158075.03 151187.05 0.00 0.00 0.00 71848.15 103163.66 62760.80 1980532.38 1946725.00 1694917.12 0.00 0.00 0.00 204878.20 242292.00 252061.25 68459.98 66617.23 71445.88 0.00 0.00 0.00 0.00 0.00 0.00 133061.11 103144.18 107568.93 0.00 0.00 0.00 136496.25 132177.80 135093.61 188084.88 211542.17 265682.47 0.00 0.00 0.00 85427.41 128350.94 116358.47 2434643.25 2401268.00 2935271.75 0.00 0.00 0.00 1646309.00 1691055.38 1866031.62 221220.92 189707.70 307089.47 0.00 0.00 0.00 0.00 0.00 0.00 236825.98 174846.12 289027.59 0.00 0.00 0.00 100173.16 96158.21 130485.40 139618.64 145547.42 175793.58 8551.98 5199.26 0.00 103002.06 85921.28 94481.53 1766354.50 1657426.00 2148445.50 0.00 0.00 0.00 1674435.50 1589181.62 1986843.00 277044.53 249645.95 302967.66 Guanine 7169.57 8799.82 6814.09 3600.47 6459.35 5193.39 5402.17 7626.87 4709.71 5996.63 3222.08 2463.55 3680.27 5349.83 7157.31 4417.34 4599.39 7312.78 5702.90 3741.38 6237.63 5033.18 4811.28 5903.64 4177.97 5066.02 4902.70 1768.94 4680.59 5671.56 6040.34 11405.31 5005.97 4966.05 5766.75 4486.79 1563.00 18010.50 19069.69 12393.72 13972.93 17351.07 3297.06 9281.19 3441.47 8509.70 14231.22 5751.49 12399.35 8916.29 15049.72 21021.48 25004.05 20585.13 30196.25 14941.39 12628.38 8121.94 18342.40 8951.06 17393.29 13287.42 38171.31 12803.89 10462.79 9030.69 5648.77 5295.20 8771.95 30568.38 18208.03 16056.79 3711.53 12217.01 6976.46 9311.71 10942.85 13047.97 20489.18 14586.93 23541.68 8288.53 11239.13 9912.25 13299.91 10553.11 12830.50 14217.60 15853.28 12891.70 16474.61 15357.25 16049.41 9754.67 9344.60 10957.52 12910.01 13977.78 13404.08 10398.36 10232.64 8390.19 14198.73 21296.78 15275.02 18848.82 7946.68 7567.97 Guanosine 32231.59 28657.66 26704.39 24962.89 26761.03 27800.04 25526.65 26035.21 26270.26 29254.78 28640.72 25526.48 27793.84 25633.77 26724.43 30060.13 30928.41 32080.37 29648.04 27405.99 32080.94 26174.65 27982.57 24739.50 28675.23 31621.01 29551.61 26822.91 26345.21 28024.42 24559.78 27509.26 27437.97 28726.40 26672.15 24258.00 0.00 47668.82 21020.78 34807.93 34650.20 34212.91 31958.65 34947.85 34685.07 46122.18 40927.19 38650.04 40536.05 38846.53 31116.42 39204.56 37209.83 41149.23 34808.77 34832.90 47583.71 36795.18 42082.65 41348.46 47600.14 40080.57 45918.23 44566.75 36883.28 39980.62 35100.88 36559.03 31800.93 39130.46 36023.97 38094.68 38661.86 43892.75 41976.24 37151.28 34841.44 36946.21 35566.79 37254.96 36319.21 40470.64 30386.80 31880.08 37517.36 31624.94 35060.02 36282.28 41037.05 37434.64 39053.55 42586.88 34995.44 38108.29 34232.75 36909.58 59211.88 47224.49 42994.42 43383.99 39540.96 34964.88 40915.48 43100.39 39696.00 37570.19 37776.36 43895.16 Hippuric acid 2465.70 3581.31 2473.10 2345.70 2427.94 1943.31 4340.02 2517.22 2242.31 2314.38 1911.18 2014.11 2667.24 2314.03 2212.13 2336.00 2431.77 2485.70 2167.01 2348.43 1970.77 0.00 2299.08 2226.95 1812.56 2826.42 1737.67 1773.12 2386.14 2171.44 2256.17 0.00 1909.19 2223.46 2455.42 4492.41 2373.04 2466.51 2277.95 2257.16 2480.95 2317.50 6377.54 2103.96 2319.61 3992.57 2029.26 2396.60 2550.14 2320.27 2921.61 4541.87 4864.28 4417.80 2312.69 2521.99 2138.67 2215.63 1820.53 2088.02 2322.34 1840.98 3217.19 2646.63 2369.09 2736.57 3979.80 2209.30 2637.64 2107.63 2375.03 2423.77 2517.58 2728.17 2337.16 2790.51 2751.28 2302.70 2601.12 2563.55 2900.30 2615.72 2573.40 2425.68 2607.98 2741.60 2840.95 4680.86 2843.15 1938.33 4366.32 3285.82 2650.47 2959.92 2472.89 2250.31 4789.96 3092.00 2362.85 2906.71 2613.98 4303.82 2455.99 4778.63 2849.96 2806.00 3629.80 2428.19 Histidine 966688.56 1435063.00 1056107.62 668873.19 506792.72 797773.69 573657.19 675193.56 540401.31 399173.50 495081.00 379836.66 824106.75 900363.25 961691.25 1790332.62 1501745.88 1255505.00 1044805.69 956209.75 1168710.00 1424431.00 1750866.62 1367192.62 638585.69 703039.50 694256.06 519223.25 536948.38 555802.88 469769.75 517144.84 585293.00 608117.94 536923.25 470381.12 8545.93 2481416.00 1620851.00 536916.31 822310.31 598626.56 590957.31 407176.25 458579.75 420618.59 303811.09 725385.50 830299.69 1278119.12 855264.00 1281640.62 1262280.12 2154937.75 579691.31 742512.94 1096589.62 1330835.00 784022.44 1277694.38 651750.06 446373.75 364287.47 4654248.00 4697667.50 4213196.00 2689850.25 5677002.50 6420853.50 1065575.50 2151101.25 3461198.75 1817983.62 1966054.62 1913350.62 1617552.62 1242255.00 1590570.50 1445990.50 1462104.62 1682344.12 883985.50 1184651.00 984339.50 1487949.38 1298556.00 1937964.62 996683.56 1354984.12 1418392.12 1709280.12 1350227.12 1582600.62 1007128.94 1343283.88 1072041.75 2200267.25 2364764.25 3296057.25 4367838.00 4031865.00 4037989.00 11689553.00 9964333.00 11086976.00 8981931.00 5042533.00 6785196.00 Homocysteic acid 2789.97 2571.37 1669.33 2718.31 1911.10 3114.74 1833.47 1647.23 2023.50 2740.24 1587.83 2492.35 1492.87 2375.42 1491.75 2488.72 2572.42 4248.20 2203.45 1816.64 2484.88 1758.33 1633.58 1547.06 2296.21 1812.04 1464.45 2500.66 1661.13 1996.70 3734.56 1840.16 2006.27 1747.36 2317.35 2728.45 4545.57 2773.38 1633.03 3934.30 1705.92 3078.78 2997.89 2011.92 2040.31 3146.02 3115.39 3530.83 2861.09 2210.23 4594.01 2281.29 1844.76 2514.42 3057.54 1715.77 4531.54 2087.33 2377.32 2097.40 1653.50 4581.85 2307.74 3117.72 1995.41 1797.75 1787.21 4427.74 1939.06 1696.40 4253.43 2473.60 3210.16 3684.98 4039.26 2497.89 4033.66 4380.05 6142.32 2813.86 5033.36 3872.37 2212.42 5653.63 3003.42 4200.84 1801.76 3102.71 2857.75 3082.79 5036.65 2580.70 2614.68 2865.94 2368.48 2591.58 4320.62 2120.50 2478.58 3016.66 2333.90 2262.64 3226.13 2249.50 2603.55 3191.28 2945.57 2989.93 Homocystine 11165.99 10394.46 7103.99 8723.33 8060.37 11052.62 11254.48 11607.02 10483.25 11404.06 8008.50 9279.80 12103.08 9882.96 11333.54 10088.99 10546.51 11780.74 12025.38 10145.33 10822.83 13154.78 13770.32 13557.70 9330.68 8672.54 9902.90 13361.41 12442.32 12883.34 11533.07 13129.19 9593.08 14172.96 12361.43 13213.64 0.00 10668.78 11227.67 5003.70 5049.62 9913.13 7697.43 7948.93 8203.75 4627.40 7037.30 3037.32 8477.12 6813.84 9597.24 6791.64 8425.42 12161.80 7497.37 7974.00 10946.19 8753.07 12794.39 13820.37 5115.75 2692.42 6642.36 4720.20 6419.51 4066.10 8562.07 10292.57 9794.96 3666.86 5590.21 2491.50 11366.95 10764.62 9586.12 7740.31 11626.30 10266.50 14482.90 9611.64 11254.96 8870.22 11708.73 10623.95 9632.10 9118.03 11026.73 7429.95 7939.52 5561.41 12017.50 12876.73 10640.04 10098.70 8452.93 9516.24 6397.27 7476.08 9431.22 2673.86 4587.68 5119.45 5640.67 8018.54 8282.08 5180.17 3906.80 3203.48 Hypotaurine 85804.97 109799.88 81127.48 59560.89 36970.82 70433.07 17951.95 37397.96 22670.65 104624.56 108519.38 121623.62 154102.62 147040.00 132433.33 83515.38 57601.55 83684.62 83881.92 117023.12 109625.59 23420.16 29626.97 49557.56 128155.78 155214.33 143495.45 132609.52 114588.91 131150.23 64750.49 64851.72 109702.65 150887.12 131773.53 164911.28 0.00 125481.09 121415.71 29034.27 31107.34 31630.69 29800.76 27246.34 26482.46 99684.38 148018.83 143494.72 165330.64 152451.55 149483.78 48061.50 76386.34 30084.51 108466.52 125989.54 109347.66 15566.96 31210.19 44949.42 128063.27 138134.62 141920.14 126338.23 118997.12 162762.61 155433.44 171044.00 111008.56 111913.16 146924.56 164766.28 72100.14 46924.03 94606.75 25075.56 60063.76 37429.45 23117.72 8082.79 26390.94 38973.98 121305.43 92918.41 111877.34 145163.92 147930.47 18294.54 15784.21 25543.25 122319.68 86582.41 81798.64 0.00 23085.92 9620.26 102952.62 48329.68 72466.57 87267.38 44061.56 128761.95 103198.12 82339.68 140926.61 93365.82 69852.91 127572.29 Hypoxanthine 7573.22 12955.91 5364.78 10821.18 9072.79 11284.33 18010.07 24858.87 25840.03 7043.41 7525.57 7375.25 7962.55 8169.23 9371.56 22333.69 16529.52 18823.94 17203.17 14852.04 17172.01 12271.82 9721.15 10400.80 20116.68 23044.42 22527.63 10117.38 8062.79 8845.25 6387.60 7706.27 7396.17 4730.73 5821.76 6765.18 1236.13 67242.27 130725.75 24466.43 13390.20 12812.51 16391.46 18839.28 21554.36 20433.58 13297.71 11737.00 63374.17 96968.09 77486.91 70847.21 48832.22 53040.20 78466.09 91979.78 87656.76 41277.19 37980.49 39965.07 40275.03 31552.70 31564.94 19794.22 23001.52 24786.45 15129.90 12739.10 16303.01 27772.23 18130.64 13045.80 117224.20 126164.77 113777.95 183025.31 244338.05 261141.88 224527.14 241767.83 277002.75 115182.65 85326.97 109291.47 358094.59 361015.09 376121.75 176613.77 195091.92 219814.64 267820.81 267698.34 312490.22 91328.12 79363.16 91844.91 25970.80 48514.64 257946.55 23978.01 64505.71 44960.08 81338.18 148808.80 85769.74 23190.57 21371.56 23818.46 IMP 4822.79 4788.36 2663.86 2827.34 2852.76 4656.38 2382.35 3784.23 1186.73 5674.42 4726.56 1438.89 3971.06 1383.13 2561.57 3875.59 4422.15 4036.60 12250.60 12495.25 15565.70 5386.58 4450.11 6949.43 3752.36 3651.40 3782.82 5156.29 8457.79 8095.27 5036.52 7665.09 7121.55 5504.11 6809.02 7385.23 0.00 18952.16 11926.86 3393.56 1323.88 1799.36 2799.82 2336.13 1752.43 4638.91 6294.83 2052.39 4263.37 3606.55 3294.36 8095.72 9572.56 8876.17 14510.22 13630.48 15760.28 8726.81 8004.59 9475.27 9531.06 7918.58 7664.42 13184.84 12437.90 9982.07 8933.05 10334.96 10016.74 21311.73 25999.23 26196.99 10635.67 11124.78 8655.97 2893.16 3719.44 4576.83 8180.97 9415.05 9435.38 5738.99 8876.16 6333.50 5974.43 7875.94 6147.14 6211.74 8597.34 10633.99 8679.28 9716.61 8195.51 8434.62 9042.10 7994.13 6747.98 6533.40 4482.46 5934.27 7072.20 6243.77 1415.89 1055.90 1222.54 35568.55 21142.29 23973.33 ITP 6022.47 6499.77 5820.32 3255.18 7385.81 8941.74 5199.09 5259.73 3282.82 8094.35 7000.95 5188.47 9213.50 6918.49 6482.37 7118.17 5392.85 6563.30 5114.74 6767.49 5527.73 4644.29 7238.22 5512.20 7597.42 5934.77 8330.97 3324.78 8205.75 5551.00 4657.17 5689.07 4979.39 6591.62 9725.43 8770.05 7228.38 6612.81 9680.22 8018.01 6269.07 7363.15 7884.61 6294.70 8626.18 8317.04 4941.57 5303.19 8149.74 7977.31 5916.13 8395.73 6603.11 7958.99 5096.13 3203.33 7306.03 11153.34 6303.22 6641.41 7033.45 6743.33 5192.06 6868.89 8708.16 6419.93 4860.32 7514.62 7014.86 5360.01 6608.98 7632.15 6502.59 7694.28 9069.75 8641.91 8251.17 9429.17 6897.82 5703.57 9636.27 11385.93 10440.76 8753.96 10419.26 9749.33 9857.90 10587.21 9036.57 6401.52 14088.28 11106.10 12289.08 7433.34 8340.85 8263.05 8274.59 9650.23 9396.70 7164.80 5335.38 6138.98 9787.15 6974.42 9241.83 7340.56 5800.15 4890.51 Isoleucine 4704148.50 5793610.00 4808559.50 3835582.00 3225002.75 3887749.25 4003748.75 4216538.00 3722625.75 2279767.75 2442432.50 2444045.75 4098200.75 4090622.75 4047883.75 7737973.50 6990884.50 6924250.50 5064964.50 4841430.50 5419573.00 7691350.00 7906900.50 6846045.50 3022936.75 3111484.75 3162705.25 2535733.75 2585457.00 2728616.75 2096737.88 2282874.00 2432693.75 2957389.25 2895727.25 2787967.00 10705.41 13473273.00 11456259.00 4868053.50 5993642.50 6823841.50 6759253.50 6054713.50 6396802.00 4840397.50 5322548.50 5884812.00 11206555.00 11736803.00 12160931.00 12330568.00 12111396.00 13278784.00 10283665.00 9385711.00 11018398.00 9890201.00 9917044.00 10150841.00 4849753.50 5307495.50 6969285.50 21629940.00 19342752.00 19040896.00 15994636.00 15710811.00 16357371.00 15051839.00 12942041.00 18573702.00 11363605.00 10793452.00 11814844.00 10298512.00 10329132.00 11321087.00 10513968.00 9687946.00 11045991.00 5767153.50 5825432.00 6446337.50 9265052.00 9437914.00 10392757.00 8739610.00 8302683.50 10060775.00 9170872.00 9964943.00 9121717.00 6830774.00 6455084.50 7322845.50 8015391.50 8223988.00 9030137.00 6832408.00 4903093.50 5272206.00 5225498.00 4552252.50 5369113.00 17967342.00 12536015.00 13974439.00 Kynurenine 10236.47 12554.18 9717.74 5131.42 7279.80 7585.55 8239.13 9727.17 7938.79 4241.32 4631.16 2309.00 8857.18 5605.95 7728.76 14480.37 12268.32 13790.15 13231.06 10878.21 9110.06 13241.89 14523.39 13018.07 9617.50 6932.62 8811.80 7106.71 5179.06 5556.75 7188.18 7483.35 6262.46 10162.30 8762.00 5848.33 0.00 23522.74 18169.24 10055.77 14707.91 12592.80 9877.56 13900.71 10925.73 8755.62 9674.54 9398.03 24542.41 17774.72 22031.53 24472.99 19693.96 25733.88 17999.89 15226.89 19169.05 19924.80 16859.47 18527.54 11624.90 14961.15 19580.56 83918.62 86324.12 90175.90 85474.70 79816.03 93170.29 52191.76 44648.27 58760.48 23720.48 26918.50 21878.07 19445.21 19316.67 24375.78 17220.90 17596.66 19793.42 12947.73 11402.79 11495.75 19943.84 18489.88 23458.71 17377.53 17570.14 19889.85 19374.98 18140.77 20257.83 15153.74 16013.74 15299.66 32167.20 36234.33 50249.31 102403.12 101154.84 107928.06 141756.33 128528.88 159135.61 141486.94 91540.71 109336.03 Lactose 4783.78 5765.49 3729.28 9787.16 6889.18 9571.13 5968.94 6163.86 6515.23 5379.31 6338.17 6249.43 10052.36 5833.13 6135.40 20345.54 19168.89 17399.27 14094.33 15321.43 13582.88 14390.85 12772.37 15305.42 7591.44 7331.13 5979.76 0.00 0.00 0.00 0.00 1650.78 0.00 8436.71 7694.83 7331.82 0.00 5570.15 7125.39 4020.88 1985.40 2631.31 1516.52 0.00 1248.41 4127.80 2516.60 1953.72 9402.11 9026.42 8329.16 19212.31 12617.04 14522.09 10848.49 11139.32 8672.90 8162.35 8696.80 8737.93 1958.46 3497.72 1468.34 0.00 0.00 0.00 0.00 0.00 0.00 2435.86 2751.56 3336.61 7900.74 1739.24 3284.63 3566.57 4177.06 3446.24 6339.93 2379.95 3461.85 1595.14 3151.99 1624.13 3956.53 1785.43 2510.49 1580.35 1344.09 1558.22 1645.49 4050.47 1949.32 1815.61 1788.66 1903.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 Lauroyl-carnitine 1491.15 2856.11 2361.45 5193.44 1568.97 1934.89 4941.46 3079.23 1944.30 2412.32 1770.65 2212.11 1545.76 1468.36 3571.41 2203.19 3859.98 2277.16 7086.39 1743.43 2661.59 2509.03 4263.83 2691.24 4325.24 2763.14 7536.93 4097.59 2116.95 1859.61 2432.10 8264.49 5353.81 1652.81 6206.17 3636.15 1831.43 7172.97 6075.61 2205.38 3576.51 2598.47 8647.57 10094.98 7316.58 1995.00 6498.00 2936.87 5780.56 5301.08 2699.66 2491.39 8306.90 4822.68 5055.48 6528.35 5832.43 10112.21 3789.69 3255.87 9227.89 11039.43 11900.29 5776.32 5726.26 2648.06 13436.13 13517.48 11827.07 5144.19 4511.92 12173.21 10111.33 3843.27 9950.07 12607.56 9658.50 11652.27 5954.75 2855.78 9300.42 6971.47 10023.33 7924.19 9787.82 6919.47 12551.98 5541.91 2107.77 8713.42 5482.25 11063.81 16023.47 7520.40 8477.23 6616.60 6614.87 12440.81 14511.71 7280.19 3036.78 2919.57 33456.27 27676.86 26944.72 12205.31 6581.11 9800.38 Leucine 2701068.75 3609520.75 2553511.25 2280107.25 1699490.50 2133108.25 2186301.75 2350245.50 2034923.88 1297685.62 1321271.88 1305341.38 2146243.75 2468175.25 2247772.00 4364431.50 3900596.25 3763808.75 2883058.00 2732842.00 3080222.00 4165860.75 4215580.00 3824012.00 1518712.00 1534276.62 1596962.38 1339103.88 1239832.00 1273581.88 1056638.62 1157619.38 1182764.25 1413591.88 1436937.00 1378751.38 23972.62 8425476.00 6600744.00 3000162.00 3661844.75 4115819.00 3934685.25 3302003.25 3763830.25 2934651.25 3087139.25 3309117.00 6683693.50 6761589.50 7190830.00 6764418.00 7075240.00 7851120.50 5755940.00 5344524.50 6543362.00 5565700.00 5384141.50 5530194.50 2418496.75 2481508.75 3500552.00 8508181.00 8075498.50 8302214.00 6403614.00 6671683.50 6635836.50 6416657.50 5383013.50 7284472.00 7047442.50 7197467.50 7341729.50 6414334.00 6402876.50 6658065.50 7138496.50 6026938.50 7185676.00 3664241.75 3685455.25 4066036.00 5881064.00 5369689.50 6463950.00 5443925.50 5275797.50 6362233.50 5440158.00 5607308.00 5316935.50 4120296.25 3637605.00 4308702.00 4334068.00 4172406.25 4965778.50 3963466.00 2825068.00 2952323.75 2282483.00 2065993.88 2448568.00 9714412.00 6150518.50 7117962.50 Lysine 177104.77 178865.23 142156.20 156910.67 129268.74 149558.38 186360.75 202833.88 192407.36 81901.59 90256.27 79428.49 130963.34 114466.25 131570.89 361900.09 323540.66 318110.75 367057.59 317367.16 349447.81 281609.38 319745.38 317625.41 156504.44 184561.64 190386.95 81630.66 99715.55 102211.76 66108.34 58544.84 61722.91 51965.84 46992.30 48828.44 10509.44 316012.72 266592.47 168217.58 209764.69 224400.31 270062.34 244143.45 260647.50 158328.20 179601.64 160736.19 289949.38 283955.59 294290.84 577742.06 565141.31 592644.19 486136.59 477996.16 500336.00 440455.62 427180.41 454104.41 164508.41 156644.05 146013.14 35960.27 35371.06 30878.63 33251.77 35392.41 36854.19 37297.39 47403.61 40724.47 303825.16 307755.47 289767.81 297033.16 272841.22 277929.34 443932.12 412698.91 425094.66 185672.80 184847.02 167239.11 236451.38 224168.73 240931.80 298930.72 317861.12 345961.34 352669.72 337475.81 349867.75 328430.06 293410.59 342109.12 142640.77 143002.25 222967.52 32158.57 30107.85 34225.06 37702.04 41398.80 40985.61 47552.93 41200.28 44609.91 Methionine 975915.06 1154981.38 1011908.81 784748.50 662083.25 806886.81 828640.75 890104.19 769774.75 504700.00 532493.31 503469.72 845069.81 895058.06 797017.69 1527016.00 1386091.88 1319773.62 1002161.00 969015.06 1028051.44 1329195.88 1410124.12 1258024.62 466186.62 454574.72 474671.66 510177.38 499014.62 487377.97 463049.50 453658.91 473564.72 631350.94 560218.81 556694.06 0.00 2644699.00 2224076.25 948632.56 1124455.38 1254371.00 1300709.00 1195851.12 1282656.50 906515.56 985786.31 1076631.12 2144294.25 2222529.75 2152812.00 2019583.88 2009670.38 2292902.25 1722807.88 1683808.62 1923969.50 1603777.88 1740118.50 1652968.38 521541.12 477820.47 664263.62 1909705.62 1719852.62 1926088.00 1696222.00 1493252.88 1611671.00 1247601.00 1155278.00 1476007.12 2148733.00 2178500.25 2267410.75 1809203.00 1776268.38 2020865.12 1926096.62 1768879.38 2112822.25 1037276.00 1092957.38 1188852.38 1771658.00 1683865.62 1989220.38 1536243.62 1529465.88 1797321.12 1676542.00 1688858.00 1670424.00 1156057.38 1095304.00 1252479.12 794472.19 816608.06 907933.50 1546957.00 1407833.50 1562846.00 1050313.50 923126.31 1186469.00 2471919.25 1655859.62 2067499.62 Methylnicotinamide 349883.97 499331.84 357791.75 28389.23 25876.13 28346.32 37851.02 42190.54 35414.72 49164.87 45816.87 49876.11 333662.16 322145.91 293254.34 166513.58 137613.64 128907.46 38666.96 36340.53 46883.61 67459.89 66407.49 52253.08 515862.59 543752.19 487577.66 63070.18 64288.88 58981.95 17762.97 17877.78 21553.72 51955.22 67182.79 56381.51 6461.93 2098626.25 1694785.88 52917.15 80290.93 84659.14 61123.97 56031.75 68333.05 187486.42 238095.95 245041.38 1454454.38 1570423.88 1485926.12 345161.50 295907.47 344565.09 88698.15 75040.73 91295.66 216838.23 228248.31 209953.88 1329673.50 1570218.00 1600000.50 283595.22 296152.34 371395.25 140784.52 156686.92 161094.56 177686.58 196714.88 239427.89 3027576.00 3023293.75 2755681.50 221545.30 252469.45 245362.31 192157.45 217090.95 215263.56 376881.25 381378.00 384989.84 1612263.88 1591102.88 1654467.38 295892.88 314630.75 348663.28 104841.66 100843.03 104117.71 237598.08 225897.58 225125.67 1951844.00 2037182.62 2264171.25 606141.06 567450.00 575231.19 240579.33 252325.50 244545.05 445503.78 257483.67 388210.72 N N N-Trimethyllysine 49369.23 50646.89 38045.85 30109.27 31157.87 44041.27 51411.57 60206.88 41547.07 22712.21 21329.17 19145.41 30368.59 27220.21 34868.39 105565.06 101563.34 73036.84 91167.31 76128.98 84701.10 52789.99 71614.34 70762.53 157922.17 169175.75 161370.28 39729.46 42764.49 42447.70 30455.67 34408.82 42764.19 29949.11 30453.87 29720.58 1037.17 100440.35 75723.45 53306.18 68107.82 72496.81 81733.19 74317.59 76277.58 49490.92 61741.89 59412.08 82359.34 80483.58 76996.93 191581.20 178640.50 197235.80 123753.12 124608.30 121452.41 138868.61 134232.06 142353.33 288967.91 344906.03 398921.84 380612.22 348083.03 374960.47 370108.34 367642.28 399175.75 194098.92 194339.69 247211.81 84434.73 81488.63 70445.32 86939.12 80439.77 89341.70 109997.96 112467.77 113856.10 47104.69 56967.07 47575.39 65229.03 47588.20 65835.88 85840.99 103509.56 99720.37 76234.32 68615.51 71433.31 88030.23 97783.16 101663.41 252964.36 272638.91 334943.97 284347.16 414728.59 410980.09 708326.31 646974.31 851209.44 518568.47 313046.38 378088.53 N-Acetyl-Galactosamine 907.25 1419.10 989.07 737.89 1821.10 785.51 994.05 1334.34 0.00 785.74 669.46 1135.30 844.76 1044.55 1074.39 1282.33 1002.98 1386.68 0.00 1234.05 819.76 1341.06 1961.61 2149.17 2699.00 1618.25 2062.95 3145.78 2713.15 1898.09 1488.02 2654.96 2690.91 1414.07 2547.86 1892.70 0.00 1445.45 1724.51 0.00 1391.86 1001.67 1153.87 0.00 1660.63 1692.96 1805.77 1210.44 1258.74 1925.63 1316.69 1622.37 1537.48 1395.39 1422.65 0.00 1427.43 2581.47 1728.72 2244.38 4581.64 3779.41 7414.62 2901.96 4627.21 3991.08 2553.31 7442.99 2541.71 2593.92 4297.71 2843.49 1120.76 1391.50 1064.89 1122.58 0.00 1602.34 881.66 1133.43 2222.13 0.00 1021.84 1039.39 766.48 0.00 0.00 924.53 0.00 1349.30 1532.82 0.00 1013.72 1769.37 0.00 1285.83 2055.27 2231.05 2137.77 1529.96 3035.95 1762.07 5032.81 5994.48 5189.29 7161.45 5177.45 2585.25 N-Acetyl-Serotonin 2397.71 13146.91 3379.52 3271.90 3214.23 2144.55 5616.35 1788.01 3289.87 3898.68 0.00 0.00 2908.17 3671.68 2249.31 7718.76 10820.01 3746.91 3563.44 15345.67 8614.87 2805.14 2789.48 1796.32 15488.81 7632.67 14557.98 4437.77 0.00 2614.27 3210.28 3413.33 11022.65 9226.68 2722.11 3974.61 0.00 15925.16 9537.69 0.00 3519.86 4855.52 3128.59 5080.30 6026.55 5418.70 8436.21 8807.98 14779.24 9691.95 4846.86 18375.24 11478.48 5588.90 9681.40 5593.21 8056.93 6220.74 15006.71 6653.03 14580.97 21556.39 21533.25 0.00 6935.44 11454.80 16231.47 7747.64 20300.42 10239.80 7135.67 8621.49 14379.28 9918.49 22612.09 5631.46 8195.00 18312.88 18093.08 11627.84 12372.74 4948.76 16213.89 10059.54 16338.21 4156.03 11223.16 4940.17 13560.50 21103.19 12079.37 14083.64 13706.00 7928.11 13890.72 14346.69 33990.57 29340.44 36691.25 14629.49 3754.89 9709.66 5744.53 20864.87 22707.09 3765.51 13440.40 21362.13 N-Acetyl-glutamate 1115.66 2357.42 1242.84 6172.01 6856.27 6143.80 31077.43 26823.04 22857.65 10442.19 11020.24 10417.67 1137.11 1216.65 881.69 24459.49 20004.83 24983.88 5411.28 2129.28 2375.92 6772.64 3294.42 5651.59 5002.41 1738.77 3387.37 3781.98 4940.14 6507.39 899.63 978.33 1006.29 0.00 966.65 934.04 0.00 2572.06 1281.70 1498.09 4612.52 3634.45 17809.70 17654.22 20373.98 5631.24 5893.63 6832.38 1940.21 1051.33 1349.26 11534.36 10410.25 15052.83 1091.09 1129.14 3081.13 6044.08 5638.56 6347.44 2734.95 2337.47 5731.80 11850.43 11422.13 10217.02 1587.99 846.08 1124.71 1149.98 1009.50 1229.76 0.00 0.00 1338.27 3325.07 3933.34 3044.13 13237.12 16805.42 13402.55 3336.87 4541.89 5327.05 1508.35 1186.01 1224.86 5837.40 7683.74 6588.70 0.00 2603.50 0.00 3328.25 5112.28 3693.72 2061.51 1508.04 1398.35 4110.13 2601.35 2172.93 1042.60 0.00 0.00 1176.42 1040.87 0.00 N-Acetyl-lysine 0.00 0.00 2421.97 0.00 4631.20 0.00 2031.40 2171.84 0.00 0.00 0.00 0.00 2881.48 1902.06 0.00 7138.71 4749.14 2289.16 0.00 3212.15 0.00 6615.66 3529.97 1724.08 4742.48 4946.89 8249.97 0.00 0.00 0.00 1202.01 0.00 2309.83 2419.28 1298.22 0.00 1139.07 15216.89 6635.16 1771.97 4889.39 2785.45 1154.34 2313.59 3465.52 3062.05 3591.35 3519.74 6380.39 7083.96 6407.46 6061.60 3706.48 4945.56 3174.63 3990.00 8996.17 4719.65 4147.45 4440.82 11923.33 14088.91 18094.50 8457.42 8404.30 7921.77 3450.45 7624.62 6435.95 4825.28 4107.92 5920.02 2879.16 1534.25 3256.51 1088.06 3388.38 3029.60 6696.68 4896.29 11089.50 0.00 0.00 1237.94 2838.51 3181.18 1374.62 6213.86 3072.58 3361.93 2781.48 2584.78 4405.64 6615.71 1788.59 3229.77 8951.37 15353.37 19764.80 5582.64 5028.60 13867.04 9201.64 9100.39 12269.32 14597.40 6856.13 5870.62 N-Acetyl-methionine 9988.57 9281.47 7764.60 10439.76 10288.35 12896.70 11267.26 10708.71 10372.84 4459.41 1925.29 5359.18 7575.64 7515.06 8515.48 9589.37 11994.48 11248.60 10188.87 8173.24 11397.80 9076.64 14136.36 12455.85 23681.63 23933.82 22224.33 19031.39 16242.33 18686.64 8508.04 9554.38 10076.79 12222.06 17458.39 12420.89 0.00 6294.40 0.00 4052.87 11113.00 8100.57 16085.20 15847.61 15513.45 5131.86 6273.08 5373.75 3929.75 2919.05 2691.47 6609.12 6974.01 9938.45 7985.12 6949.68 2644.86 4717.30 8517.77 9170.53 44005.44 36593.32 36489.88 37180.82 30423.02 36008.94 23644.68 20148.63 16889.88 23871.03 27747.86 33906.96 1756.22 1951.35 3792.09 1696.72 0.00 0.00 2217.09 3652.76 1910.56 0.00 1836.01 0.00 1834.32 0.00 0.00 1594.18 1559.70 2135.09 0.00 1563.23 1559.53 1774.25 2230.07 2125.29 18997.45 21284.28 21802.78 20782.47 15195.91 10484.39 9623.49 9271.41 11602.99 20844.62 21511.23 20147.57 N-Acetyl-proline 3156.55 6735.40 7002.60 6634.88 5683.76 3971.36 5556.23 4477.79 3857.18 3750.79 3330.75 5254.00 5055.95 5232.42 3144.18 4902.85 2842.36 3048.86 4703.05 4947.29 6821.34 5583.29 6851.18 5455.73 5136.79 5399.24 5539.33 6216.32 2448.80 4303.04 7456.40 6924.94 6984.50 4887.29 6961.54 6784.95 3294.32 12549.24 8431.07 6545.31 9908.06 5901.45 7936.73 8419.98 8713.16 10756.73 6666.07 9611.48 7911.74 8876.66 6221.11 11550.13 8863.70 8007.71 8751.41 10222.17 11819.08 7544.13 4616.21 9201.95 8157.70 9262.04 8802.40 9976.02 9716.14 9614.46 7502.84 8794.98 10236.96 4877.32 12141.56 10088.75 7816.01 6528.40 7277.55 7977.78 6317.23 7313.81 6966.23 6221.17 8301.24 7511.85 5831.71 6483.85 6219.61 6827.76 9338.75 8549.71 5225.66 5738.86 10336.39 7847.19 8154.16 4961.13 5617.43 8830.86 4533.50 9372.67 10779.57 9509.82 5713.40 6535.33 8337.69 3914.38 8161.48 10638.60 7518.28 8434.03 N-Acetyl-serine 2613.77 6927.43 3961.89 1886.61 2616.60 2260.64 1294.40 1267.79 1233.53 2077.35 1263.08 1705.29 5510.50 2262.57 1367.73 4437.58 1806.53 4472.53 4691.57 2612.93 1467.58 1798.56 1332.49 2526.46 7081.59 8546.40 6274.80 4071.74 1494.23 2053.70 1339.15 2140.88 1433.33 2696.21 1412.63 1609.50 0.00 3188.57 2097.12 4229.26 4668.59 3083.70 1645.67 2554.99 1413.40 2598.81 2631.25 3679.25 5123.14 4755.18 4766.95 7322.41 9821.06 11814.27 4916.61 3664.33 4167.09 4091.14 4623.70 6873.24 24479.69 22804.14 28217.00 10647.80 7185.49 6601.85 9056.97 7829.40 7246.46 7397.10 5794.24 10485.80 4995.89 3914.53 3024.54 2103.48 1803.39 3160.02 4532.43 2632.43 1705.87 1788.13 4395.40 1573.18 1399.53 1489.75 665.98 3281.93 4124.16 4041.66 3465.22 1675.96 1915.88 4370.69 4357.48 3544.10 11907.59 10649.30 11188.09 3239.13 3629.37 4385.88 5094.82 7833.48 11547.93 216000.75 3280.37 3920.43 N-Acetylglycine 844.41 0.00 692.92 872.87 0.00 904.47 1016.42 928.71 1086.81 815.15 0.00 683.99 895.00 773.54 921.97 1192.80 1186.01 1189.34 2203.04 1207.53 1041.21 1104.50 0.00 789.87 7130.70 4158.58 3131.46 2751.21 1233.65 1047.27 756.07 0.00 1165.04 1197.41 3084.98 3254.33 0.00 995.66 1140.82 1062.52 0.00 0.00 975.92 0.00 1130.90 0.00 1253.75 841.48 1197.00 1065.96 0.00 1869.37 1798.76 3546.20 1807.05 2118.95 3036.03 3704.11 4197.46 3643.35 5429.74 10137.97 15648.95 3392.36 3870.59 7638.22 4842.89 3058.14 6814.49 5953.57 3469.57 9628.57 1556.34 1754.64 1298.40 1463.35 1423.13 1914.57 2148.04 1427.26 2173.57 0.00 0.00 0.00 1343.25 1212.13 1147.07 1287.33 1743.40 3476.31 1848.43 3395.99 3736.21 1543.28 1335.86 3478.50 5350.44 6335.99 6073.86 3373.18 6061.38 12036.41 5388.25 5656.40 6048.57 9113.35 8000.75 9831.88 N-Acetylneuraminic acid 17277.86 16926.77 15771.57 18046.66 15036.09 20526.88 17164.21 17084.40 16160.75 11060.34 10257.13 9274.12 12011.51 9053.20 8987.51 24098.17 18637.31 24796.12 26988.17 25180.69 26800.17 30553.67 31418.55 31203.60 41864.69 43317.17 38285.59 16688.86 18755.52 15735.09 5452.14 8586.43 6043.09 9270.23 14997.38 11819.59 0.00 43060.78 43567.66 24979.05 21753.21 27766.40 27428.41 36149.51 32865.64 17832.93 20672.50 17847.10 21021.54 23739.23 21816.49 30113.97 38273.42 45093.39 34583.59 40421.85 38873.90 42423.14 51051.91 40202.00 106051.85 85246.63 98907.00 46828.77 30415.18 39964.78 25957.08 27832.98 28447.21 32599.67 35229.60 42014.82 41323.19 39219.20 37974.35 27095.59 24268.28 29035.39 25477.94 26022.36 24057.53 16371.76 22065.96 19862.84 39005.37 33388.21 35306.17 24938.90 26639.33 27111.88 42662.73 44979.43 42137.36 32687.67 28613.09 29604.90 65301.46 59588.57 67560.91 24558.95 25436.54 22241.03 16039.01 19421.81 22288.63 16931.69 21218.50 26039.63 NAD 964354.44 1290745.50 988581.81 688897.19 655755.44 763623.94 612037.00 597959.81 486773.75 612134.44 604013.44 513191.91 808342.44 761673.31 711312.69 1035030.69 921876.44 892867.69 752936.19 778004.19 866668.31 973063.75 1001196.69 957976.31 1576235.38 1465946.00 1345498.38 742736.50 767987.69 794279.19 608372.00 673159.81 669006.31 776072.00 923847.31 803127.25 0.00 1659762.38 1133640.00 681215.31 819403.31 833350.44 635170.94 634546.69 624554.56 869312.69 891780.81 968030.44 1129429.62 991263.00 987944.44 1149498.88 1216388.25 1323424.62 764295.81 763128.94 868875.00 1093949.12 1251913.62 1206479.88 1935114.38 2027482.38 2128916.25 2143888.50 2168122.25 1958681.38 1974753.38 2236450.25 2172689.75 1502675.38 1721010.12 1962519.38 858481.50 861249.19 812066.25 775598.69 805852.00 873851.00 795597.81 815425.81 854382.50 781751.69 952121.31 804362.69 576646.81 571752.81 574131.44 724665.44 766190.69 832516.25 675319.50 627291.44 681827.50 971723.31 999439.31 985767.31 1825670.00 1867885.62 1943623.88 1575436.62 1429984.38 1585472.38 2121363.75 2245223.75 2114617.00 2047542.88 1545411.12 1615481.62 NADH 77063.60 89457.40 78996.09 35072.89 30483.57 33573.16 31733.64 26340.13 23792.86 49239.53 48189.38 48377.73 59567.58 50031.01 54387.77 39509.66 47875.95 47447.94 79225.87 79501.37 90869.44 52609.81 53968.59 50049.32 1629.58 2543.38 3063.19 1934.55 1513.28 1450.91 3643.47 6773.53 5626.45 1729.03 3930.07 3952.38 0.00 192444.00 156999.08 37188.08 50950.69 62711.26 36006.21 42285.38 35732.45 110444.79 111156.32 130795.63 93724.60 84419.27 76542.22 71085.16 68660.30 75143.04 119533.55 127250.38 137731.97 107862.30 114548.23 90422.52 4479.99 3486.64 8887.38 58618.28 105077.72 250388.75 14746.50 12285.36 14276.71 17645.39 26936.39 42117.33 135971.42 140853.92 140065.23 57697.77 58828.34 54204.04 110278.73 101697.37 87267.66 119111.00 124540.19 139769.75 46772.02 46940.96 52266.81 49127.76 50819.89 54746.31 82302.45 80490.41 87794.81 88464.40 87490.40 102593.13 20301.19 24024.09 34322.12 261464.95 296556.84 294965.38 25276.90 24052.78 19400.90 195696.45 140635.89 148348.70 NADP 4383.72 12099.78 6720.84 4811.77 4971.62 8220.87 5772.51 4452.32 3622.96 5295.65 3237.61 1697.51 5148.36 5903.26 5469.80 10830.54 8076.81 6156.77 6371.97 8107.36 2317.39 7694.63 4567.24 8559.82 28634.64 29799.97 27607.28 13806.57 11915.52 12615.74 9508.27 8624.62 7713.91 13692.17 13720.47 14411.26 0.00 6790.26 5337.38 4659.03 5328.76 5980.68 4149.66 3313.42 4542.93 2902.64 4505.83 2036.05 8037.91 5791.48 4695.01 7148.38 7685.40 9354.16 1944.74 3849.28 4465.30 6328.88 5937.33 5215.03 24756.77 22821.88 26202.29 13582.12 10998.81 6438.95 15855.56 17266.05 18106.56 14872.89 17053.49 16386.48 5579.65 4230.70 6366.22 6284.08 6775.08 6980.83 2848.56 3687.54 4619.59 3282.96 3610.71 1240.38 5512.59 3517.09 4759.04 2869.39 4069.83 4190.83 3245.69 3394.80 3716.63 4501.07 3111.81 4148.80 16279.62 18330.60 18902.11 5606.65 5646.95 6367.19 16357.64 16112.93 17533.65 11021.66 10303.96 12007.35 NADPH 51162.29 71443.20 46551.25 42061.89 43081.48 40281.65 35904.15 35770.94 33307.36 27792.34 25760.48 25985.18 40467.20 37927.45 42983.68 35373.33 42175.40 41720.36 38799.59 39086.12 42147.50 37168.39 36363.38 45556.62 99092.59 121461.78 112356.82 48859.89 57188.77 50902.34 40224.56 43375.36 46567.22 51894.86 51385.07 75740.74 0.00 53390.79 42999.25 37772.56 38142.34 41769.75 38390.46 36123.68 37570.02 25858.33 29167.99 26115.27 41897.06 36594.62 35349.98 41670.84 44092.51 44510.27 32462.19 27617.32 33850.36 30336.90 27908.39 25261.94 131741.48 149646.45 129520.50 76105.88 87913.81 60585.67 93467.76 89687.66 88105.46 98250.32 105144.70 96201.88 38882.61 40738.29 34064.92 25809.33 28047.02 25855.76 21095.88 21275.92 17321.34 21286.17 26968.32 22404.47 17136.35 17233.95 18590.85 24697.48 25586.89 26743.72 25015.97 20244.62 20514.92 18711.22 17594.64 16990.16 94439.49 118453.00 104430.12 41406.52 38949.77 45692.07 107743.40 109663.44 105412.68 122001.66 79864.63 76015.94 NMN 1470.77 3668.56 1181.11 909.22 2645.61 983.87 2685.65 1444.72 4323.65 1451.99 2730.38 1018.44 1928.14 1124.88 1222.00 2481.47 4772.03 3232.91 0.00 1076.94 707.09 1140.69 1158.37 654.01 6724.42 8321.24 6874.12 5999.70 6944.35 5401.68 2594.22 5551.44 4433.65 3133.56 4726.81 3765.74 0.00 5162.34 4949.50 757.72 1413.74 1920.55 3214.99 3992.51 3826.89 890.97 2487.72 2327.66 1934.18 1434.80 1045.83 3727.39 3880.81 2639.43 0.00 0.00 882.38 1241.23 2871.96 2091.11 9842.03 10758.26 12637.04 14140.45 15661.86 15079.10 9091.18 9707.77 8259.78 6187.88 8333.23 8118.99 7585.73 9448.14 9426.47 1718.10 3866.63 2772.33 3404.81 3443.74 3067.68 3393.38 3453.95 3789.89 3042.69 5200.47 3542.06 1586.05 1834.65 2081.27 1033.71 0.00 865.55 2429.26 2465.47 3113.30 13402.18 15004.76 16807.61 21538.73 20313.56 21608.92 6820.70 8672.75 7801.14 11747.86 10190.88 8323.77 Nicotinamide 281393.53 343513.66 365160.59 382348.41 259786.61 240802.58 286985.81 441907.47 292514.62 236979.67 206383.50 239766.05 214021.05 324675.06 238372.61 359990.91 444412.50 337014.69 507887.62 433914.09 517240.66 465177.84 449393.25 425515.50 615214.81 650805.94 798563.00 300627.97 311713.72 330086.41 227292.88 191993.30 243253.75 178189.00 192792.80 199980.38 1880.39 573258.69 419468.00 273397.44 315902.91 315157.09 351227.38 301258.25 347311.97 342838.69 405532.16 385733.91 475673.09 498101.91 502244.59 703205.69 723595.81 741865.56 686249.25 595929.31 711515.94 733139.81 688592.50 563686.69 1018935.31 951066.50 1090261.88 854951.50 725367.44 708978.81 715778.75 644875.44 733060.25 575566.31 475995.91 613401.69 285261.00 291920.72 313600.88 370627.75 326892.47 271510.09 594457.06 574844.31 513407.12 481225.25 565091.44 491695.84 278440.19 260971.27 297110.03 454936.38 405171.41 500321.16 297141.50 334516.97 349454.25 547668.31 446785.91 454049.75 726278.00 733712.81 666987.19 652193.06 467203.53 590588.00 587416.62 549521.31 607984.81 840783.44 544164.44 471007.84 O-Acetyl-L-carnitine 4277184.00 5125306.00 4520300.00 2375691.50 1942701.50 2385843.75 1700177.88 1950268.50 1438701.38 3027968.25 3134086.75 3241010.00 6018677.50 6698128.50 6036629.50 3431984.00 3041319.00 3148202.75 7498050.50 7377837.50 8673846.00 2397524.75 2599303.00 1944233.62 5400665.50 5051087.50 4764086.50 7208874.00 6549495.50 6626424.50 2777107.75 3776982.25 3907352.75 5403977.00 6122424.50 5440651.00 12983.68 13726016.00 13180769.00 2459866.75 3233586.00 4041547.25 1913513.88 1776932.00 1803264.62 5366126.50 5958074.00 6526746.50 9102153.00 9254948.00 10019433.00 5869326.00 5854076.00 6679256.00 5770376.00 5626642.50 6693706.50 4411738.50 4745892.50 4672923.50 9827867.00 10050870.00 13537899.00 54809420.00 54528084.00 55570956.00 27557354.00 27301040.00 28942174.00 24215576.00 23661586.00 30182712.00 18580122.00 17439962.00 18032344.00 6429943.50 7246468.50 8292936.00 5476866.00 5453533.50 6878251.50 8626224.00 9091564.00 11915231.00 15744101.00 15950133.00 19431918.00 5109857.50 5141185.50 6303396.00 4934116.50 5772254.50 5026116.00 4179107.25 4131960.25 4304935.50 16702513.00 17212420.00 21211562.00 42176508.00 37669052.00 41280156.00 29093808.00 28836384.00 33201096.00 45359860.00 31894512.00 39458900.00 O-Phospho-serine 3517.22 4444.08 5025.47 2108.29 3768.47 3081.27 1018.57 1899.32 844.95 2847.88 961.06 2192.78 2223.76 2529.59 3205.13 2469.43 977.34 1948.87 0.00 0.00 0.00 728.42 646.66 727.81 20989.52 18925.02 18177.89 21647.59 19983.26 20783.80 32819.02 38951.91 33713.62 49683.20 39792.57 38005.39 0.00 0.00 0.00 892.36 1127.63 1501.64 845.18 702.50 953.33 0.00 0.00 0.00 0.00 0.00 610.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 823.20 749.58 849.27 1165.33 0.00 0.00 4085.47 5274.83 4450.59 1827.54 2050.69 1789.54 0.00 0.00 0.00 737.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5023.82 3500.62 5321.49 926.68 0.00 0.00 O-Phosphorylethanolamine 6376.94 10755.02 9515.78 8282.09 7586.41 7920.04 7507.67 6961.94 6372.39 46576.29 48140.34 31869.38 11308.70 11910.52 10018.73 5056.94 4478.30 4387.31 1963.98 1795.58 4308.99 3853.56 3630.30 4204.21 15020.67 14218.13 14912.32 11977.43 11314.27 11385.20 5795.14 9215.65 9187.82 9859.28 10150.05 9208.33 0.00 10154.10 7393.03 3935.16 5175.89 4874.16 5101.24 5863.46 5500.21 19397.33 25875.32 22773.96 5571.87 5186.23 5207.61 4147.63 4106.08 4210.20 2039.79 1621.04 1052.42 3402.11 4797.08 5998.78 14466.08 15425.39 17203.72 11693.01 9496.78 8349.01 8498.64 10671.00 10373.17 10139.59 11912.54 15564.58 9476.07 8678.82 9413.67 8201.68 9173.84 7535.31 8486.09 6168.84 8926.97 27325.92 32916.30 35476.09 5683.37 5933.02 6680.29 1925.89 1547.50 3027.00 1325.58 738.83 1651.27 4561.52 4183.93 5623.41 9938.36 11170.17 9273.42 6480.10 6206.61 7322.40 10846.75 8661.12 10645.01 14344.35 9069.53 12183.66 O-Succinyl-L-homoserine 2702.37 4771.22 4083.51 2731.66 4427.18 3697.51 2716.05 4304.64 2670.96 1627.70 1611.29 2601.46 4660.00 4772.85 2594.78 2423.81 3076.11 4552.28 5521.92 5712.39 7970.41 6852.74 7323.61 4918.45 4102.04 2957.33 2725.19 2050.74 1240.84 3390.50 969.41 871.34 1209.51 1320.19 1482.53 1085.93 0.00 5912.44 6868.38 1998.35 4023.71 7020.38 5137.14 5566.54 4844.26 5292.95 6043.43 5786.86 7008.86 3266.98 5741.48 6030.81 5491.34 5274.38 5275.89 4792.81 5064.35 8472.04 9176.94 8660.65 2647.16 3250.68 5549.91 2040.35 3429.80 1417.02 1444.96 2295.51 2676.72 2357.05 1264.39 2573.73 2242.13 5522.66 5893.74 3528.51 5130.28 3838.71 5591.27 3572.31 4755.68 5652.50 6654.61 4559.80 4780.03 4669.79 2595.55 2014.93 4714.36 3496.14 4855.54 5524.87 6248.04 6166.66 6894.28 6405.23 1268.17 1680.46 2509.59 1458.57 0.00 0.00 1688.10 1166.18 2799.06 969.97 0.00 1315.55 Ophthalmate 19874.24 25203.41 23493.86 10364.80 14809.98 17131.81 92111.56 101073.98 90756.71 70097.32 62293.00 65930.13 16042.16 14429.58 13159.59 20065.01 16642.37 23835.46 20246.52 18075.29 19473.20 32197.88 32067.39 37124.52 121615.26 120820.48 115890.40 92444.04 86674.23 91474.91 111950.12 137474.45 148392.72 361905.03 378847.16 363340.25 0.00 11502.63 6274.43 11474.25 11024.80 16956.76 76119.99 85325.55 84005.78 20336.00 20732.95 21202.98 8405.29 3903.69 4243.14 15495.69 15507.61 17001.69 15041.02 15910.71 16704.09 29756.80 36280.42 36300.61 84938.24 82521.48 77064.32 44967.16 36404.92 22146.52 21914.59 21186.70 25638.67 137463.23 232342.38 134640.70 5213.74 8869.27 7166.38 3704.86 1726.70 1709.82 26310.54 29124.00 21982.34 7915.13 18147.01 13202.96 0.00 3371.63 1447.08 3309.33 6565.71 9153.22 12365.98 9408.09 13361.43 21884.62 22365.05 25650.33 38393.27 35818.45 39282.92 9833.53 5536.16 5590.71 10653.98 13146.20 5453.34 30498.75 22519.96 21395.62 Ornithine 62197.89 70289.88 64111.68 49998.97 46808.06 50991.24 71046.59 83557.21 62678.70 29719.52 29237.74 24539.53 45500.22 47259.47 58072.32 137181.17 113387.31 115518.51 129508.34 131341.23 145877.50 120698.16 139302.41 107887.09 168856.91 183525.08 169556.89 50999.19 49845.86 62016.23 50660.56 42808.47 53242.78 45222.97 43871.78 47376.88 5986.51 108081.91 89210.35 62290.43 79213.52 72119.30 108760.06 95127.16 107131.09 53839.67 57748.98 60392.36 110739.03 97655.21 84725.55 180371.38 218032.75 189221.62 174673.11 146842.39 168344.67 161664.45 166769.86 184210.33 236379.70 244891.36 330253.59 297661.53 262616.88 309638.78 446573.66 393066.59 465649.34 215090.05 205171.42 271750.25 111743.44 94566.97 106286.15 109758.45 96013.06 90277.09 166566.50 154569.14 165957.92 72013.49 82961.38 62544.28 103456.62 90118.97 117936.68 137745.42 144076.53 153203.50 152113.44 179196.50 155432.22 154403.77 146614.06 158527.95 353308.72 367615.16 745137.44 374752.34 328023.12 327667.53 601682.25 603146.06 685803.69 471229.00 348049.44 438819.91 Oxaloacetate 0.00 882.76 0.00 963.25 711.74 0.00 0.00 0.00 0.00 0.00 0.00 766.05 0.00 796.21 0.00 1548.13 2593.39 1045.35 0.00 0.00 0.00 0.00 1046.86 907.35 1613.17 1329.58 1350.16 0.00 0.00 983.01 0.00 0.00 1565.03 1212.29 2243.09 1244.27 0.00 0.00 0.00 0.00 0.00 1126.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 772.26 993.74 1533.99 1149.36 1616.63 0.00 0.00 0.00 1199.00 0.00 934.13 1284.40 1049.37 1855.73 7206.86 3801.34 9620.59 8518.14 7878.35 9736.67 4009.14 3919.49 8164.87 0.00 0.00 0.00 1275.36 1293.36 1070.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1042.71 1202.32 0.00 0.00 1566.08 0.00 0.00 0.00 0.00 736.26 0.00 4846.90 3078.60 5337.50 2972.68 3033.49 5508.28 8561.75 7637.21 9084.00 8669.02 7605.31 9617.58 Palmitoyl-carnitine 9658.18 10473.46 7606.33 10149.92 9651.78 9388.44 5639.59 5330.29 3967.06 11130.25 12815.71 23644.43 7367.17 7222.24 9488.66 3817.74 4191.94 2469.71 4449.57 1438.91 2006.52 5056.80 3679.75 1968.32 9826.61 11796.30 11452.46 10776.13 10833.65 12417.13 12146.72 13814.04 17071.58 8075.22 9494.59 11117.40 0.00 48930.49 50388.49 5809.74 6372.80 5881.74 2761.81 8644.44 7905.46 8106.16 15452.55 21703.41 33560.52 29896.16 31714.61 5356.42 5746.48 3219.25 2798.52 7040.51 9733.31 9305.59 8511.54 8366.39 19072.84 13217.12 18029.10 23633.22 21976.01 23337.63 58562.11 53557.32 51802.00 13337.67 13302.18 16317.41 80428.59 75924.63 87321.08 37838.81 45108.14 67740.84 23155.65 15763.29 35432.40 67192.22 57774.21 70109.66 80986.23 88793.12 96957.12 10618.04 10955.19 9920.47 44237.14 42951.14 30067.11 18841.43 19724.95 16530.19 16457.37 18859.94 17846.70 17596.52 28304.90 28417.73 173661.38 164088.08 172735.20 8502.27 18533.84 15780.91 Pantothenate 357759.72 495340.91 437861.50 189661.45 177383.08 185024.77 457276.84 472734.75 371390.84 51836.45 47576.53 48513.47 68443.89 71793.05 64699.07 245788.77 249564.64 235026.52 184539.69 182963.58 221706.88 798163.81 804328.00 712309.44 523539.66 478610.66 465253.41 178763.58 176128.55 187101.81 146299.08 157211.83 163422.48 187379.98 191138.56 175154.58 2678.32 969361.81 689233.50 197120.33 253472.58 306465.72 648673.56 640008.00 664608.50 80415.46 86199.28 94787.30 141095.06 128743.78 152177.92 483854.66 508297.47 545761.38 350832.91 308587.53 360279.25 1548275.62 1863278.62 1713289.88 867663.69 882236.19 1201329.25 290450.50 203351.75 232493.20 385009.50 352797.78 357339.09 374921.16 366588.00 361377.25 737535.19 816807.06 768890.00 409655.09 434189.34 471571.59 1684581.62 1619947.50 1686604.38 103120.52 109927.10 101799.21 86819.23 82881.24 92590.25 313461.00 310659.62 331387.19 290974.28 259167.23 270043.22 1559869.62 1494843.50 1480567.50 726239.25 710811.69 769617.00 212977.75 165490.50 168905.83 300113.41 264032.59 319622.38 483943.97 271125.03 325924.22 Phenylacetaldehyde 67468.90 82562.59 62873.23 50598.91 41124.53 39851.85 38412.94 43158.83 50264.86 46956.32 34041.54 53987.31 38789.97 53465.80 48146.69 38791.17 49098.58 43204.14 40685.69 38862.59 43886.57 47090.43 39421.88 42989.78 53531.43 39690.86 43982.88 43087.03 66109.85 46902.08 51154.39 81444.87 53143.68 44541.12 42923.71 35717.61 1955.64 114733.55 95830.84 95885.31 117813.66 92835.12 89126.91 110164.88 101797.68 67528.04 91823.65 74955.98 93256.25 73767.63 74639.14 91105.30 126790.62 115211.29 138821.94 79721.88 80730.70 87619.31 107936.21 73829.39 101279.10 109690.59 127983.88 105425.66 83456.68 102824.31 83474.93 104419.12 89244.66 89114.94 99460.30 99386.55 92284.94 108947.94 77321.80 85505.55 75147.99 79447.62 66487.98 87263.24 61414.56 49458.04 71570.09 81156.29 70607.20 103715.38 69936.68 73496.71 60337.54 91786.77 56835.24 38162.91 88835.49 97621.81 79735.46 55591.76 96122.10 105820.79 96970.28 118523.28 106117.91 118242.98 89367.77 93739.66 110735.38 163433.42 99267.21 103118.49 Phenylalanine 1415949.88 1867869.00 1475164.62 1158624.62 920235.06 1122476.12 1302356.00 1351255.00 1142096.12 730054.81 780033.50 752147.94 1299767.50 1380193.12 1298188.88 2274497.00 1984504.00 2029529.12 1415796.62 1387275.38 1452563.62 2016634.12 2052503.00 1794724.38 600412.94 607317.31 654179.06 681209.75 658535.50 660516.69 651671.69 717890.06 683176.44 758102.06 655720.00 752206.94 8680.82 3443674.00 3023756.00 1262322.38 1605006.38 1704955.38 1786840.62 1711297.62 1733737.00 1354403.75 1310597.75 1448611.38 3125643.00 3078728.75 3178712.00 3098416.00 2855565.75 3307483.00 2452987.75 2394827.75 2616330.50 2469141.75 2267491.25 2461095.75 538426.88 536921.69 617627.00 1226431.12 1202964.50 1214969.88 1543502.12 1586591.62 1630941.00 866607.56 880553.44 931365.31 3172662.00 3234258.25 3487075.75 2902634.00 2763637.00 3109098.75 3020150.00 2635044.00 3187053.75 1548389.38 1583812.50 1618746.00 2672250.75 2507813.00 3037402.00 2380762.75 2257468.25 2582737.75 2395498.50 2606181.75 2416323.25 1775543.38 1667125.38 1937701.38 760067.31 813862.81 1358499.62 1074684.62 1031147.31 1092776.62 1944858.12 1772846.00 1958024.00 1047854.94 667611.19 814942.50 Phenylethanolamine 13008.97 11263.66 13873.50 20307.75 18044.59 11101.62 13605.57 14996.77 10446.78 13068.52 13733.44 16300.19 13638.03 14844.07 13070.12 14986.97 13419.28 13564.47 10635.35 15742.17 19173.65 16009.62 13027.77 12621.55 14842.80 14547.47 13826.09 19351.13 14894.28 14626.19 14759.67 19782.18 17489.91 13016.70 15321.36 14893.19 4861.73 21903.29 28467.17 27536.18 26468.10 29119.05 43549.07 113810.32 108104.72 90224.62 106002.66 90235.59 21351.77 81280.35 31203.78 26070.09 27467.85 22619.54 31583.84 25218.48 24284.93 27635.16 31669.16 31320.15 30061.24 30128.24 26852.32 29264.23 32108.33 24592.77 31090.48 20670.24 30340.18 30735.21 223006.48 271176.16 18352.60 42835.96 22733.40 25927.91 28931.07 22859.15 26488.71 30750.08 20962.99 89159.41 28991.98 29337.72 21533.74 18481.71 22451.41 22113.20 24557.62 23460.07 24590.65 55899.48 24474.58 22866.16 27433.53 25734.99 35002.43 203743.00 228243.67 34388.39 230595.98 26552.52 21261.63 272618.59 31296.16 364226.12 34755.25 219206.52 Phosphocholine 46060368.00 66878308.00 51715360.00 40975756.00 36040924.00 42487088.00 34106124.00 34287892.00 31539520.00 48259908.00 46290000.00 42294396.00 33892156.00 32022970.00 32453688.00 53457028.00 50679948.00 48756052.00 46354636.00 44623764.00 55454432.00 36088140.00 36575740.00 31648238.00 92322728.00 88773704.00 85366632.00 24941622.00 25042442.00 24115386.00 81760936.00 90841032.00 100265608.00 119042328.00 127586024.00 124713752.00 33354.73 63338956.00 48464340.00 51809712.00 60399584.00 67344616.00 54402720.00 52624116.00 57223392.00 44953696.00 53588444.00 54765984.00 38651476.00 36762784.00 37822084.00 71690960.00 77068024.00 80129024.00 75306856.00 70258968.00 80531768.00 51467324.00 59016928.00 54180876.00 56496492.00 46461420.00 51028300.00 27790262.00 27264606.00 28774334.00 79974400.00 75218280.00 83759208.00 82224960.00 103538856.00 90969304.00 33893012.00 34029680.00 35047460.00 46533932.00 46898512.00 61382140.00 36116768.00 33912428.00 37680628.00 53685004.00 55511344.00 65702396.00 21149502.00 18904228.00 23896178.00 57106800.00 60821356.00 69072976.00 71990032.00 71720168.00 68917376.00 40349744.00 37811876.00 41920748.00 7136318.00 4242491.00 3693218.25 16869346.00 15174233.00 15220453.00 8761612.00 6493938.50 7883119.50 51204592.00 31631168.00 35618800.00 Phosphoenolpyruvate 7189.48 11960.33 11773.25 3507.68 2528.90 4886.49 2933.75 2085.39 1232.25 2331.41 2131.09 1860.66 7213.95 5285.84 5079.10 2781.15 3081.40 1933.29 1849.56 2915.73 2713.16 1274.09 2833.04 2735.43 9133.35 9914.49 10589.27 7868.50 6859.90 6803.03 8063.41 8698.94 10468.57 6603.68 7043.18 4192.46 0.00 3433.53 3007.10 8933.58 9098.92 9036.76 3339.67 6199.17 2323.07 1809.60 2170.91 3894.33 2770.23 1067.81 1928.56 2193.73 2911.56 4845.99 1684.21 652.23 790.61 1366.07 2099.40 1426.35 14861.89 13377.03 14045.11 6487.58 5674.99 2949.45 10120.68 13106.20 11840.77 10120.88 14510.02 12373.78 2399.24 3820.76 3679.26 1066.03 831.42 2045.05 693.93 770.59 0.00 642.46 0.00 757.49 687.16 692.29 2320.21 853.21 0.00 1026.46 0.00 0.00 0.00 0.00 0.00 0.00 6091.09 7527.72 3385.86 2244.58 1006.09 1814.58 7496.97 8567.33 11225.54 7388.44 4373.73 5570.41 Pipecolate 19947.42 20670.93 17962.62 18077.26 20102.39 17622.72 23368.27 27294.65 22830.96 13446.86 11257.40 17615.64 17059.57 12869.00 14743.42 30975.62 37417.14 35428.54 31353.54 27034.40 23610.58 30770.54 31303.74 33024.89 81226.76 81295.16 71966.70 40923.34 40790.82 35146.94 25160.38 29787.37 38206.64 52949.95 42209.57 43711.04 6782.78 26203.94 22000.28 20992.44 27217.00 30540.17 23521.65 20335.50 32065.42 18513.91 17271.46 24849.88 22272.37 19616.11 19972.71 40564.31 34200.38 34278.45 29742.78 24434.12 29667.65 29965.84 38787.81 39982.95 103950.09 103974.66 134694.64 99166.46 103342.56 114908.98 120867.34 130774.65 120557.24 122950.46 119608.94 138610.23 29350.10 20976.50 28835.10 23147.22 23919.87 22914.13 33754.16 29528.22 40408.70 19996.94 17248.64 24133.12 32121.34 18159.48 20921.58 25443.25 39487.12 32331.48 27930.80 30060.55 30838.12 37461.94 33379.50 38276.18 105986.98 108740.40 123961.51 110629.13 108313.56 111364.00 144546.64 118357.37 167713.58 181605.20 124094.31 157928.55 Proline 44481380.00 52178676.00 47708480.00 39041236.00 33945340.00 37497736.00 39480560.00 41638188.00 31747536.00 30005946.00 31021250.00 29630894.00 41719828.00 42755436.00 40929124.00 69320912.00 58898784.00 61716468.00 64702428.00 65121152.00 70423256.00 62238228.00 64343108.00 53321876.00 43659296.00 38514784.00 40568256.00 25061558.00 23868640.00 24700576.00 24702362.00 29604450.00 29427976.00 41055548.00 41770244.00 39618404.00 48792.86 72761864.00 65059712.00 29640016.00 37835664.00 45962740.00 41203240.00 37998220.00 40297228.00 41804148.00 43949476.00 47681980.00 64507696.00 59648320.00 67773624.00 99441784.00 92559240.00 98702344.00 88038856.00 89397088.00 95502984.00 103945272.00 103244904.00 109610104.00 71603432.00 76350368.00 97689512.00 99098680.00 103525400.00 103189944.00 133945568.00 130939768.00 143757552.00 97968000.00 92612216.00 105314368.00 78401472.00 74810360.00 80719944.00 63075636.00 61952928.00 67695920.00 102068568.00 99521344.00 111188000.00 56179428.00 54373012.00 65073508.00 55972832.00 52922976.00 62438140.00 73352672.00 70601240.00 85597960.00 86331712.00 90780376.00 86412664.00 106901400.00 100692376.00 105846168.00 104128248.00 105096320.00 114996000.00 109798616.00 100906056.00 115996904.00 141983408.00 132251400.00 156255936.00 144403920.00 116431672.00 134397776.00 Pyridoxal 156031.02 186344.06 160518.42 75915.93 68067.44 75637.77 42155.16 54824.50 39934.16 52863.19 68358.07 59684.13 99025.06 95273.77 97601.52 152792.33 143578.39 137106.05 189468.30 162255.66 182219.45 116316.41 113605.24 107395.75 224460.95 215620.05 206990.31 67701.93 64260.39 71866.91 78120.00 88433.71 116335.82 58278.50 85362.34 68502.85 2081.01 521594.12 398032.00 75756.17 109824.76 108927.81 89519.59 77600.87 73913.24 179940.88 208771.95 182123.61 350506.09 344318.31 367830.75 444191.78 481311.16 480548.34 434854.34 438753.50 433485.91 348075.50 366549.84 325338.28 452748.00 471801.84 572142.25 316543.88 326968.03 293221.91 475534.38 464466.03 441958.66 250041.00 258426.06 256318.81 497142.88 489282.00 472787.16 288282.03 282903.28 264761.09 371140.12 385781.03 395006.16 311191.00 339220.88 297603.66 358586.66 331388.59 394156.41 307942.22 311427.00 351627.97 354960.25 363741.09 384028.50 354269.47 255946.12 317583.34 512031.50 563360.69 636100.06 481265.28 431132.91 439675.38 832449.06 809189.00 837507.44 309306.09 359844.78 363660.00 Pyridoxal 5-phosphate 2191.38 2080.61 1130.42 1449.07 1014.61 898.93 0.00 1145.22 731.48 880.70 932.96 0.00 1099.28 0.00 0.00 3656.68 2074.39 1342.57 2159.89 2704.13 3821.84 1111.29 1279.75 1136.02 3222.95 1554.26 1630.60 1045.85 1706.17 909.65 1104.95 1397.62 2444.13 1852.63 1138.18 1059.71 0.00 5041.93 4134.64 938.63 1199.73 2460.58 1024.14 953.38 881.30 2295.68 2705.74 3585.01 2006.93 1796.58 3537.66 5338.89 5265.40 5959.79 4475.50 4431.93 5749.50 2293.85 3836.49 2376.01 5413.78 6415.03 4971.97 1285.90 1480.39 2538.83 5747.40 5320.38 2441.12 1337.91 3200.12 1589.50 3654.30 1420.09 1860.52 1008.03 1190.48 835.45 1406.30 3699.09 1280.45 1186.54 1458.55 1217.67 1023.63 0.00 1093.34 1391.25 1502.86 1574.32 1386.86 2431.42 1564.62 1854.99 2443.68 1369.54 1523.98 1663.51 2485.51 1418.10 1221.94 1403.07 3130.79 2519.27 1756.55 1684.38 1378.18 1103.46 Pyridoxine 1017757.19 1269007.00 982039.19 1082236.75 888080.69 989980.94 881167.19 949379.56 911308.94 741565.31 786667.69 830061.81 859361.06 848301.00 903306.50 942044.94 964253.75 896092.00 805491.19 613661.44 695496.25 1278495.62 1173729.62 1195476.88 1285339.12 1353221.12 1478560.62 1258980.62 1327158.62 1340700.00 916105.31 907949.06 1066384.12 1033775.31 1156437.88 1171440.12 2446.72 1497054.62 1313677.00 1242566.62 1350199.50 1450095.12 1524756.00 1351659.50 1433220.62 1482721.38 1625825.50 1524665.00 1666055.50 1617232.12 1590620.00 1566171.62 1634601.38 1612236.38 1153935.88 905270.31 975122.56 1909739.00 1742085.12 1719727.88 2410851.75 2159245.25 2096456.12 3208032.75 2758083.75 2839404.00 2256010.75 2162438.75 2229196.75 2496427.25 2764165.75 2872411.25 949836.81 998996.94 907996.31 1440734.38 1295018.00 1188868.00 1709274.50 1377301.50 1428032.38 1252380.12 1415647.38 1331998.75 980465.00 931174.31 1088970.62 958763.69 943118.00 986575.50 498805.25 517160.59 644892.81 1223908.00 1036608.19 1137393.00 1454668.62 1483277.50 1480900.38 2706277.00 2443479.25 2417634.25 1222198.62 1066315.62 1260959.88 3132465.75 2290876.25 2401584.25 Pyroglutamate 4906.36 8965.93 5758.96 7214.79 4889.75 4320.55 4919.66 5182.08 5145.71 2731.79 3047.26 2157.81 5244.86 6367.73 5534.92 10047.71 6819.85 5959.92 6948.11 4638.76 8333.62 10691.12 4172.61 8262.45 5553.02 2768.83 4047.81 4371.59 1517.51 3712.64 3613.92 4003.37 4867.41 1680.80 4110.40 4801.11 0.00 9926.45 6350.48 7287.00 10797.30 9439.29 8889.20 6473.74 7546.46 5501.27 7357.08 6693.83 11655.17 7515.93 10423.33 7337.21 10221.26 10982.04 11992.54 7565.87 10025.75 8559.67 6392.81 4947.04 6569.78 5538.78 10824.15 5278.18 8596.62 4357.02 3528.33 5367.96 1787.30 4878.37 7599.17 2503.08 3173.74 2440.06 4677.01 3480.40 3699.35 3148.79 4248.73 5053.83 4283.06 5088.49 3660.41 5465.32 1297.68 2415.33 4023.78 4006.09 5390.04 5763.06 1728.79 1908.55 3023.01 2244.83 2589.51 2152.52 7870.98 3672.93 8707.16 7542.00 6703.40 6336.44 3347.04 2021.74 6713.35 21499.80 7238.76 6660.54 Retinal 0.00 1856.75 1889.82 11175.32 9922.49 6594.13 9784.98 7060.72 5736.16 3420.71 2688.65 2615.73 6745.41 10782.80 7603.74 5087.34 7718.69 5387.47 1480.60 0.00 0.00 16121.98 11548.16 16792.12 12289.01 13887.51 13865.93 14556.74 14412.98 18706.30 8840.56 8651.42 9982.91 3153.40 3732.71 3893.13 0.00 0.00 0.00 8562.90 8279.62 4175.07 4418.22 5057.44 9158.30 0.00 0.00 0.00 3074.01 0.00 0.00 5233.38 7938.95 4434.67 0.00 0.00 0.00 2885.00 2365.95 0.00 14807.65 19972.50 16808.21 8736.61 9605.58 6159.56 12481.52 12293.96 3459.73 8207.86 2373.36 3163.87 0.00 0.00 0.00 2090.23 4926.77 2864.55 2432.44 0.00 1978.92 0.00 4724.49 0.00 0.00 0.00 2270.70 2939.92 2344.41 2633.25 0.00 0.00 0.00 2516.04 0.00 2172.70 11853.20 8783.20 4962.28 2247.38 3440.60 2318.19 5225.31 7726.26 9983.42 0.00 0.00 2596.81 Riboflavin 1079.88 1294.86 0.00 10348.13 8033.80 10451.66 6852.99 6280.79 6127.55 0.00 891.36 0.00 838.14 1097.10 1254.89 10583.46 9574.77 8754.24 2866.26 2344.00 4545.92 2706.63 2920.98 2468.44 5217.61 3637.90 7086.88 1860.61 2671.73 0.00 0.00 0.00 0.00 1153.15 2717.61 2574.24 0.00 2807.56 1739.61 4546.55 8255.08 3679.56 7909.91 7097.81 5760.66 2280.46 1727.21 2513.55 3809.83 7087.16 7834.31 16045.82 19707.14 18395.38 9262.45 7619.07 8177.36 4162.04 4958.46 4194.18 12866.88 11178.89 13476.18 8997.08 8003.36 9587.68 2494.26 7320.89 2311.35 4036.25 2987.61 7183.74 2311.47 6735.07 4914.92 15215.81 14845.83 12128.68 19894.66 20197.13 18945.91 2439.55 4555.24 1210.65 2064.54 2072.96 4155.97 8502.12 6653.23 6757.59 4657.37 3046.16 5950.09 2734.42 2059.59 1231.63 7042.15 12621.11 9685.10 7913.72 2984.08 5278.70 3485.56 1550.33 2881.09 7074.45 2421.52 2151.91 Ribose 5-phosphate 1074.00 2174.98 911.68 2098.79 1553.57 2201.39 2276.71 1925.44 1207.45 1969.69 649.04 911.47 1211.35 1221.25 2803.30 3037.28 1269.64 2875.67 4003.70 3188.44 3241.06 2536.00 2737.90 2322.80 3726.12 4081.22 3194.81 3576.85 4264.62 3632.12 2758.08 2076.04 2435.69 1237.80 3290.05 3261.34 0.00 1087.06 0.00 5167.52 3012.14 5342.68 3685.63 3210.45 4237.79 3548.48 4853.29 1953.03 6311.79 2573.93 2593.32 4664.01 5024.12 5889.35 5958.30 4576.29 4639.53 5055.86 4105.65 5190.41 8830.59 8416.75 11340.24 13644.63 12371.86 16610.36 10686.74 10965.24 7536.39 12698.75 11713.21 12070.43 0.00 0.00 673.65 855.69 703.94 883.33 1009.74 996.69 1078.66 0.00 847.21 0.00 0.00 0.00 0.00 881.47 1003.90 1062.27 0.00 0.00 0.00 1352.83 1013.98 1519.58 3731.41 4505.23 3900.00 9391.43 7818.59 7348.61 5687.05 2830.68 7177.76 15870.59 11729.26 10607.81 Ribulose-5-phosphate 1954.08 3591.62 2217.12 5779.30 4365.17 6186.05 2916.58 4253.34 3987.85 4366.43 3289.87 1200.56 4560.84 4190.18 4819.14 5233.82 5606.83 2647.01 7574.95 7702.74 7685.05 6016.61 5322.59 6086.42 4076.23 5822.90 4787.51 7233.28 8722.87 6494.76 4031.97 5088.51 5187.82 3178.29 6047.95 4642.20 0.00 1267.64 0.00 5413.02 3577.35 5443.05 4725.21 5349.49 3612.60 5889.58 6848.92 5094.00 3098.21 5099.11 3310.16 4176.37 6584.61 6407.15 9207.62 5995.44 5850.59 6892.82 5928.54 5649.76 11713.67 10888.42 10419.88 15275.97 19845.27 28853.81 12650.24 17599.81 14804.38 9536.50 13248.17 15666.89 0.00 0.00 0.00 886.37 1105.06 0.00 1231.07 1415.68 997.10 0.00 0.00 0.00 0.00 0.00 0.00 947.13 1234.80 2092.97 0.00 0.00 0.00 1291.59 1405.26 1236.00 6497.52 6626.20 6547.10 13988.37 10765.13 11865.98 9983.52 9041.29 10376.09 19141.60 14495.21 15675.77 S-Adenosyl-homocysteine 3399.58 4060.58 3497.14 2183.52 1452.04 2268.65 2050.42 5566.65 2147.49 4217.82 2812.64 2102.93 4958.74 1831.72 2007.65 5042.07 8308.73 5017.40 2032.70 3835.14 1947.12 3121.46 5151.16 2736.77 7193.40 9689.24 10060.60 9198.96 5420.53 8843.63 8030.03 7975.56 10187.53 15366.06 12734.65 10532.27 0.00 9812.25 2331.24 2442.49 3980.96 5855.42 3062.90 4076.12 5815.74 2147.01 4621.59 6966.13 6075.79 10234.10 5108.90 4105.54 6820.60 3827.08 3379.12 2924.40 2109.01 7171.05 5251.61 7552.54 13938.13 8034.65 4391.60 8020.58 10815.52 8844.07 15737.50 23581.63 17006.60 17069.75 16411.75 20855.82 4046.03 6394.78 8546.63 3027.35 4897.59 4628.26 4713.40 2681.10 5400.50 2470.62 4187.86 5759.23 8799.40 13103.93 13848.31 2860.96 6377.02 7578.91 2687.67 2943.75 2467.64 3962.73 7724.43 9195.70 6066.01 14257.05 18360.04 11426.41 12008.64 12274.84 21240.46 19817.56 30639.52 16472.87 13759.26 18238.67 S-Adenosylmethionine 457849.66 707606.56 591899.44 416515.84 254331.80 382171.84 210342.05 247412.45 182850.98 235349.75 225414.25 192569.62 339749.59 341895.78 339645.41 436357.59 410342.16 385724.66 578884.88 549588.06 646570.81 513819.66 567408.75 512798.53 465756.16 449926.25 507154.47 260458.67 279428.66 273272.44 228117.20 274521.59 287861.41 386992.00 395853.91 303103.34 0.00 1348066.12 1050173.88 572799.75 918625.56 913599.69 508744.34 459309.22 477979.34 447361.75 619685.31 494975.38 825114.94 923010.19 823121.31 821392.44 813931.00 779367.81 1205793.50 1304601.75 1272924.50 795242.69 932297.06 731877.69 645131.12 715101.00 1043586.81 1386267.88 1343262.88 1351933.00 1486362.38 1439483.62 1372205.00 898973.56 991077.00 1150555.38 512216.09 553106.81 514302.09 936667.00 1071637.88 1108359.12 289214.62 256417.62 237192.48 335345.66 413171.97 373332.53 389217.22 428905.22 414215.66 283848.28 288733.66 354721.75 592279.19 470939.75 627922.81 314223.16 275475.38 304778.50 499442.66 376960.25 359749.66 584526.50 662053.06 586634.00 419542.97 342891.16 411417.59 750850.81 614220.19 558379.44 Serine 216893.56 283752.47 210045.81 283899.53 229488.45 279471.91 290244.31 286004.00 261490.20 169516.11 155728.27 164971.81 261751.27 259992.36 262926.78 435734.88 393531.72 391093.38 132200.52 128513.60 136175.08 288014.88 280834.75 270567.34 311389.88 291613.97 304118.28 217239.19 200901.77 194220.80 283622.16 285344.66 294506.09 368029.38 301771.78 345605.47 1598.93 289872.69 220889.56 268531.25 344170.84 373449.75 356507.84 333083.78 381049.16 144589.83 167492.55 166094.17 490814.91 505527.66 480996.91 454274.50 515894.50 547493.19 177315.30 161959.83 190433.80 256847.30 264141.12 280233.72 91631.12 76165.26 98985.12 394634.50 397495.78 455450.84 375073.88 410051.66 419327.25 137374.77 119254.41 157267.62 171438.86 180510.92 186310.92 435671.38 416733.16 482997.12 291394.00 285239.53 322787.72 121490.46 109629.50 150558.38 318479.03 319105.03 362990.50 316304.50 328389.97 390517.34 158536.17 147302.44 176133.62 155387.41 145701.95 179878.17 62099.72 64140.64 448763.59 526335.69 472256.25 503464.84 423761.41 366086.84 420297.34 276984.06 205005.94 253745.81 Taurine 5846004.50 6952198.00 6378016.00 4399928.00 4043560.00 4257647.00 2626894.25 2640885.75 2259182.25 7403218.50 7598140.00 7674563.50 10362160.00 10725818.00 10397041.00 4428000.50 4248395.00 4230200.50 7357855.50 7655774.00 8105302.50 3886629.25 3806715.25 3364474.25 9947423.00 9987675.00 9577091.00 10567680.00 9639884.00 9437463.00 6434618.00 7082214.50 7363492.00 8766771.00 9509583.00 10080605.00 23523.47 8132762.00 7945806.50 3569440.75 4301370.50 5343757.00 2660930.25 2499923.00 2808952.75 7494962.50 8299658.50 8913348.00 11236576.00 10071187.00 11797740.00 4916546.00 4517436.50 5160646.50 8601672.00 8753612.00 9864713.00 3601398.25 3497237.75 4169369.75 10859797.00 11561359.00 12366425.00 12946173.00 13858905.00 13642785.00 10788119.00 11581584.00 12303792.00 10534665.00 11761359.00 12497696.00 7989052.50 7469076.50 8497191.00 3980554.00 3757414.25 5034058.00 3225508.75 2912315.25 3932222.25 7456408.50 8004567.50 10072843.00 9441716.00 9448571.00 11451473.00 2681672.75 2414487.25 3340428.75 8616547.00 8968209.00 8544623.00 2707020.25 2300274.00 2676548.75 10293204.00 10206011.00 10561836.00 10952343.00 10838375.00 11727891.00 11037514.00 11182461.00 11817199.00 10508376.00 10542961.00 11325391.00 Thiamine 108896.46 113474.21 70625.35 123570.79 81206.70 74533.92 104526.51 111760.38 125035.97 51438.94 59039.02 48967.66 59739.83 55167.36 74203.55 155589.11 170470.86 148297.70 208028.36 137634.98 178336.70 138872.70 117271.75 139279.22 192202.86 215826.64 235379.62 160859.34 170153.80 187521.67 156683.14 150995.12 177186.30 53197.29 63507.28 68689.37 0.00 181438.95 228497.00 161829.42 147702.50 146151.33 217682.17 184664.95 236201.23 181889.00 185103.58 167750.70 258062.89 282776.97 269603.78 495344.91 443515.62 420599.50 514919.34 323165.12 354573.00 377377.28 255217.95 230402.08 504561.28 425831.47 404679.34 488156.47 307855.31 321038.91 497157.91 415428.34 370774.41 213656.55 250930.75 202621.08 197260.62 245999.27 223350.64 343339.00 234858.94 136061.73 354933.84 276422.34 264435.28 184653.44 192218.83 165970.86 188856.36 177825.14 229030.56 249239.88 240191.62 236200.75 117164.99 116237.49 145719.89 170278.42 122959.31 144020.42 193448.95 166442.14 161300.77 393061.12 329475.25 289830.59 361072.47 368594.16 408436.28 294194.94 195706.50 159370.92 Thiamine pyrophosphate 14818.33 19256.83 17216.21 8750.80 9011.39 8821.94 5869.54 7089.06 4524.25 13486.27 13436.59 10539.88 15659.40 17473.04 11619.93 21577.94 16913.59 17467.45 14677.27 15440.42 18959.32 10653.81 9302.52 12438.68 16710.93 12805.74 14824.05 6884.57 6672.18 6625.05 5604.59 7218.44 4089.23 7760.93 7305.05 7507.30 0.00 42715.66 33134.06 8776.18 12337.17 13254.92 7043.45 8407.28 7364.35 23669.52 22086.96 25793.21 23946.52 21758.51 22096.11 27803.88 28381.32 34112.32 26004.06 21893.97 28616.89 19069.22 23107.32 18409.21 22274.55 23792.83 28939.29 22233.37 22272.35 20419.13 17003.51 20749.75 22294.89 20669.83 22846.25 25061.93 26716.55 24398.47 22462.79 11875.13 11990.25 13325.58 19610.72 15984.57 18555.58 19867.58 27539.18 28284.77 10812.06 10616.32 11088.59 18069.80 16859.55 18625.20 17339.46 15181.86 16321.02 15429.37 15187.79 15682.83 23964.95 24596.62 23469.19 18680.46 18992.36 19851.18 21191.25 20587.80 16429.35 37163.93 28684.45 26318.18 Threonine 227526.64 247825.38 227527.67 195137.92 166687.91 205853.14 200129.73 247293.88 211123.39 135329.80 139564.58 142438.98 195033.17 211900.08 207406.94 387881.75 360543.84 372787.03 192616.17 176494.95 204786.92 307715.50 335270.75 286132.16 208108.02 215053.20 192160.83 128450.34 117916.98 132727.23 132346.19 136450.83 135031.33 169059.81 168112.11 176858.92 7366.92 428149.75 332588.84 206719.75 264124.84 269591.91 326151.03 300425.41 311294.12 177574.64 233607.67 203451.70 402347.00 402123.59 402875.97 526418.06 460158.88 497291.12 262002.62 290991.75 313157.47 272870.53 289462.00 303816.69 191371.58 194406.81 263158.72 283500.53 262878.62 292419.97 421633.34 409203.25 431469.78 338648.72 320154.12 372244.84 257430.56 265966.75 280789.53 276469.59 303379.59 334744.41 248643.05 227405.14 289992.91 160005.92 162589.38 199651.94 242185.95 240213.50 282009.50 280928.16 257675.88 332156.91 222479.42 263674.22 211236.20 132520.39 148285.94 172320.88 225288.19 223258.14 298719.03 211873.30 186903.38 191696.14 386639.75 366243.03 445312.91 307931.22 223836.52 294566.91 Trigonelline 8278.39 6668.69 7123.35 8864.21 4695.52 5045.65 4535.10 5874.21 8822.12 10527.81 5743.55 11072.71 8057.23 6939.13 6242.75 11580.61 9338.79 11358.20 11390.99 9898.58 10754.26 9948.50 10090.92 8497.70 20469.35 19867.03 14470.67 14524.06 9227.47 13681.20 5518.22 9009.76 10772.07 7176.43 8432.88 13176.86 6992.46 13910.97 14216.32 10731.14 8036.97 8162.76 10357.37 8448.67 9422.11 7668.93 9483.40 7760.70 6567.98 12935.94 10898.11 12190.52 12124.98 14180.79 13372.89 14412.58 12117.34 14113.06 13282.17 16211.34 22295.11 34314.28 35858.85 29730.40 33274.52 25546.18 24704.98 24894.65 36871.70 18988.25 19986.23 19575.39 13112.02 16270.51 12465.33 10194.09 13691.80 11165.97 10298.17 11630.97 18187.18 11944.85 15929.28 6235.48 9833.11 13350.09 8114.03 12478.36 11720.52 11918.28 15546.75 20770.91 15808.34 13239.46 9260.72 15278.86 41109.84 34221.45 42771.36 38265.45 25508.87 32818.95 33458.69 28289.60 32120.60 20929.65 12625.80 20297.61 Tryptophan 250836.83 311850.31 258554.95 183801.94 159302.08 215444.20 193976.45 207450.48 174461.62 119788.04 135391.80 125640.09 239056.31 229918.69 231020.73 358831.66 333972.25 321252.88 238336.36 238707.62 243802.95 332692.66 349293.84 283005.72 107610.30 114370.62 122070.90 117753.52 118524.13 115784.29 121882.09 105506.84 122318.99 134185.45 119970.06 127422.05 0.00 666319.50 553877.06 227343.58 274182.38 289555.78 294522.66 275608.00 281943.41 214342.70 236100.31 240992.38 536471.31 542599.75 566668.81 516750.88 480438.41 557736.94 398815.66 429572.97 468074.62 408085.62 428900.59 433093.12 112140.03 116503.60 152295.67 412751.53 447242.88 459418.84 498728.75 459118.34 497839.47 264481.12 242962.05 294797.72 575577.94 550894.56 579837.25 480103.22 503628.00 540947.00 494776.91 453179.00 533475.81 238763.05 266169.53 259577.20 505099.34 446416.75 501162.78 383580.09 372919.25 409796.34 450631.09 464600.09 417695.59 278687.59 280250.34 331150.78 160678.42 163476.55 284400.38 408514.03 378967.91 435014.66 662219.81 596855.81 658451.69 458660.00 313346.91 386950.00 Tyrosine 726119.75 915352.50 765332.44 527053.62 468414.00 587929.69 592831.44 623115.00 561763.69 332037.72 390751.41 358212.47 723256.81 616717.56 632902.81 1038142.50 920060.94 931259.50 735223.06 706629.69 677911.56 972215.19 1087651.25 928420.69 399572.16 441055.59 441739.59 371946.59 385325.84 401035.00 365049.12 398734.91 347877.88 452387.72 447568.25 384504.59 7004.95 1633781.12 1358578.62 581519.44 779962.56 745312.25 776025.81 708262.31 703545.69 510491.59 537858.50 604297.31 1271684.62 1353969.62 1334039.75 1281736.12 1301620.12 1474993.88 989358.19 974423.06 1113543.88 1002096.31 1134492.12 1029058.81 440958.38 450969.84 614882.00 2048450.38 1849601.00 2067398.38 2213201.25 2131841.00 2292938.75 1371205.50 1123988.88 1593866.62 1254871.62 1203590.62 1304159.88 1044080.25 1086784.88 1175618.62 1168077.50 1038274.69 1245723.62 635939.38 628739.44 654642.94 1039937.00 1027350.56 1167806.88 916832.81 971667.00 1118201.12 1009746.31 1015760.81 991281.50 731385.94 708170.44 819840.50 847481.00 951064.56 1685296.62 2170087.25 1943049.00 2253565.75 3068422.00 2858215.25 3206659.25 2681168.25 1991020.38 2491540.75 UDP 22038.76 28454.01 21222.96 15759.42 20370.19 19307.40 15475.66 14129.62 13671.15 21910.06 17403.35 17424.33 25370.37 21605.64 22685.05 20113.53 18536.85 21817.91 15451.78 16320.87 17655.42 14286.11 12701.39 21481.27 49094.29 47193.00 48838.48 16347.07 17265.22 17433.93 21697.43 25217.91 28714.71 38579.58 49557.58 54234.40 0.00 18925.99 12225.94 15118.59 16252.70 17666.06 13192.05 13116.13 12759.43 19334.78 20536.29 18140.34 17111.96 17872.53 14935.00 15944.60 17716.01 17806.21 10340.48 9709.47 8340.70 11685.51 13637.68 12720.05 72382.77 69495.35 64531.57 42354.68 49750.60 44805.38 55874.62 56296.44 57604.05 100425.66 101569.82 107506.63 9743.74 11240.21 7477.95 4668.04 4490.38 5938.55 7866.57 6514.84 7182.29 11222.41 14423.72 14358.16 4295.92 3986.01 5238.03 4993.59 7767.05 8155.09 4773.86 5907.99 3623.68 11509.68 11102.30 11759.51 57032.72 62673.66 58407.54 23327.04 27065.70 25203.11 52331.16 57839.92 55745.07 114029.71 77343.02 79350.16 UDP-Glucose 6977.00 11764.02 10722.55 9222.65 9131.47 13789.93 6656.55 8595.99 6393.68 15377.67 15917.52 12559.06 11171.90 11257.22 10754.31 5951.16 11645.36 9600.27 7029.60 6901.90 8707.57 8942.51 7190.06 8350.69 19133.42 19195.31 19687.88 16074.77 19945.01 18853.75 15202.58 17786.75 15680.08 16948.58 20952.24 21620.57 0.00 5613.48 4325.09 7801.02 6565.35 10223.86 5922.65 7092.37 6080.52 10451.21 13097.44 13738.71 5988.17 5201.88 5161.98 6191.84 7539.50 7253.19 3543.91 6302.05 3756.91 3710.23 3171.49 5769.68 30529.45 27822.51 26268.70 38211.52 36110.95 37459.28 43342.93 48920.83 47801.68 27966.09 33121.67 35668.37 2146.60 3091.61 1956.98 723.02 833.05 1044.12 1653.67 3357.89 2178.31 2548.36 6735.41 4936.35 987.41 944.25 0.00 896.70 1165.67 1075.22 1033.63 989.96 1020.24 1239.49 1399.99 2681.01 23363.66 21236.13 20592.32 21600.55 26333.82 17260.37 31649.33 34225.38 33637.70 36061.23 27271.03 25844.84 UDP-N-acetylgalactosamine 311888.53 413551.59 324075.09 209893.77 195551.73 213087.58 148773.58 143456.83 120370.43 249885.12 249187.39 247209.52 370311.22 340454.88 330400.44 257477.00 228569.80 256164.75 189798.73 206301.31 212458.12 211021.30 189379.55 187816.06 659540.62 647038.38 585990.75 271981.53 289672.50 290989.47 257893.36 295848.09 313037.22 387607.88 454841.97 443800.75 0.00 372052.47 178537.81 141643.08 167920.25 185679.55 118278.84 112650.62 118934.66 259854.88 291877.72 292052.59 652879.69 596099.81 575134.00 199152.42 204779.61 219968.50 282061.53 322933.34 339337.12 180910.23 209046.45 190266.30 850224.81 919855.19 902580.31 777872.06 812507.31 776793.19 1126987.88 1150539.00 1137873.62 890460.25 959912.00 1108863.38 84556.74 84896.42 67616.73 48735.42 43457.66 46895.79 107761.01 97020.09 96122.65 111365.29 191500.20 112746.28 54779.81 53390.82 44578.32 78160.90 71987.96 83541.97 96976.49 97118.34 118481.79 78321.96 76841.16 73740.34 851609.06 940647.81 854769.06 758800.06 717326.69 687890.06 1704882.50 1646426.00 1769087.38 1531085.38 1230626.25 1278189.50 UMP 3337.96 5584.33 5103.01 5764.20 4307.16 6650.19 5525.36 5160.68 4689.39 7732.45 9270.58 4607.98 2483.65 2895.57 3982.59 5849.81 5041.92 6405.45 5425.64 5364.10 6217.63 4050.66 3313.01 6268.69 9086.29 8311.45 9011.92 2170.03 4796.98 4245.33 7286.74 7853.21 6973.64 7261.35 7157.13 8653.29 0.00 10566.84 6072.21 7690.57 7378.20 7853.47 4324.12 6509.57 5224.55 3762.95 7273.63 6607.97 2699.83 4369.08 2722.29 3982.48 7145.76 7343.95 2857.34 1961.16 2013.08 1430.72 5419.83 5250.35 9242.34 7304.60 9484.92 5022.58 6066.32 6543.86 11413.92 11165.58 8940.04 10672.21 11045.25 11587.70 2809.16 1760.66 2499.22 1334.63 3524.42 4886.66 2517.42 3568.77 4287.28 8123.28 7890.71 9472.30 3298.01 2638.23 4512.55 4860.40 4506.20 3541.13 3494.62 5416.24 3500.96 4376.33 3898.20 4283.35 11061.57 9179.11 15078.26 3440.61 1378.24 1099.75 1912.13 3292.17 4292.12 9301.43 6127.52 4829.55 UTP 48915.64 78561.75 43175.03 53973.25 34873.34 48114.25 52621.84 49214.84 38844.18 53668.05 43159.31 29296.15 44793.60 43366.86 40177.22 55656.28 67038.43 56453.39 51620.57 47749.25 53197.91 45082.79 43543.26 54455.36 220372.08 214271.77 222646.45 81804.66 102302.15 95553.30 82991.01 95382.48 114659.35 116223.05 135159.36 160081.47 0.00 31411.96 19246.12 34383.87 28466.79 30826.06 36405.74 28084.82 27160.16 33933.49 28286.67 35752.26 16465.53 16599.72 11216.27 34273.06 35023.77 40550.49 20610.03 19055.05 19520.83 25235.56 23874.29 20317.12 255176.30 205656.75 175303.98 180368.20 223578.50 190061.48 237045.00 259131.42 270813.03 158538.61 227907.70 185235.95 14273.82 19344.42 13384.07 5800.54 4750.82 4483.11 18756.29 14733.34 11938.25 14070.14 22963.46 15541.95 3534.89 3299.59 3600.85 8905.37 12372.07 11279.90 5801.57 5923.95 6844.46 18262.07 18110.46 14903.40 202276.42 220972.89 202406.75 139640.25 140015.55 143676.94 182197.48 183794.81 170159.12 335276.62 189950.67 203322.33 Urocanate 65728.62 35824.08 28180.63 51387.11 33667.97 48772.66 29102.98 50629.53 47946.49 37470.99 44694.03 22412.06 61736.42 57973.73 90273.49 57581.64 67891.99 76560.19 69083.26 47792.78 64410.48 42437.80 28823.32 34803.75 42222.43 57260.06 55689.88 55563.86 52081.39 167680.42 111368.00 49279.04 44710.69 38426.73 34819.31 50178.27 7408.03 334938.75 133931.50 85229.56 131865.95 91425.44 206392.45 180153.92 91848.35 102601.63 182455.98 119436.25 203935.52 346550.97 87330.80 127125.84 2648326.75 197895.00 161529.61 117438.60 95464.12 125250.94 184583.45 81751.79 149111.45 134655.02 135892.69 320256.16 91030.52 212770.80 162322.80 160338.52 89982.71 228766.00 289153.09 94040.38 102673.34 92150.60 110051.48 96088.02 98239.32 84854.18 76973.52 65331.40 143772.33 104607.88 68726.16 284651.25 101040.59 97789.09 107516.52 85397.38 76718.52 57221.99 884676.19 183754.81 124580.38 135148.56 106302.90 76175.38 169231.80 399411.75 19273670.00 529861.81 146325.89 89958.94 183695.20 71952.97 72330.44 83035.64 136981.80 212267.58 dAMP 12401.87 40950.03 27997.98 10790.69 8988.83 22659.06 5165.79 3963.29 3261.54 11703.31 14577.18 11897.04 36755.44 33921.30 31008.14 40655.71 18789.63 11631.10 12003.78 17250.51 19551.40 11203.96 23440.02 10542.39 9682.70 8157.95 19487.99 9167.60 9790.98 9700.46 6781.22 13377.67 12116.57 4265.23 12617.57 10915.80 0.00 42136.19 24598.42 5426.38 16371.78 9596.18 3151.08 3660.32 2587.25 10357.13 14431.13 13086.35 18339.39 16175.58 19638.66 28440.47 11935.33 25295.99 7818.24 12402.57 4586.13 8004.43 13623.98 6847.50 24007.26 11467.63 2620.45 24775.98 13735.32 10601.00 67528.77 53539.49 4510.92 34050.11 42317.61 18707.23 7339.38 6750.63 22666.13 7776.17 11203.82 9290.46 5947.31 4563.09 14591.54 24055.62 15440.41 22216.30 10455.45 8192.42 17291.34 5230.36 8224.68 11897.78 10632.00 6384.04 8242.09 13808.18 12241.32 12764.49 17566.71 10629.29 9055.07 9933.99 6208.88 5449.84 20957.14 20140.13 53443.41 12946.01 9414.21 10768.95 dATP 3328.95 2455.38 2213.30 3796.92 3325.69 2665.29 3143.89 1644.18 1443.79 4073.56 2090.75 3203.65 1828.82 3216.20 2753.85 3035.12 5031.15 2882.20 3408.25 4166.40 4886.32 4540.20 6263.56 7269.25 1953.65 1631.97 1607.42 5004.38 2044.74 5344.38 5799.32 2707.71 3407.30 6845.81 7800.96 7766.03 0.00 1941.38 2028.40 2510.13 5045.85 2627.79 1803.00 1371.95 1830.01 1356.40 1015.09 788.98 3872.96 2372.64 1391.87 4003.89 5522.19 3218.24 2475.87 2099.59 3419.51 2010.62 2827.27 1547.84 2273.99 4326.63 1819.82 4240.33 3591.13 3555.70 9181.34 12064.76 16395.71 11008.05 8713.45 5195.73 0.00 850.57 862.63 988.29 878.70 0.00 1394.06 1233.73 1062.95 772.50 883.28 0.00 0.00 0.00 0.00 1050.38 1925.85 1404.07 1647.36 1151.62 974.63 1554.12 1675.34 1544.56 1026.41 1225.92 1015.03 0.00 0.00 0.00 2520.79 3783.66 4039.72 3822.53 4434.26 3132.24 dGDP 8400.13 11179.51 10521.70 8252.42 9320.25 8772.13 7921.29 6685.54 7876.53 7643.68 6487.20 7246.53 10773.53 11281.75 9325.74 13309.89 9023.53 11994.05 12703.46 11791.49 10665.17 13913.89 13933.76 11352.61 12182.62 13051.89 14945.29 9655.50 10065.66 10884.33 7670.40 9307.00 12030.97 8982.70 7393.96 9148.86 1215.62 20165.78 14620.42 8164.69 8941.89 11142.54 9800.58 10136.83 9875.04 12396.75 15849.50 11476.57 15167.77 16965.33 13805.28 16823.55 16550.56 17482.17 14058.32 15065.22 14866.57 15616.77 14803.23 11236.54 15645.66 20609.70 18401.93 16580.96 19695.44 17423.83 16948.78 15309.36 16843.39 14607.75 16707.81 16999.62 9944.07 13745.37 9946.43 8603.03 10265.44 10108.42 12695.96 11876.04 12509.47 13773.09 16865.57 13185.95 7956.91 6027.68 7017.85 10967.13 8951.39 11873.52 14284.57 9232.07 10423.75 12217.48 14336.90 10985.79 18709.25 19204.63 15677.48 16382.42 18853.77 23818.91 17582.34 17731.43 23298.62 22680.74 15891.09 18623.85 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name medMz medRt 1-Aminocyclopropanecarboxylate 102.055 6.05 2 3-cAMP 330.058 4.427 2 4-Diaminobutyrate 119.081 10.535 2 6-Diaminopimelic acid 191.102 10.579 2-Aminoadipic acid 162.075 8.825 2-Aminoethylphosphonate 126.031 10.507 2-Aminoisobutyrate 104.070 6.004 2-Aminophenol 110.060 0.987 2-Deoxyadenosine 252.108 2.371 2-Hydroxypyridine 96.044 2.098 3-Methyl-2-oxovalerate 131.070 1.782 3-Methyladenine 150.077 2.464 3-Phosphoglycerate 186.999 10.188 3-hydroxybutanone 89.060 7.626 3-methyl-histidine 170.091 7.669 4-Acetamidobutyrate 146.081 4.631 4-Aminobutyrate (GABA) 104.070 7.605 4-Guanidinobutyrate 146.091 6.952 4-Hydroxy-3-methoxyphenylglycol 185.080 1.944 4-Imidazoleacetate 127.050 5.925 4-Quinolinecarboxylate 174.054 2.481 5-Aminolevulinate 132.065 6.687 5-Deoxy-5-(methylthio)adenosine 298.095 1.983 5-Deoxyadenosine 252.108 2.116 5-Hydroxylysine 163.107 13.068 7 8-Dihydro-L-biopterin 240.108 4.746 ADP 428.035 10.019 ADP-Glucose 590.088 9.304 ADP-ribose 560.077 9.072 AMP 348.069 9.282 ATP 508.002 11.304 Acetyl CoA 810.130 8.928 Acetylcholine 146.117 3.519 Acetylputrescine 131.117 5.862 Adenine 136.061 2.551 Adenosine 268.103 2.743 Alanine 90.055 6.665 Anthranilate 138.054 1.571 Arginine 175.118 12.429 Asparagine 133.060 7.693 Aspartate 134.044 8.692 Beta-Alanine 90.055 7.268 Betaine 118.086 4.904 Biotin 245.094 4.122 Butyrate 89.060 7.032 CDP 404.024 10.992 CDP-choline 489.113 9.737 CDP-ethanolamine 447.066 9.826 CMP 324.058 9.996 CTP 483.991 12.664 Carnitine 162.112 6.931 Choline 104.107 5.331 Citrulline 176.102 8.097 Coenzyme A 768.119 9.278 Creatine 132.076 6.645 Creatine phosphate 212.042 9.572 Creatinine 114.066 2.835 Cystathionine 223.074 10.029 Cysteinesulfinic acid 154.017 7.797 Cystine 241.031 9.486 Cytidine 244.092 4.044 Cytosine 112.050 3.223 D-Glyceraldehyde-3-phosphate 171.005 9.819 Deoxycarnitine 146.117 7.629 Deoxycytidine 228.097 3.254 Diethanolamine 106.086 5.792 Dihydroxyacetone phosphate 171.005 9.36 Dimethyl-arginine 203.150 10.901 FAD 786.162 8.354 Folic acid 442.146 9.254 GDP 444.031 11.332 GDP-Mannose 606.082 10.434 GMP 364.064 10.136 GTP 523.996 13.22 Glucose 6-phosphate 261.036 10.551 Glutamate 148.060 8.533 Glutamine 147.076 7.465 Glutaryl-carnitine 276.143 8.662 Glutathione 308.090 8.609 Glycerol 3-phosphate 173.020 9.355 Guanidineacetic acid 118.061 6.76 Guanine 152.056 3.418 Guanosine 284.097 4.287 Hippuric acid 180.066 2.221 Histidine 156.076 8.639 Homocysteic acid 184.027 7.774 Homocystine 269.062 8.534 Hypotaurine 110.027 6.684 Hypoxanthine 137.045 2.825 IMP 349.053 9.674 ITP 508.988 13.119 Isoleucine 132.101 4.406 Kynurenine 209.091 3.641 Lactose 343.123 8.498 Lauroyl-carnitine 344.278 2.003 Leucine 132.101 4.03 Lysine 147.112 13.117 Methionine 150.058 4.557 Methylnicotinamide 137.070 5.621 N N N-Trimethyllysine 189.159 13.413 N-Acetyl-Galactosamine 222.097 4.665 N-Acetyl-Serotonin 219.112 1.334 N-Acetyl-glutamate 190.070 8.195 N-Acetyl-lysine 189.122 8.14 N-Acetyl-methionine 192.068 2.789 N-Acetyl-proline 158.081 4.565 N-Acetyl-serine 148.060 4.657 N-Acetylglycine 118.049 4.89 N-Acetylneuraminic acid 310.112 7.754 NAD 664.114 9.488 NADH 666.130 8.542 NADP 744.080 11.753 NADPH 746.096 10.399 NMN 335.062 10.38 Nicotinamide 123.055 1.987 O-Acetyl-L-carnitine 204.122 5.578 O-Phospho-serine 186.015 10.368 O-Phosphorylethanolamine 142.026 10.344 O-Succinyl-L-homoserine 220.081 7.834 Ophthalmate 290.133 8.549 Ornithine 133.096 12.512 Oxaloacetate 133.012 7.675 Palmitoyl-carnitine 400.340 1.981 Pantothenate 220.117 4.322 Phenylacetaldehyde 121.064 1.241 Phenylalanine 166.085 3.632 Phenylethanolamine 138.091 1.984 Phosphocholine 184.072 10.979 Phosphoenolpyruvate 168.989 9.893 Pipecolate 130.085 5.606 Proline 116.070 5.824 Pyridoxal 168.065 2.706 Pyridoxal 5-phosphate 248.031 9.476 Pyridoxine 170.080 2.414 Pyroglutamate 130.049 4.731 Retinal 285.220 1.184 Riboflavin 377.144 2.777 Ribose 5-phosphate 231.026 9.796 Ribulose-5-phosphate 231.026 9.476 S-Adenosyl-homocysteine 385.128 7.547 S-Adenosylmethionine 399.144 10.91 Serine 106.050 7.672 Taurine 126.021 5.506 Thiamine 265.111 6.087 Thiamine pyrophosphate 425.043 12.53 Threonine 120.065 6.959 Trigonelline 138.054 5.487 Tryptophan 205.096 3.454 Tyrosine 182.080 5.099 UDP 405.008 10.416 UDP-Glucose 567.061 9.592 UDP-N-acetylgalactosamine 608.086 9.337 UMP 325.042 9.5 UTP 484.975 11.884 Urocanate 139.049 4.544 dAMP 332.076 8.602 dATP 492.007 10.892 dGDP 428.035 11.354 METABOLITES_END #END