#METABOLOMICS WORKBENCH micaelaroy_20211227_121435 DATATRACK_ID:3008 STUDY_ID:ST002032 ANALYSIS_ID:AN003303 PROJECT_ID:PR001288 VERSION 1 CREATED_ON January 3, 2022, 7:50 am #PROJECT PR:PROJECT_TITLE Irradiation causes alterations of polyamine, purine and sulfur metabolism in red PR:PROJECT_TITLE blood cells and multiple organs PR:PROJECT_SUMMARY Investigating the metabolic effects of radiation is critical to understand the PR:PROJECT_SUMMARY impact of radiotherapy (e.g., for bone marrow irradiation prior to hematopoietic PR:PROJECT_SUMMARY stem cell transplantation in the clinic or in laboratory studies), space travel, PR:PROJECT_SUMMARY and exposure to environmental radiation. In patients undergoing hemopoietic stem PR:PROJECT_SUMMARY cell transplantation, iron overload is a common risk factor for poor outcomes. PR:PROJECT_SUMMARY Previous studies assert that both irradiation and iron independently modulate PR:PROJECT_SUMMARY tryptophan and indole metabolism of the microbiome, which may in turn impact PR:PROJECT_SUMMARY host immune response. However, no studies have interrogated the multi-organ PR:PROJECT_SUMMARY effects of these treatments concurrently. Herein, we use a model that PR:PROJECT_SUMMARY recapitulate transfusional iron overload, a condition often observed in PR:PROJECT_SUMMARY chronically transfused patients with thalassemia, sickle cell disease, or PR:PROJECT_SUMMARY myelodysplastic syndrome. We applied an omics approach to investigate the impact PR:PROJECT_SUMMARY of both iron load and irradiation on the host metabolome. Our results revealed PR:PROJECT_SUMMARY dose-dependent effects of irradiation in red blood cells (RBC), plasma, spleen, PR:PROJECT_SUMMARY and liver energy and redox metabolism. Increases in polyamines and purine PR:PROJECT_SUMMARY salvage metabolites were observed in organs with high oxygen consumption PR:PROJECT_SUMMARY including the heart, kidney, and brain. Irradiation also impacted the metabolism PR:PROJECT_SUMMARY of the duodenum, colon, and stool, suggesting a potential effect on the PR:PROJECT_SUMMARY microbiome. Iron infusion affected the respose to radiation in the organs and PR:PROJECT_SUMMARY blood, especially in RBC polyamine metabolism and spleen antioxidant metabolism, PR:PROJECT_SUMMARY and affected glucose, sulfur (especially methionine and glutathione systems) and PR:PROJECT_SUMMARY tryptophan metabolism in the liver, stool, and brain. Together, the results PR:PROJECT_SUMMARY suggest that radiation impacts metabolism on a multi-organ level with a PR:PROJECT_SUMMARY significant interaction of host iron status. PR:INSTITUTE University of Colorado Anschutz School of Medicine PR:LAST_NAME Roy PR:FIRST_NAME Micaela PR:ADDRESS 1635 Aurora Ct, Aurora, CO, 80045, USA PR:EMAIL micaela.roy@cuanschutz.edu PR:PHONE 303-724-3339 #STUDY ST:STUDY_TITLE Irradiation causes alterations of polyamine, purine and sulfur metabolism in red ST:STUDY_TITLE blood cells and multiple organs (Blood plasma) ST:STUDY_SUMMARY Investigating the metabolic effects of radiation is critical to understand the ST:STUDY_SUMMARY impact of radiotherapy (e.g., for bone marrow irradiation prior to hematopoietic ST:STUDY_SUMMARY stem cell transplantation in the clinic or in laboratory studies), space travel, ST:STUDY_SUMMARY and exposure to environmental radiation. In patients undergoing hemopoietic stem ST:STUDY_SUMMARY cell transplantation, iron overload is a common risk factor for poor outcomes. ST:STUDY_SUMMARY Previous studies assert that both irradiation and iron independently modulate ST:STUDY_SUMMARY tryptophan and indole metabolism of the microbiome, which may in turn impact ST:STUDY_SUMMARY host immune response. However, no studies have interrogated the multi-organ ST:STUDY_SUMMARY effects of these treatments concurrently. Herein, we use a model that ST:STUDY_SUMMARY recapitulate transfusional iron overload, a condition often observed in ST:STUDY_SUMMARY chronically transfused patients with thalassemia, sickle cell disease, or ST:STUDY_SUMMARY myelodysplastic syndrome. We applied an omics approach to investigate the impact ST:STUDY_SUMMARY of both iron load and irradiation on the host metabolome. Our results revealed ST:STUDY_SUMMARY dose-dependent effects of irradiation in red blood cells (RBC), plasma, spleen, ST:STUDY_SUMMARY and liver energy and redox metabolism. Increases in polyamines and purine ST:STUDY_SUMMARY salvage metabolites were observed in organs with high oxygen consumption ST:STUDY_SUMMARY including the heart, kidney, and brain. Irradiation also impacted the metabolism ST:STUDY_SUMMARY of the duodenum, colon, and stool, suggesting a potential effect on the ST:STUDY_SUMMARY microbiome. Iron infusion affected the respose to radiation in the organs and ST:STUDY_SUMMARY blood, especially in RBC polyamine metabolism and spleen antioxidant metabolism, ST:STUDY_SUMMARY and affected glucose, sulfur (especially methionine and glutathione systems) and ST:STUDY_SUMMARY tryptophan metabolism in the liver, stool, and brain. Together, the results ST:STUDY_SUMMARY suggest that radiation impacts metabolism on a multi-organ level with a ST:STUDY_SUMMARY significant interaction of host iron status. ST:INSTITUTE University of Colorado Anschutz School of Medicine ST:LAST_NAME Roy ST:FIRST_NAME Micaela ST:ADDRESS 1635 Aurora Ct, Aurora, CO, 80045, USA ST:EMAIL micaela.roy@cuanschutz.edu ST:PHONE 303-724-3339 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 #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 - 1 Treatment:Saline | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-1 SUBJECT_SAMPLE_FACTORS - 2 Treatment:Saline | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-2 SUBJECT_SAMPLE_FACTORS - 3 Treatment:Saline | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-3 SUBJECT_SAMPLE_FACTORS - 4 Treatment:Saline | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-4 SUBJECT_SAMPLE_FACTORS - 6 Treatment:IV iron | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-5 SUBJECT_SAMPLE_FACTORS - 7 Treatment:IV iron | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-6 SUBJECT_SAMPLE_FACTORS - 8 Treatment:IV iron | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-7 SUBJECT_SAMPLE_FACTORS - 9 Treatment:IV iron | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-8 SUBJECT_SAMPLE_FACTORS - 10 Treatment:IV iron | Radiation Dose:no irradiated RAW_FILE_NAME=AM3-9 SUBJECT_SAMPLE_FACTORS - 11 Treatment:Saline | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-10 SUBJECT_SAMPLE_FACTORS - 13 Treatment:Saline | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-11 SUBJECT_SAMPLE_FACTORS - 14 Treatment:Saline | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-12 SUBJECT_SAMPLE_FACTORS - 15 Treatment:Saline | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-13 SUBJECT_SAMPLE_FACTORS - 16 Treatment:IV iron | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-14 SUBJECT_SAMPLE_FACTORS - 17 Treatment:IV iron | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-15 SUBJECT_SAMPLE_FACTORS - 18 Treatment:IV iron | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-16 SUBJECT_SAMPLE_FACTORS - 19 Treatment:IV iron | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-17 SUBJECT_SAMPLE_FACTORS - 20 Treatment:IV iron | Radiation Dose:Gy7 RAW_FILE_NAME=AM3-18 SUBJECT_SAMPLE_FACTORS - 21 Treatment:Saline | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-19 SUBJECT_SAMPLE_FACTORS - 22 Treatment:Saline | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-20 SUBJECT_SAMPLE_FACTORS - 23 Treatment:Saline | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-21 SUBJECT_SAMPLE_FACTORS - 24 Treatment:Saline | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-22 SUBJECT_SAMPLE_FACTORS - 25 Treatment:Saline | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-23 SUBJECT_SAMPLE_FACTORS - 26 Treatment:IV iron | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-24 SUBJECT_SAMPLE_FACTORS - 27 Treatment:IV iron | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-25 SUBJECT_SAMPLE_FACTORS - 28 Treatment:IV iron | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-26 SUBJECT_SAMPLE_FACTORS - 29 Treatment:IV iron | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-27 SUBJECT_SAMPLE_FACTORS - 30 Treatment:IV iron | Radiation Dose:Gy8 RAW_FILE_NAME=AM3-28 SUBJECT_SAMPLE_FACTORS - 31 Treatment:Saline | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-29 SUBJECT_SAMPLE_FACTORS - 32 Treatment:Saline | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-30 SUBJECT_SAMPLE_FACTORS - 33 Treatment:Saline | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-31 SUBJECT_SAMPLE_FACTORS - 34 Treatment:Saline | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-32 SUBJECT_SAMPLE_FACTORS - 35 Treatment:Saline | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-33 SUBJECT_SAMPLE_FACTORS - 36 Treatment:IV iron | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-34 SUBJECT_SAMPLE_FACTORS - 37 Treatment:IV iron | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-35 SUBJECT_SAMPLE_FACTORS - 38 Treatment:IV iron | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-36 SUBJECT_SAMPLE_FACTORS - 39 Treatment:IV iron | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-37 SUBJECT_SAMPLE_FACTORS - 40 Treatment:IV iron | Radiation Dose:Gy9 RAW_FILE_NAME=AM3-38 SUBJECT_SAMPLE_FACTORS - 41 Treatment:Saline | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-39 SUBJECT_SAMPLE_FACTORS - 42 Treatment:Saline | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-40 SUBJECT_SAMPLE_FACTORS - 43 Treatment:Saline | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-41 SUBJECT_SAMPLE_FACTORS - 44 Treatment:Saline | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-42 SUBJECT_SAMPLE_FACTORS - 45 Treatment:Saline | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-43 SUBJECT_SAMPLE_FACTORS - 46 Treatment:IV iron | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-44 SUBJECT_SAMPLE_FACTORS - 47 Treatment:IV iron | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-45 SUBJECT_SAMPLE_FACTORS - 48 Treatment:IV iron | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-46 SUBJECT_SAMPLE_FACTORS - 49 Treatment:IV iron | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-47 SUBJECT_SAMPLE_FACTORS - 50 Treatment:IV iron | Radiation Dose:Gy10 RAW_FILE_NAME=AM3-48 SUBJECT_SAMPLE_FACTORS - 51 Treatment:Saline | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-49 SUBJECT_SAMPLE_FACTORS - 52 Treatment:Saline | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-50 SUBJECT_SAMPLE_FACTORS - 53 Treatment:Saline | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-51 SUBJECT_SAMPLE_FACTORS - 54 Treatment:Saline | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-52 SUBJECT_SAMPLE_FACTORS - 55 Treatment:Saline | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-53 SUBJECT_SAMPLE_FACTORS - 56 Treatment:IV iron | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-54 SUBJECT_SAMPLE_FACTORS - 57 Treatment:IV iron | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-55 SUBJECT_SAMPLE_FACTORS - 58 Treatment:IV iron | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-56 SUBJECT_SAMPLE_FACTORS - 59 Treatment:IV iron | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-57 SUBJECT_SAMPLE_FACTORS - 60 Treatment:IV iron | Radiation Dose:Gy11 RAW_FILE_NAME=AM3-58 #COLLECTION CO:COLLECTION_SUMMARY At day +4 post irradiation, mice were euthanized and blood was collected by CO:COLLECTION_SUMMARY cardiac puncture in heparinized syringe. Plasma obtained after centrifugation at CO:COLLECTION_SUMMARY 4500 g for 10 minutes at +4°C CO:SAMPLE_TYPE Blood (plasma) #TREATMENT TR:TREATMENT_SUMMARY After one week of acclimatization in a pathogen-free facility, cohorts of mice TR:TREATMENT_SUMMARY were retro-orbitally infused with phosphate buffer saline (PBS) or 12.5 mg of TR:TREATMENT_SUMMARY iron dextran (Henry Shein Animal Health, Dublin, OH), twice a week for 2 weeks TR:TREATMENT_SUMMARY for a total of 50 mg of iron. After 2 days of rest, mice were then divided in TR:TREATMENT_SUMMARY groups and irradiated with 7, 8, 9, 10, 11 Gy of C-137 (n=5 per group). Total TR:TREATMENT_SUMMARY dose was split in 2 doses 3 hours apart. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY A volume of 50μl of frozen plasma was extracted in 450μl of SP:SAMPLEPREP_SUMMARY methanol:acetonitrile:water (5:3:2, v/v/v).29 After vortexing at 4°C for 30 SP:SAMPLEPREP_SUMMARY min, extracts were separated from the protein pellet by centrifugation for 10 SP:SAMPLEPREP_SUMMARY min at 10,000g at 4°C and stored at −80°C until analysis. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME Phenomenex Kinetex C18 (150 x 2.1mm, 2.6 um) #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Samples (10uL injection for cells, 20uL injection for SUPs) were introduced to MS:MS_COMMENTS the MS via electrospray ionization with the MS scanning in full MS mode (2 MS:MS_COMMENTS µscans) and ddMS2 (top15) over the range of 65-950 m/z. Technical replicates MS:MS_COMMENTS were injected every six to twelve samples to ensure instrument stability. MS:MS_COMMENTS Metabolites were manually selected integrated with Maven (Princeton University) MS:MS_COMMENTS in conjunction with the KEGG database. Peak quality was determined using blanks, MS:MS_COMMENTS technical mixes, and 13C abundance. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS peak area top MS_METABOLITE_DATA_START Samples 1 2 3 4 6 7 8 9 10 11 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 Factors Treatment:Saline | Radiation Dose:no irradiated Treatment:Saline | Radiation Dose:no irradiated Treatment:Saline | Radiation Dose:no irradiated Treatment:Saline | Radiation Dose:no irradiated Treatment:IV iron | Radiation Dose:no irradiated Treatment:IV iron | Radiation Dose:no irradiated Treatment:IV iron | Radiation Dose:no irradiated Treatment:IV iron | Radiation Dose:no irradiated Treatment:IV iron | Radiation Dose:no irradiated Treatment:Saline | Radiation Dose:Gy7 Treatment:Saline | Radiation Dose:Gy7 Treatment:Saline | Radiation Dose:Gy7 Treatment:Saline | Radiation Dose:Gy7 Treatment:IV iron | Radiation Dose:Gy7 Treatment:IV iron | Radiation Dose:Gy7 Treatment:IV iron | Radiation Dose:Gy7 Treatment:IV iron | Radiation Dose:Gy7 Treatment:IV iron | Radiation Dose:Gy7 Treatment:Saline | Radiation Dose:Gy8 Treatment:Saline | Radiation Dose:Gy8 Treatment:Saline | Radiation Dose:Gy8 Treatment:Saline | Radiation Dose:Gy8 Treatment:Saline | Radiation Dose:Gy8 Treatment:IV iron | Radiation Dose:Gy8 Treatment:IV iron | Radiation Dose:Gy8 Treatment:IV iron | Radiation Dose:Gy8 Treatment:IV iron | Radiation Dose:Gy8 Treatment:IV iron | Radiation Dose:Gy8 Treatment:Saline | Radiation Dose:Gy9 Treatment:Saline | Radiation Dose:Gy9 Treatment:Saline | Radiation Dose:Gy9 Treatment:Saline | Radiation Dose:Gy9 Treatment:Saline | Radiation Dose:Gy9 Treatment:IV iron | Radiation Dose:Gy9 Treatment:IV iron | Radiation Dose:Gy9 Treatment:IV iron | Radiation Dose:Gy9 Treatment:IV iron | Radiation Dose:Gy9 Treatment:IV iron | Radiation Dose:Gy9 Treatment:Saline | Radiation Dose:Gy10 Treatment:Saline | Radiation Dose:Gy10 Treatment:Saline | Radiation Dose:Gy10 Treatment:Saline | Radiation Dose:Gy10 Treatment:Saline | Radiation Dose:Gy10 Treatment:IV iron | Radiation Dose:Gy10 Treatment:IV iron | Radiation Dose:Gy10 Treatment:IV iron | Radiation Dose:Gy10 Treatment:IV iron | Radiation Dose:Gy10 Treatment:IV iron | Radiation Dose:Gy10 Treatment:Saline | Radiation Dose:Gy11 Treatment:Saline | Radiation Dose:Gy11 Treatment:Saline | Radiation Dose:Gy11 Treatment:Saline | Radiation Dose:Gy11 Treatment:Saline | Radiation Dose:Gy11 Treatment:IV iron | Radiation Dose:Gy11 Treatment:IV iron | Radiation Dose:Gy11 Treatment:IV iron | Radiation Dose:Gy11 Treatment:IV iron | Radiation Dose:Gy11 Treatment:IV iron | Radiation Dose:Gy11 L-alanine 2.08E+07 3.39E+07 3.55E+07 3.69E+07 2.68E+07 2.84E+07 3.10E+07 3.13E+07 3.17E+07 2.69E+07 4.46E+07 4.14E+07 1.42E+07 3.18E+07 3.49E+07 3.85E+07 3.66E+07 4.70E+07 1.70E+07 3.41E+07 2.07E+07 3.62E+07 3.71E+07 2.09E+07 3.32E+07 2.77E+07 3.12E+07 2.03E+07 2.78E+07 3.32E+07 4.07E+07 3.57E+07 4.51E+07 1.71E+07 8.94E+06 3.40E+07 3.76E+07 3.08E+07 1.96E+07 1.83E+07 3.89E+07 6.16E+07 6.15E+07 2.55E+07 2.97E+07 4.50E+07 4.40E+07 3.19E+07 3.78E+07 4.21E+07 2.45E+07 4.35E+07 3.67E+07 2.90E+07 2.50E+07 3.57E+07 4.45E+07 1.21E+07 L-arginine 7.46E+06 9.83E+06 8.95E+06 8.57E+06 4.15E+06 4.89E+06 5.79E+06 5.52E+06 4.76E+06 7.01E+06 9.29E+06 5.37E+06 2.84E+06 3.83E+06 5.42E+06 6.76E+06 6.72E+06 5.80E+06 5.97E+06 7.48E+06 5.23E+06 4.87E+06 6.59E+06 4.34E+06 4.05E+06 4.42E+06 3.92E+06 3.88E+04 7.88E+06 7.68E+06 5.50E+06 7.38E+06 7.16E+06 2.16E+06 5.28E+06 3.18E+06 4.24E+06 5.92E+06 8.18E+06 6.36E+06 6.74E+06 5.94E+06 6.82E+06 1.38E+06 6.04E+06 6.18E+06 3.54E+06 2.45E+06 7.68E+06 7.22E+06 6.37E+06 5.46E+06 6.86E+06 4.86E+06 3.48E+06 5.68E+06 4.52E+06 7.70E+06 L-asparagine 7.90E+05 1.05E+06 5.77E+05 6.78E+05 4.01E+05 3.95E+05 4.60E+05 3.89E+05 3.91E+05 3.77E+05 6.97E+05 5.96E+05 1.84E+05 3.95E+05 4.34E+05 3.87E+05 4.06E+05 5.09E+05 5.63E+05 5.39E+05 3.30E+05 4.34E+05 4.33E+05 3.03E+05 4.70E+05 3.42E+05 3.14E+05 5.47E+05 4.94E+05 4.17E+05 5.10E+05 5.84E+05 5.19E+05 3.46E+05 7.81E+05 4.73E+05 4.09E+05 3.96E+05 4.38E+05 5.13E+05 5.51E+05 9.23E+05 6.06E+05 5.42E+05 4.22E+05 5.33E+05 4.17E+05 5.32E+05 6.63E+05 7.03E+05 4.54E+05 4.26E+05 3.79E+05 5.03E+05 3.67E+05 3.73E+05 5.15E+05 8.48E+05 L-aspartate 9.78E+04 1.08E+05 1.34E+05 8.29E+04 7.66E+04 1.25E+05 1.13E+05 1.04E+05 1.47E+05 8.06E+04 7.09E+04 3.68E+05 7.38E+04 1.28E+05 5.00E+04 1.77E+05 1.44E+05 1.50E+05 2.62E+05 1.44E+05 5.94E+04 1.62E+05 1.16E+05 1.24E+05 1.37E+05 6.90E+04 1.03E+05 1.11E+05 1.58E+05 9.30E+04 4.11E+05 1.74E+05 2.00E+05 2.40E+05 1.12E+05 1.36E+05 1.48E+05 1.21E+05 1.62E+05 1.99E+05 1.81E+05 7.72E+05 5.78E+05 9.36E+04 1.63E+05 2.45E+05 2.99E+05 1.40E+05 1.60E+05 1.65E+05 2.23E+05 1.70E+05 1.22E+05 1.89E+05 1.27E+05 1.15E+05 1.91E+05 3.21E+05 L-glutamate 6.17E+05 5.52E+05 5.20E+05 3.64E+05 5.12E+05 7.12E+05 5.48E+05 4.85E+05 5.33E+05 4.48E+05 4.51E+05 7.50E+05 2.45E+05 6.10E+05 3.57E+05 6.00E+05 5.29E+05 6.07E+05 7.38E+05 5.55E+05 2.74E+05 4.44E+05 3.49E+05 4.84E+05 5.15E+05 3.94E+05 4.73E+05 5.66E+05 6.43E+05 4.71E+05 7.49E+05 5.13E+05 5.16E+05 5.95E+05 5.78E+05 7.10E+05 6.64E+05 4.85E+05 4.76E+05 4.16E+05 5.30E+05 1.02E+06 6.73E+05 6.75E+05 6.87E+05 6.52E+05 7.69E+05 6.13E+05 5.12E+05 4.79E+05 6.00E+05 5.74E+05 4.53E+05 5.97E+05 4.76E+05 4.46E+05 5.88E+05 7.99E+05 L-glutamine 1.34E+07 1.04E+07 1.02E+07 1.18E+07 9.35E+06 1.08E+07 9.00E+06 8.94E+06 1.05E+07 1.70E+07 8.77E+06 1.23E+07 4.79E+06 1.07E+07 8.91E+06 1.03E+07 7.79E+06 8.29E+06 1.63E+07 9.23E+06 7.26E+06 9.55E+06 1.01E+07 1.16E+07 1.01E+07 8.36E+06 9.21E+06 8.30E+06 1.26E+07 8.10E+06 9.72E+06 1.06E+07 1.06E+07 1.05E+07 8.76E+06 7.61E+06 8.72E+06 8.01E+06 1.28E+07 7.74E+06 9.79E+06 1.00E+07 1.17E+07 8.59E+06 9.41E+06 1.04E+07 8.19E+06 8.43E+06 1.07E+07 9.58E+06 7.92E+06 8.77E+06 9.86E+06 9.99E+06 7.47E+06 8.96E+06 1.28E+07 1.44E+07 L-histidine 2.46E+06 2.99E+06 2.79E+06 2.91E+06 1.44E+06 1.68E+06 1.41E+06 1.93E+06 2.22E+06 2.98E+06 2.97E+06 2.93E+06 1.11E+06 2.27E+06 1.75E+06 2.45E+06 2.27E+06 2.53E+06 2.28E+06 2.89E+06 1.98E+06 2.69E+06 2.83E+06 1.89E+06 1.90E+06 1.89E+06 1.88E+06 2.02E+06 2.66E+06 2.14E+06 3.17E+06 2.93E+06 2.78E+06 1.47E+06 9.82E+05 2.77E+06 2.14E+06 2.33E+06 3.11E+06 2.56E+06 2.83E+06 3.09E+06 3.04E+06 2.06E+06 1.69E+06 2.21E+06 2.53E+06 2.56E+06 2.77E+06 3.05E+06 1.76E+06 2.49E+06 2.11E+06 2.19E+06 1.69E+06 1.20E+06 2.19E+06 1.38E+06 L-leucine/isoleucine 8.64E+07 1.36E+08 1.14E+08 9.69E+07 7.98E+07 8.81E+07 8.34E+07 8.08E+07 7.31E+07 7.46E+07 1.41E+08 1.15E+08 3.49E+07 7.37E+07 9.32E+07 7.89E+07 7.35E+07 7.92E+07 6.65E+07 1.06E+08 5.07E+07 9.22E+07 8.17E+07 7.53E+07 7.70E+07 8.14E+07 6.87E+07 8.18E+07 8.87E+07 8.45E+07 8.93E+07 8.94E+07 7.67E+07 6.19E+07 7.11E+07 7.70E+07 9.47E+07 7.82E+07 7.00E+07 7.25E+07 9.48E+07 1.12E+08 1.12E+08 5.82E+07 8.91E+07 8.53E+07 7.88E+07 9.02E+07 8.32E+07 8.60E+07 5.62E+07 8.86E+07 6.25E+07 1.19E+08 1.11E+08 4.71E+07 6.26E+07 8.29E+07 L-lysine 9.87E+06 1.50E+07 1.06E+07 1.54E+07 6.10E+06 8.69E+06 6.66E+06 1.02E+07 8.81E+06 8.53E+06 1.07E+07 1.03E+07 2.65E+06 7.91E+06 5.57E+06 9.56E+06 7.86E+06 8.73E+06 1.22E+07 1.31E+07 6.48E+06 8.42E+06 8.97E+06 8.92E+06 6.51E+06 5.33E+06 7.77E+06 7.88E+06 1.22E+07 7.18E+06 1.14E+07 1.15E+07 1.11E+07 5.92E+06 7.09E+06 7.43E+06 8.64E+06 1.09E+07 1.22E+07 1.07E+07 1.01E+07 1.38E+07 1.03E+07 4.81E+06 7.21E+06 9.86E+06 8.43E+06 6.44E+06 1.08E+07 1.03E+07 5.89E+06 7.24E+06 7.47E+06 1.01E+07 5.36E+06 7.60E+06 8.31E+06 1.22E+07 L-methionine 1.37E+07 1.83E+07 1.84E+07 1.66E+07 1.06E+07 9.79E+06 1.41E+07 8.43E+06 8.85E+06 1.12E+07 1.90E+07 9.50E+06 4.41E+06 8.38E+06 1.09E+07 9.76E+06 9.99E+06 1.42E+07 9.26E+06 1.28E+07 7.89E+06 9.50E+06 8.60E+06 7.02E+06 8.02E+06 6.76E+06 6.87E+06 7.66E+06 1.94E+07 1.42E+07 1.45E+07 1.31E+07 1.15E+07 5.72E+06 2.81E+06 1.20E+07 8.49E+06 1.14E+07 1.14E+07 7.71E+06 1.11E+07 2.78E+07 2.31E+07 1.13E+07 7.20E+06 9.64E+06 1.03E+07 1.19E+07 1.61E+07 1.08E+07 6.50E+06 1.30E+07 1.14E+07 9.98E+06 7.69E+06 6.69E+06 6.97E+06 4.29E+06 L-phenylalanine 1.49E+07 1.94E+07 1.72E+07 1.42E+07 1.34E+07 1.37E+07 1.22E+07 1.12E+07 1.10E+07 1.37E+07 2.23E+07 1.66E+07 6.28E+06 1.38E+07 1.65E+07 1.33E+07 1.32E+07 1.43E+07 1.43E+07 1.84E+07 9.95E+06 1.71E+07 1.36E+07 1.59E+07 1.37E+07 1.41E+07 1.28E+07 1.78E+07 1.73E+07 1.42E+07 1.50E+07 1.36E+07 1.07E+07 1.01E+07 1.07E+07 1.77E+07 1.38E+07 1.25E+07 1.20E+07 1.23E+07 1.48E+07 1.73E+07 1.91E+07 2.08E+07 1.68E+07 1.58E+07 1.46E+07 2.02E+07 1.72E+07 1.47E+07 9.50E+06 1.63E+07 1.30E+07 1.92E+07 2.01E+07 9.11E+06 1.15E+07 1.37E+07 L-proline 3.43E+07 5.35E+07 5.25E+07 5.48E+07 2.94E+07 2.93E+07 3.79E+07 2.90E+07 3.13E+07 3.73E+07 5.93E+07 4.18E+07 1.61E+07 3.63E+07 3.91E+07 3.23E+07 3.46E+07 3.77E+07 2.96E+07 4.25E+07 2.48E+07 3.47E+07 3.54E+07 2.29E+07 3.08E+07 2.46E+07 2.57E+07 2.95E+07 5.00E+07 3.88E+07 5.23E+07 4.54E+07 4.79E+07 1.98E+07 1.57E+07 4.78E+07 3.34E+07 3.33E+07 3.56E+07 3.17E+07 4.37E+07 8.56E+07 6.33E+07 3.92E+07 2.93E+07 4.26E+07 4.02E+07 4.08E+07 4.97E+07 4.99E+07 2.86E+07 4.89E+07 3.60E+07 3.58E+07 2.40E+07 3.18E+07 3.85E+07 1.98E+07 L-serine 9.00E+05 1.30E+06 1.04E+06 1.15E+06 6.85E+05 8.52E+05 8.85E+05 7.39E+05 7.98E+05 9.71E+05 1.55E+06 1.21E+06 5.29E+05 9.23E+05 1.04E+06 1.02E+06 1.04E+06 1.22E+06 1.09E+06 1.38E+06 8.08E+05 1.04E+06 1.22E+06 6.67E+05 9.59E+05 8.47E+05 9.42E+05 7.04E+05 1.31E+06 1.18E+06 1.25E+06 1.41E+06 1.60E+06 5.15E+05 3.12E+05 7.50E+05 9.57E+05 8.62E+05 9.85E+05 7.32E+05 1.29E+06 1.90E+06 1.49E+06 7.42E+05 8.32E+05 1.03E+06 1.09E+06 1.10E+06 1.46E+06 1.36E+06 7.85E+05 1.35E+06 1.20E+06 9.44E+05 7.41E+05 8.06E+05 7.62E+05 5.07E+05 L-threonine 3.99E+06 6.29E+06 4.82E+06 4.24E+06 2.27E+06 2.94E+06 3.65E+06 2.57E+06 2.42E+06 4.62E+06 6.10E+06 4.07E+06 1.56E+06 2.51E+06 2.75E+06 3.34E+06 2.31E+06 3.43E+06 3.00E+06 3.38E+06 2.67E+06 3.13E+06 3.11E+06 2.14E+06 2.75E+06 1.72E+06 2.30E+06 2.74E+06 5.76E+06 4.33E+06 4.64E+06 5.06E+06 6.05E+06 1.96E+06 1.86E+06 2.13E+06 3.22E+06 3.02E+06 3.96E+06 2.69E+06 4.82E+06 7.63E+06 5.85E+06 2.11E+06 2.18E+06 2.74E+06 2.79E+06 2.23E+06 4.05E+06 4.98E+06 3.06E+06 4.32E+06 4.07E+06 3.75E+06 2.56E+06 2.51E+06 2.79E+06 3.16E+06 L-tryptophan 7.05E+07 7.37E+07 6.54E+07 6.03E+07 4.62E+07 5.47E+07 3.70E+07 3.96E+07 4.42E+07 7.45E+07 5.79E+07 6.19E+07 3.67E+07 7.50E+07 4.42E+07 6.89E+07 6.12E+07 4.83E+07 6.89E+07 7.33E+07 5.78E+07 4.74E+07 4.60E+07 6.18E+07 5.55E+07 4.33E+07 4.89E+07 5.79E+07 1.20E+08 5.16E+07 6.35E+07 6.53E+07 6.83E+07 3.97E+07 6.53E+07 6.50E+07 6.22E+07 4.71E+07 7.64E+07 7.46E+07 5.99E+07 7.30E+07 5.98E+07 4.81E+07 6.17E+07 6.14E+07 4.42E+07 3.84E+07 9.33E+07 7.02E+07 5.19E+07 3.85E+07 5.50E+07 6.64E+07 4.44E+07 4.19E+07 4.53E+07 4.03E+07 L-tyrosine 1.03E+07 1.05E+07 9.65E+06 7.77E+06 6.15E+06 4.99E+06 4.40E+06 3.18E+06 4.50E+06 6.89E+06 1.03E+07 7.97E+06 3.80E+06 5.42E+06 6.26E+06 4.69E+06 4.77E+06 3.74E+06 9.90E+06 1.12E+07 3.90E+06 6.02E+06 7.51E+06 5.91E+06 6.12E+06 5.91E+06 5.02E+06 1.03E+07 8.70E+06 7.20E+06 6.99E+06 6.49E+06 5.45E+06 5.18E+06 2.11E+06 8.81E+06 5.62E+06 4.57E+06 7.02E+06 5.09E+06 7.32E+06 1.30E+07 1.20E+07 1.04E+07 5.45E+06 6.70E+06 6.39E+06 1.34E+07 7.76E+06 8.97E+06 3.35E+06 8.49E+06 5.83E+06 8.33E+06 8.09E+06 2.46E+06 2.71E+06 2.31E+06 L-valine 1.47E+08 1.92E+08 1.75E+08 1.71E+08 1.24E+08 1.30E+08 1.20E+08 1.25E+08 1.19E+08 2.00E+08 2.16E+08 2.12E+08 7.26E+07 1.29E+08 1.33E+08 1.36E+08 1.24E+08 1.58E+08 1.80E+08 1.88E+08 1.37E+08 1.65E+08 1.58E+08 1.34E+08 1.36E+08 1.14E+08 1.08E+08 1.73E+08 1.99E+08 1.87E+08 2.54E+08 2.21E+08 2.00E+08 9.22E+07 7.89E+07 1.89E+08 1.45E+08 1.63E+08 2.40E+08 1.57E+08 1.89E+08 2.90E+08 2.33E+08 1.82E+08 1.42E+08 1.73E+08 1.83E+08 2.05E+08 2.10E+08 2.07E+08 1.32E+08 2.32E+08 1.88E+08 1.64E+08 1.32E+08 8.30E+07 1.04E+08 8.97E+07 L-cystine 2.25E+05 2.37E+05 2.30E+05 3.28E+05 2.01E+05 2.34E+05 2.71E+05 3.41E+05 3.61E+05 2.43E+05 5.70E+05 6.03E+05 2.25E+05 3.56E+05 4.57E+05 5.57E+05 6.20E+05 5.92E+05 4.10E+05 6.01E+05 3.79E+05 4.92E+05 6.93E+05 5.66E+05 6.12E+05 6.23E+05 5.35E+05 4.96E+05 2.38E+05 3.80E+05 4.39E+05 6.16E+05 3.88E+05 2.25E+05 2.74E+05 2.33E+05 4.73E+05 5.80E+05 4.17E+05 3.83E+05 6.60E+05 4.17E+05 6.38E+05 2.54E+05 7.12E+05 7.00E+05 5.12E+05 4.46E+05 4.23E+05 6.49E+05 5.65E+05 5.22E+05 5.09E+05 6.14E+05 5.62E+05 5.08E+05 4.38E+05 6.29E+05 Cytosine 1.78E+05 2.03E+05 1.55E+05 1.47E+05 1.80E+05 1.67E+05 1.19E+05 2.26E+05 2.55E+05 1.48E+05 1.44E+05 1.31E+05 3.67E+04 1.73E+05 9.04E+04 5.93E+04 9.23E+04 7.93E+04 1.42E+05 1.70E+05 3.65E+04 1.42E+05 1.16E+05 1.24E+05 1.11E+05 8.27E+04 8.47E+04 4.99E+04 1.15E+05 1.06E+05 8.29E+04 9.04E+04 8.03E+04 1.06E+05 1.03E+05 1.32E+05 1.93E+05 1.32E+05 8.28E+04 6.72E+04 1.13E+05 2.13E+05 1.15E+05 1.12E+05 1.12E+05 1.07E+05 1.30E+05 1.01E+05 9.50E+04 1.25E+05 1.25E+05 1.18E+05 4.11E+04 1.41E+05 1.04E+05 6.75E+04 1.23E+05 8.95E+04 IDP 2.04E+05 1.58E+05 1.41E+05 1.44E+05 9.93E+04 1.30E+05 9.63E+04 1.39E+05 1.87E+05 9.00E+04 8.89E+04 1.07E+05 2.34E+04 4.52E+04 1.97E+04 5.37E+04 9.66E+04 8.03E+04 4.02E+04 5.23E+04 3.95E+04 6.37E+04 7.17E+04 8.21E+04 3.78E+04 2.88E+04 7.07E+04 5.95E+04 1.26E+05 4.46E+04 1.22E+05 1.38E+05 1.43E+05 6.41E+04 4.14E+04 8.39E+04 1.07E+05 1.12E+05 6.34E+04 8.24E+04 1.15E+05 2.51E+05 1.80E+05 2.78E+04 7.57E+04 1.03E+05 8.67E+04 3.50E+04 6.41E+04 7.69E+04 4.93E+04 6.21E+04 1.01E+05 8.50E+04 4.54E+04 4.37E+04 5.80E+04 7.30E+04 Allantoate 2.97E+05 4.15E+05 3.38E+05 4.60E+05 2.58E+05 3.33E+05 3.63E+05 3.36E+05 4.20E+05 3.51E+05 4.31E+05 4.35E+05 1.28E+05 3.91E+05 2.60E+05 3.63E+05 2.56E+05 3.08E+05 4.37E+05 3.17E+05 2.03E+05 3.64E+05 3.77E+05 2.54E+05 1.95E+05 1.98E+05 3.43E+05 6.89E+05 4.55E+05 3.39E+05 7.57E+05 4.61E+05 5.29E+05 3.98E+05 1.86E+05 5.67E+05 3.95E+05 4.70E+05 5.26E+05 4.14E+05 4.19E+05 8.01E+05 5.44E+05 4.27E+05 2.55E+05 4.08E+05 5.51E+05 4.87E+05 3.71E+05 4.77E+05 2.36E+05 3.13E+05 2.35E+05 3.59E+05 2.17E+05 2.56E+05 5.47E+05 2.80E+05 5-Hydroxyisourate 2.61E+05 1.88E+05 1.84E+05 1.62E+05 2.01E+05 2.09E+05 1.38E+05 9.92E+04 1.55E+05 2.74E+05 1.05E+05 1.50E+05 6.24E+04 1.88E+05 1.48E+05 1.19E+05 1.49E+05 1.47E+05 3.17E+05 1.50E+05 6.20E+04 1.25E+05 1.31E+05 2.78E+05 1.39E+05 9.71E+04 7.65E+04 9.70E+04 2.45E+05 1.32E+05 1.29E+05 1.09E+05 1.10E+05 1.77E+05 2.53E+05 1.40E+05 1.72E+05 9.44E+04 2.37E+05 1.03E+05 8.23E+04 1.80E+05 1.52E+05 1.91E+05 1.79E+05 1.44E+05 1.58E+05 1.50E+05 1.62E+05 8.78E+04 1.10E+05 9.20E+04 8.23E+04 2.44E+05 1.49E+05 1.72E+05 2.07E+05 2.43E+05 2',3'-Cyclic CMP 1.41E+05 1.69E+05 1.74E+05 1.65E+05 1.28E+05 1.55E+05 1.64E+05 1.95E+05 1.45E+05 2.17E+05 1.45E+05 2.07E+05 6.09E+04 1.43E+05 1.26E+05 1.84E+05 2.27E+05 1.78E+05 1.96E+05 1.62E+05 1.41E+05 1.58E+05 1.70E+05 1.74E+05 1.96E+05 1.61E+05 1.74E+05 1.91E+05 1.84E+05 1.08E+05 1.64E+05 1.37E+05 1.36E+05 2.25E+05 9.37E+04 1.31E+05 2.11E+05 1.80E+05 1.71E+05 1.97E+05 1.56E+05 1.01E+05 1.69E+05 1.03E+05 1.88E+05 2.26E+05 1.43E+05 1.49E+05 1.55E+05 2.15E+05 1.29E+05 1.51E+05 1.33E+05 1.64E+05 2.06E+05 9.81E+04 1.03E+05 5.49E+04 5-6-Dihydrothymine 3.69E+05 3.92E+05 3.55E+05 2.97E+05 5.17E+05 3.62E+05 2.90E+05 3.55E+05 3.52E+05 3.64E+05 3.22E+05 2.87E+05 9.92E+04 3.24E+05 2.85E+05 2.33E+05 2.17E+05 2.36E+05 1.73E+05 2.51E+05 1.26E+05 2.48E+05 2.67E+05 4.73E+05 2.57E+05 2.26E+05 1.79E+05 2.29E+05 3.90E+05 2.46E+05 3.11E+05 2.94E+05 2.60E+05 2.90E+05 1.23E+05 3.36E+05 2.22E+05 3.38E+05 2.80E+05 2.10E+05 2.85E+05 4.97E+05 3.94E+05 3.56E+05 3.08E+05 3.37E+05 3.42E+05 2.55E+05 3.13E+05 2.49E+05 1.50E+05 3.17E+05 2.19E+05 4.08E+05 3.26E+05 1.81E+05 2.56E+05 1.35E+05 Pyridoxal 2.43E+05 2.28E+05 1.37E+05 1.02E+05 2.05E+05 1.35E+05 1.34E+05 1.20E+05 1.15E+05 1.43E+05 1.26E+05 2.32E+04 3.11E+04 7.55E+04 4.41E+04 3.32E+04 3.35E+04 4.07E+04 3.82E+04 2.30E+04 5.22E+04 2.73E+04 2.46E+04 9.38E+04 7.80E+04 5.62E+04 4.80E+04 4.93E+04 1.09E+05 1.41E+05 1.46E+05 2.60E+04 5.58E+04 8.94E+04 3.56E+04 8.69E+04 4.66E+04 4.78E+04 1.18E+05 8.68E+04 4.83E+04 5.34E+04 2.40E+04 8.75E+04 6.26E+04 4.93E+04 2.29E+04 4.55E+04 3.79E+04 2.09E+04 5.31E+04 1.90E+04 6.25E+04 6.42E+04 5.11E+04 4.89E+04 3.59E+04 1.22E+04 Pyridoxamine 5'-phosphate 3.66E+05 4.62E+05 6.09E+05 3.45E+05 6.76E+05 3.14E+05 2.78E+05 2.69E+05 2.75E+05 5.75E+05 6.00E+05 4.79E+05 4.02E+05 4.18E+05 5.42E+05 3.50E+05 3.19E+05 3.40E+05 4.13E+05 5.01E+05 5.16E+05 5.97E+05 5.19E+05 3.40E+05 4.59E+05 5.54E+05 4.37E+05 3.09E+05 4.44E+05 7.10E+05 6.28E+05 3.77E+05 3.70E+05 3.28E+05 3.82E+05 5.28E+05 2.95E+05 2.52E+05 3.46E+05 3.63E+05 4.88E+05 4.91E+05 5.26E+05 5.37E+05 6.26E+05 3.71E+05 4.19E+05 4.55E+05 5.56E+05 4.28E+05 6.88E+05 5.35E+05 3.74E+05 3.88E+05 4.71E+05 5.98E+05 4.21E+05 4.07E+05 Nicotinamide 1.52E+06 2.42E+06 2.40E+06 2.25E+06 2.22E+06 2.57E+06 2.33E+06 2.91E+06 3.08E+06 1.44E+06 2.70E+06 2.55E+06 1.29E+06 2.52E+06 2.16E+06 2.66E+06 2.93E+06 3.74E+06 1.53E+06 2.14E+06 1.80E+06 2.67E+06 2.83E+06 1.98E+06 2.88E+06 2.77E+06 2.48E+06 1.89E+06 1.70E+06 2.23E+06 3.13E+06 2.43E+06 3.06E+06 1.87E+06 2.16E+06 3.17E+06 2.86E+06 3.51E+06 1.96E+06 2.47E+06 3.28E+06 3.56E+06 4.08E+06 1.48E+06 2.95E+06 2.41E+06 3.73E+06 2.28E+06 2.09E+06 2.21E+06 2.63E+06 2.82E+06 2.73E+06 2.50E+06 2.82E+06 2.89E+06 3.58E+06 3.62E+06 Phosphate 8.05E+06 1.24E+07 1.16E+07 1.55E+07 5.25E+06 1.05E+07 1.17E+07 1.19E+07 1.47E+07 1.36E+07 1.41E+07 1.95E+07 1.03E+07 1.08E+07 6.79E+06 1.55E+07 1.33E+07 1.76E+07 1.33E+07 1.50E+07 1.35E+07 9.99E+06 1.07E+07 1.64E+07 1.24E+07 7.24E+06 1.36E+07 2.12E+07 1.13E+07 6.57E+06 1.33E+07 1.82E+07 1.79E+07 1.13E+07 1.16E+07 1.70E+07 1.48E+07 1.67E+07 1.47E+07 2.05E+07 1.37E+07 1.41E+07 1.89E+07 8.15E+06 1.11E+07 1.68E+07 1.35E+07 1.15E+07 9.71E+06 1.14E+07 9.64E+06 8.66E+06 1.50E+07 1.25E+07 8.99E+06 1.06E+07 1.44E+07 1.91E+07 Glutathione 4.45E+04 4.22E+04 4.05E+04 5.12E+04 4.75E+04 4.30E+04 5.85E+04 5.55E+04 6.06E+04 5.87E+04 4.36E+04 1.13E+05 1.43E+04 6.09E+04 2.95E+04 7.62E+04 8.91E+04 1.04E+05 8.79E+04 6.96E+04 2.74E+04 9.85E+04 5.78E+04 1.00E+05 6.13E+04 4.28E+04 6.64E+04 5.52E+04 5.60E+04 2.70E+04 6.58E+04 7.99E+04 5.16E+04 5.18E+04 2.89E+04 1.10E+05 7.77E+04 9.07E+04 5.44E+04 6.00E+04 6.09E+04 1.53E+05 1.03E+05 7.58E+04 7.67E+04 1.12E+05 9.43E+04 7.40E+04 1.08E+05 6.70E+04 4.34E+04 7.14E+04 6.57E+04 9.87E+04 5.54E+04 8.86E+04 1.24E+05 7.46E+04 Glutathione disulfide 7.42E+04 4.83E+04 5.35E+04 2.62E+04 9.90E+04 1.26E+05 8.62E+04 8.19E+04 1.35E+05 6.35E+04 3.83E+04 2.15E+05 4.06E+04 1.19E+05 4.71E+04 8.94E+04 7.63E+04 1.37E+05 9.79E+04 4.41E+04 2.81E+04 1.50E+05 6.67E+04 1.27E+05 9.49E+04 6.01E+04 1.03E+05 6.31E+04 1.23E+05 4.88E+04 2.78E+05 9.36E+04 7.61E+04 1.58E+05 7.49E+04 7.54E+04 1.58E+05 1.25E+05 8.24E+04 7.04E+04 5.39E+04 3.74E+05 2.40E+05 1.08E+05 1.46E+05 1.22E+05 3.71E+05 9.31E+04 1.55E+05 6.81E+04 1.13E+05 8.97E+04 8.66E+04 1.64E+05 1.16E+05 1.64E+05 2.44E+05 1.13E+05 5-Oxoproline 8.44E+06 6.75E+06 6.80E+06 7.34E+06 6.99E+06 7.37E+06 5.94E+06 5.78E+06 8.46E+06 1.08E+07 6.18E+06 7.47E+06 3.18E+06 7.52E+06 5.87E+06 7.44E+06 4.99E+06 5.35E+06 1.08E+07 7.66E+06 4.89E+06 6.75E+06 7.00E+06 8.44E+06 6.75E+06 5.76E+06 6.31E+06 5.09E+06 8.76E+06 5.71E+06 6.33E+06 7.16E+06 6.91E+06 6.98E+06 5.49E+06 5.52E+06 5.93E+06 5.03E+06 8.88E+06 5.06E+06 5.63E+06 6.96E+06 7.77E+06 6.22E+06 6.48E+06 6.88E+06 6.50E+06 7.23E+06 6.09E+06 6.45E+06 5.42E+06 5.92E+06 6.24E+06 6.60E+06 5.38E+06 6.22E+06 7.54E+06 9.38E+06 S-Glutathionyl-L-cysteine 1.85E+05 1.47E+05 1.64E+05 1.44E+05 1.56E+05 2.46E+05 1.97E+05 2.52E+05 3.19E+05 1.58E+05 1.82E+05 4.36E+05 5.16E+04 2.78E+05 1.60E+05 2.54E+05 2.49E+05 2.98E+05 2.57E+05 1.99E+05 1.05E+05 2.55E+05 2.01E+05 3.87E+05 2.80E+05 1.94E+05 2.17E+05 1.74E+05 2.69E+05 1.50E+05 4.09E+05 2.48E+05 2.25E+05 3.93E+05 1.84E+05 1.27E+05 3.51E+05 3.14E+05 2.79E+05 2.79E+05 2.66E+05 4.64E+05 3.86E+05 1.52E+05 3.37E+05 4.21E+05 4.22E+05 2.23E+05 3.40E+05 2.69E+05 2.51E+05 2.93E+05 2.27E+05 3.99E+05 2.68E+05 2.36E+05 3.26E+05 3.10E+05 Dimethylglycine 1.52E+06 1.71E+06 1.50E+06 1.40E+06 1.21E+06 1.03E+06 1.11E+06 1.34E+06 1.17E+06 1.50E+06 1.73E+06 1.64E+06 4.57E+05 9.41E+05 9.01E+05 8.18E+05 1.11E+06 1.28E+06 1.31E+06 1.63E+06 7.96E+05 1.30E+06 1.37E+06 1.54E+06 1.59E+06 1.16E+06 1.20E+06 2.27E+06 1.71E+06 1.43E+06 1.84E+06 1.56E+06 1.75E+06 9.16E+05 1.66E+06 1.85E+06 1.49E+06 1.65E+06 1.57E+06 9.26E+05 1.59E+06 2.54E+06 2.01E+06 1.54E+06 1.05E+06 1.45E+06 1.51E+06 2.24E+06 1.76E+06 1.86E+06 1.01E+06 1.54E+06 1.22E+06 1.45E+06 2.88E+06 1.66E+06 1.54E+06 3.30E+06 Phosphoserine 1.35E+05 1.57E+05 2.20E+05 1.84E+05 1.33E+05 1.49E+05 1.78E+05 1.71E+05 1.86E+05 1.76E+05 1.59E+05 1.53E+05 4.52E+04 1.62E+05 1.60E+05 1.72E+05 1.60E+05 1.63E+05 4.84E+04 1.20E+05 9.72E+04 1.27E+05 9.60E+04 1.91E+05 1.33E+05 1.34E+05 1.64E+05 2.01E+05 1.85E+05 1.24E+05 1.68E+05 1.53E+05 1.47E+05 1.56E+05 1.42E+05 1.71E+05 1.86E+05 1.69E+05 1.09E+05 1.63E+05 1.66E+05 2.08E+05 1.50E+05 1.45E+05 1.66E+05 9.47E+04 1.59E+05 1.40E+05 1.43E+05 1.27E+05 9.13E+04 1.53E+05 1.53E+05 1.95E+05 1.87E+05 1.51E+05 1.40E+05 1.23E+05 Ornithine 8.21E+05 1.14E+06 1.03E+06 1.67E+06 5.56E+05 9.56E+05 9.34E+05 9.97E+05 1.14E+06 8.92E+05 1.10E+06 1.59E+06 2.37E+05 1.28E+06 4.99E+05 9.97E+05 7.44E+05 1.00E+06 1.31E+06 1.14E+06 5.78E+05 9.40E+05 9.11E+05 1.02E+06 6.74E+05 4.69E+05 9.17E+05 2.31E+06 1.73E+06 6.19E+05 2.15E+06 1.73E+06 1.63E+06 1.19E+06 5.29E+05 1.48E+06 1.43E+06 1.57E+06 1.46E+06 1.18E+06 1.23E+06 2.57E+06 1.52E+06 8.80E+05 8.68E+05 1.43E+06 1.46E+06 1.18E+06 1.29E+06 1.29E+06 4.90E+05 6.95E+05 8.94E+05 1.29E+06 5.46E+05 6.45E+05 1.43E+06 9.36E+05 L-Citrulline 1.69E+06 1.85E+06 8.84E+05 1.11E+06 8.88E+05 1.29E+06 1.04E+06 1.00E+06 1.11E+06 1.45E+06 1.44E+06 1.38E+06 5.05E+05 1.01E+06 9.13E+05 1.15E+06 8.23E+05 1.09E+06 1.11E+06 1.26E+06 7.28E+05 1.15E+06 1.09E+06 1.27E+06 1.09E+06 7.51E+05 9.79E+05 1.31E+06 1.44E+06 1.08E+06 1.52E+06 1.85E+06 1.55E+06 1.41E+06 5.69E+05 1.36E+06 1.19E+06 1.04E+06 1.30E+06 1.21E+06 1.55E+06 2.89E+06 1.56E+06 1.06E+06 1.29E+06 1.59E+06 1.26E+06 1.48E+06 1.24E+06 1.69E+06 8.37E+05 1.23E+06 1.08E+06 1.30E+06 1.09E+06 5.97E+05 8.73E+05 5.31E+05 Spermidine 3.10E+04 1.43E+04 4.12E+04 3.48E+04 2.12E+04 4.43E+04 1.03E+05 7.26E+04 1.20E+05 2.82E+04 9.98E+03 1.29E+05 1.03E+05 3.25E+04 1.73E+04 6.36E+04 1.63E+05 8.27E+04 8.51E+04 2.89E+04 1.15E+05 7.18E+04 6.07E+04 6.61E+04 1.63E+05 4.45E+04 4.95E+05 3.09E+05 4.31E+04 3.15E+04 5.74E+04 5.71E+04 3.12E+04 1.82E+05 6.36E+04 1.07E+05 8.08E+04 7.48E+04 3.31E+04 7.04E+04 5.68E+04 5.86E+04 1.05E+05 7.65E+04 8.08E+04 6.54E+04 1.28E+05 8.73E+04 5.01E+04 6.50E+04 5.38E+04 7.72E+04 1.58E+05 1.12E+05 1.24E+05 5.01E+04 6.83E+04 5.43E+04 5-Guanidino-2-oxopentanoate 9.99E+04 1.03E+05 7.25E+04 4.56E+04 4.75E+04 4.58E+04 6.22E+04 4.37E+04 2.96E+04 4.85E+04 4.95E+04 7.09E+04 0.00E+00 2.51E+04 2.30E+04 5.56E+04 3.21E+04 2.50E+04 5.62E+04 9.17E+04 9.78E+03 5.18E+04 3.36E+04 1.88E+04 4.20E+03 2.02E+04 1.65E+04 0.00E+00 9.14E+04 3.17E+04 5.37E+04 7.50E+04 5.57E+04 2.82E+04 6.60E+03 6.43E+04 1.91E+04 5.39E+04 2.48E+04 2.91E+04 3.74E+04 6.89E+04 1.21E+05 3.25E+04 4.18E+04 0.00E+00 2.56E+04 5.14E+04 4.30E+04 7.17E+04 1.86E+04 2.97E+04 2.03E+04 4.00E+04 1.59E+04 2.21E+04 5.18E+04 1.75E+04 Creatine 7.54E+07 9.25E+07 6.79E+07 5.34E+07 8.67E+07 6.08E+07 5.16E+07 5.42E+07 4.40E+07 7.61E+07 1.01E+08 7.12E+07 3.40E+07 8.96E+07 6.27E+07 5.37E+07 5.27E+07 6.79E+07 8.83E+07 7.86E+07 4.95E+07 7.01E+07 5.52E+07 5.66E+07 7.28E+07 5.60E+07 7.85E+07 8.17E+07 7.38E+07 7.07E+07 7.13E+07 5.28E+07 6.49E+07 4.39E+07 1.20E+08 8.60E+07 6.70E+07 4.55E+07 8.20E+07 5.88E+07 4.36E+07 8.51E+07 6.69E+07 8.40E+07 6.90E+07 8.53E+07 7.40E+07 7.82E+07 8.13E+07 5.20E+07 7.06E+07 5.17E+07 4.17E+07 7.97E+07 7.08E+07 1.03E+08 9.27E+07 1.31E+08 Creatinine 2.75E+06 3.87E+06 3.34E+06 3.26E+06 3.24E+06 2.09E+06 2.61E+06 2.62E+06 2.78E+06 3.20E+06 3.57E+06 2.92E+06 1.00E+06 2.88E+06 2.25E+06 2.44E+06 2.89E+06 3.15E+06 1.90E+06 2.86E+06 1.79E+06 2.81E+06 2.50E+06 4.13E+06 2.11E+06 2.21E+06 2.23E+06 1.92E+06 3.99E+06 2.50E+06 3.22E+06 2.78E+06 2.99E+06 1.95E+06 3.70E+06 3.10E+06 2.74E+06 2.54E+06 2.45E+06 2.01E+06 3.11E+06 5.14E+06 4.96E+06 2.55E+06 2.39E+06 3.13E+06 3.12E+06 2.34E+06 3.25E+06 2.62E+06 2.36E+06 2.85E+06 2.14E+06 2.65E+06 2.75E+06 2.45E+06 3.14E+06 3.48E+06 N-Acetylornithine 7.32E+05 6.67E+05 9.95E+05 9.06E+05 9.53E+05 1.02E+06 8.89E+05 8.98E+05 9.89E+05 6.28E+05 7.60E+05 7.63E+05 2.89E+05 8.86E+05 7.89E+05 7.48E+05 6.85E+05 7.03E+05 5.97E+05 6.90E+05 3.78E+05 5.74E+05 5.59E+05 8.67E+05 6.82E+05 6.69E+05 5.82E+05 4.70E+05 6.25E+05 4.92E+05 5.91E+05 4.04E+05 5.09E+05 7.66E+05 3.54E+05 9.56E+05 8.20E+05 8.17E+05 4.67E+05 5.90E+05 5.48E+05 1.07E+06 8.16E+05 7.35E+05 8.99E+05 9.01E+05 7.80E+05 7.31E+05 4.61E+05 6.82E+05 4.33E+05 6.99E+05 4.41E+05 9.08E+05 7.28E+05 5.04E+05 6.18E+05 4.30E+05 Guanidinoacetate 4.21E+05 2.81E+05 2.02E+05 1.72E+05 2.00E+05 2.14E+05 1.32E+05 1.57E+05 1.02E+05 2.09E+05 1.87E+05 1.17E+05 1.64E+04 1.28E+05 1.26E+05 1.48E+05 1.10E+05 1.53E+05 1.08E+05 1.31E+05 9.76E+04 5.09E+04 8.24E+04 3.59E+05 1.49E+05 1.08E+05 6.33E+04 1.34E+05 2.67E+05 2.12E+05 2.11E+05 1.84E+05 1.77E+05 9.94E+04 1.33E+05 2.20E+05 1.45E+05 6.94E+04 1.78E+05 1.13E+05 1.19E+05 1.23E+05 1.63E+05 2.99E+05 1.56E+05 8.46E+04 1.16E+05 1.78E+05 1.53E+05 1.33E+05 1.33E+05 6.14E+04 8.87E+04 1.72E+05 1.54E+05 1.36E+05 1.45E+05 1.51E+05 trans-4-Hydroxy-L-proline 4.38E+05 6.32E+05 6.36E+05 9.82E+05 2.95E+05 3.13E+05 4.85E+05 4.81E+05 6.07E+05 7.82E+05 5.81E+05 6.71E+05 3.88E+05 3.09E+05 5.53E+05 5.82E+05 5.53E+05 7.44E+05 6.19E+05 7.78E+05 4.96E+05 3.90E+05 7.25E+05 2.66E+05 4.19E+05 2.47E+05 2.46E+05 2.25E+05 9.85E+05 4.23E+05 8.27E+05 8.90E+05 9.55E+05 2.97E+05 1.07E+05 2.13E+05 2.37E+05 6.31E+05 5.19E+05 4.92E+05 7.81E+05 1.47E+06 1.09E+06 2.95E+05 4.50E+05 6.69E+05 5.99E+05 4.17E+05 7.76E+05 8.43E+05 3.77E+05 8.13E+05 7.90E+05 3.87E+05 3.62E+05 3.20E+05 2.83E+05 5.31E+04 Pantothenol 5.63E+05 4.91E+05 3.22E+05 2.54E+05 5.48E+05 4.59E+05 3.49E+05 3.22E+05 2.95E+05 3.07E+05 2.62E+05 3.97E+05 1.02E+05 5.38E+05 2.35E+05 2.32E+05 2.55E+05 2.03E+05 4.02E+05 3.34E+05 2.02E+05 2.27E+05 1.82E+05 4.86E+05 4.04E+05 2.14E+05 2.04E+05 2.88E+05 3.15E+05 2.13E+05 2.48E+05 1.76E+05 2.00E+05 3.15E+05 1.07E+06 4.33E+05 2.99E+05 2.07E+05 3.10E+05 2.11E+05 1.86E+05 2.69E+05 2.20E+05 2.82E+05 3.31E+05 4.32E+05 2.62E+05 1.24E+05 3.75E+05 2.15E+05 2.32E+05 1.38E+05 1.09E+05 2.92E+05 2.48E+05 3.77E+05 2.74E+05 5.58E+05 5-6-Dihydrouracil 1.69E+05 2.49E+05 7.65E+04 9.10E+04 5.32E+04 8.11E+04 4.49E+04 9.90E+04 4.16E+04 3.49E+04 1.24E+05 6.21E+04 5.02E+04 2.87E+04 2.35E+04 3.63E+04 5.41E+04 6.33E+04 9.33E+04 3.85E+04 5.70E+04 4.40E+04 5.96E+04 7.19E+04 5.96E+04 2.87E+04 5.62E+04 1.40E+05 5.40E+04 4.44E+04 7.73E+04 9.66E+04 1.01E+05 5.24E+04 2.70E+05 9.99E+04 5.98E+04 7.10E+04 5.95E+04 1.21E+05 8.77E+04 1.19E+05 9.49E+04 1.01E+05 4.55E+04 1.15E+05 3.80E+04 3.17E+04 9.68E+04 8.80E+04 1.49E+05 6.67E+04 5.17E+04 4.46E+04 4.96E+04 1.05E+05 1.10E+05 3.31E+05 Taurine 2.32E+06 2.92E+06 2.02E+06 1.49E+06 2.06E+06 3.25E+06 2.45E+06 2.89E+06 2.35E+06 1.21E+06 1.35E+06 1.60E+06 8.15E+05 1.89E+06 1.00E+06 2.03E+06 1.56E+06 2.23E+06 2.48E+06 9.75E+05 9.80E+05 1.21E+06 1.01E+06 1.27E+06 1.28E+06 9.59E+05 1.78E+06 2.05E+06 1.50E+06 8.73E+05 7.03E+05 1.25E+06 1.49E+06 2.66E+06 3.16E+06 2.08E+06 2.23E+06 2.46E+06 1.44E+06 2.68E+06 9.07E+05 1.39E+06 1.04E+06 1.87E+06 2.25E+06 1.97E+06 1.85E+06 1.70E+06 1.22E+06 1.10E+06 1.21E+06 8.90E+05 1.05E+06 2.22E+06 1.58E+06 1.26E+06 2.88E+06 2.41E+06 L-Methionine S-oxide 5.19E+05 6.70E+05 7.75E+05 5.37E+05 5.40E+05 5.23E+05 5.85E+05 3.87E+05 4.95E+05 4.39E+05 7.27E+05 4.53E+05 4.49E+05 4.08E+05 5.52E+05 4.79E+05 4.67E+05 5.36E+05 2.97E+05 4.59E+05 4.70E+05 4.46E+05 4.37E+05 4.27E+05 4.13E+05 3.69E+05 4.48E+05 4.28E+05 6.02E+05 7.43E+05 5.76E+05 4.74E+05 5.30E+05 2.84E+05 2.59E+05 4.11E+05 3.92E+05 4.92E+05 4.05E+05 3.16E+05 4.59E+05 9.99E+05 8.84E+05 5.23E+05 4.35E+05 4.56E+05 3.88E+05 5.58E+05 5.70E+05 4.71E+05 3.80E+05 4.87E+05 5.16E+05 4.63E+05 3.91E+05 4.45E+05 3.96E+05 2.78E+05 Indole 6.59E+05 7.32E+05 5.87E+05 6.11E+05 3.12E+05 5.38E+05 3.74E+05 4.08E+05 4.44E+05 7.11E+05 5.16E+05 6.08E+05 3.58E+05 6.98E+05 3.01E+05 6.78E+05 5.94E+05 4.80E+05 6.57E+05 6.79E+05 5.11E+05 4.22E+05 3.97E+05 5.81E+05 5.13E+05 2.93E+05 4.57E+05 5.61E+05 1.02E+06 3.34E+05 6.22E+05 6.64E+05 6.46E+05 3.32E+05 6.40E+05 6.18E+05 6.25E+05 4.89E+05 7.14E+05 7.24E+05 5.77E+05 8.50E+05 5.66E+05 2.61E+05 5.66E+05 6.11E+05 3.54E+05 2.76E+05 8.75E+05 6.90E+05 4.54E+05 2.91E+05 4.80E+05 6.49E+05 3.13E+05 3.34E+05 3.92E+05 3.83E+05 Indole-3-acetaldehyde 8.91E+05 1.09E+06 3.33E+05 4.43E+05 2.75E+05 3.47E+05 2.31E+05 2.37E+05 2.70E+05 8.84E+05 7.96E+05 5.30E+05 5.16E+05 1.68E+05 3.52E+05 1.88E+05 2.24E+05 1.09E+05 3.03E+05 3.80E+05 8.68E+04 2.80E+05 5.87E+05 6.27E+04 1.25E+05 1.13E+05 2.61E+05 3.77E+04 6.05E+05 5.15E+05 3.45E+05 3.89E+05 3.60E+05 2.32E+05 1.74E+05 4.32E+05 1.77E+05 6.66E+04 2.77E+05 7.02E+05 5.69E+05 1.72E+05 2.53E+05 2.67E+05 1.27E+05 3.16E+05 1.48E+05 2.13E+05 1.99E+05 1.53E+05 2.06E+05 2.06E+05 8.58E+04 1.47E+05 9.77E+04 6.54E+04 5.05E+04 5.23E+04 Indole-3-acetate 1.53E+05 3.67E+05 2.90E+05 1.96E+05 1.51E+05 1.93E+05 2.67E+05 3.78E+05 4.13E+05 1.39E+05 3.06E+05 5.26E+05 9.26E+04 2.52E+05 1.08E+05 3.18E+05 3.44E+05 3.28E+05 2.00E+05 2.18E+05 1.92E+05 2.21E+05 2.74E+05 1.58E+05 1.53E+05 1.59E+05 1.34E+05 2.75E+05 1.73E+05 1.30E+05 2.43E+05 3.67E+05 3.19E+05 2.87E+05 1.27E+05 4.70E+05 2.75E+05 4.50E+05 1.54E+05 1.82E+05 2.99E+05 3.93E+05 2.17E+05 1.42E+05 2.97E+05 7.21E+05 3.50E+05 1.52E+05 1.55E+05 2.54E+05 8.73E+04 1.33E+05 1.48E+05 2.43E+05 2.13E+05 8.25E+04 1.46E+05 1.83E+05 Indoxyl 2.87E+05 7.25E+05 4.78E+05 5.68E+05 4.15E+05 9.18E+05 7.32E+05 1.41E+06 1.13E+06 3.90E+05 3.83E+05 1.70E+06 3.56E+05 5.43E+05 2.42E+05 6.82E+05 7.67E+05 1.09E+06 3.20E+05 1.26E+06 7.99E+05 6.53E+05 8.81E+05 2.54E+05 4.68E+05 5.06E+05 4.71E+05 1.07E+06 1.73E+05 8.98E+05 1.75E+06 1.67E+06 1.01E+06 4.18E+05 8.28E+05 1.53E+06 8.20E+05 1.38E+06 1.28E+06 9.49E+05 2.33E+06 1.46E+06 1.40E+06 4.71E+05 4.69E+05 1.07E+06 7.40E+05 7.10E+05 9.89E+05 1.15E+06 5.89E+05 9.03E+05 1.20E+06 6.89E+05 5.54E+05 3.22E+05 6.60E+05 7.29E+05 kynurenine 8.66E+04 8.34E+04 1.03E+05 8.51E+04 3.61E+04 1.64E+04 2.84E+04 5.87E+04 5.63E+04 1.08E+05 9.13E+04 4.51E+04 3.13E+04 3.16E+04 4.72E+04 3.01E+04 2.66E+04 7.46E+04 1.04E+05 1.40E+05 3.96E+04 9.49E+04 1.34E+05 5.87E+04 2.77E+04 8.96E+04 8.39E+04 9.22E+04 8.01E+04 7.13E+04 8.78E+04 1.55E+05 1.95E+05 3.52E+04 1.72E+04 1.05E+05 8.27E+04 7.97E+04 7.36E+04 6.62E+04 1.09E+05 2.46E+05 1.71E+05 1.05E+05 7.53E+04 7.03E+04 1.26E+05 9.45E+04 1.59E+05 1.24E+05 1.42E+05 2.10E+05 2.13E+05 5.93E+04 7.75E+04 1.15E+05 1.22E+05 6.25E+04 Anthranilate 3.78E+06 4.98E+06 5.19E+06 4.73E+06 2.93E+06 4.51E+06 4.87E+06 3.66E+06 2.89E+06 3.85E+06 4.22E+06 2.88E+06 1.32E+06 4.04E+06 3.25E+06 4.26E+06 3.00E+06 3.45E+06 1.65E+06 2.80E+06 2.52E+06 2.93E+06 2.06E+06 2.23E+06 1.54E+06 1.52E+06 1.99E+06 8.07E+05 4.74E+06 2.55E+06 4.26E+06 3.82E+06 2.99E+06 2.47E+06 1.24E+05 1.30E+06 2.28E+06 3.70E+06 3.26E+06 2.76E+06 2.91E+06 6.86E+06 6.44E+06 1.03E+06 3.85E+06 2.72E+06 3.23E+06 1.05E+06 3.82E+06 2.58E+06 1.09E+06 1.97E+06 2.29E+06 3.83E+06 3.03E+06 6.59E+05 1.25E+06 1.81E+05 Serotonin 2.48E+05 3.17E+05 1.18E+05 1.55E+05 4.13E+04 8.98E+04 5.18E+04 3.99E+04 7.80E+04 2.15E+05 1.71E+05 1.63E+05 9.60E+04 2.88E+04 9.02E+04 6.17E+04 3.68E+04 1.41E+04 8.16E+04 5.23E+04 0.00E+00 3.98E+04 1.94E+05 1.25E+04 3.31E+04 1.85E+04 7.05E+04 1.62E+04 1.81E+05 1.40E+05 8.07E+04 8.62E+04 7.40E+04 5.74E+04 6.44E+04 1.25E+05 1.92E+04 0.00E+00 6.06E+04 1.90E+05 1.77E+05 5.52E+04 2.86E+04 8.25E+04 5.43E+04 8.82E+04 1.47E+04 6.24E+03 6.13E+04 0.00E+00 4.34E+04 5.05E+04 1.65E+04 1.72E+04 0.00E+00 0.00E+00 0.00E+00 1.48E+04 Ectoine 5.67E+05 8.05E+05 9.46E+05 8.09E+05 5.63E+05 6.59E+05 7.94E+05 4.00E+05 3.00E+05 7.14E+05 5.48E+05 4.21E+05 2.65E+05 5.79E+05 6.08E+05 3.54E+05 4.10E+05 6.45E+05 2.30E+05 5.41E+05 5.21E+05 3.92E+05 2.58E+05 3.81E+05 1.62E+05 1.92E+05 2.22E+05 3.89E+04 7.81E+05 5.61E+05 5.93E+05 5.79E+05 4.26E+05 2.91E+05 2.36E+04 3.91E+05 3.33E+05 6.68E+05 5.07E+05 3.56E+05 4.50E+05 1.37E+06 1.36E+06 3.79E+05 4.27E+05 3.18E+05 3.95E+05 2.48E+05 7.90E+05 3.87E+05 2.87E+05 4.85E+05 4.70E+05 4.24E+05 3.05E+05 2.03E+05 3.17E+05 4.00E+04 N-Methylethanolamine phosphate 9.06E+04 1.35E+05 9.92E+04 8.84E+04 8.08E+04 7.69E+04 3.55E+04 5.28E+04 2.80E+04 9.07E+04 1.05E+05 7.31E+04 1.50E+04 7.86E+04 3.16E+04 2.21E+04 5.81E+04 8.26E+04 9.71E+04 2.72E+04 2.14E+04 5.52E+04 6.98E+04 6.23E+04 4.15E+04 4.25E+04 1.48E+04 5.11E+04 6.80E+04 5.85E+04 1.23E+05 8.15E+04 9.68E+04 3.21E+04 2.78E+04 1.93E+05 4.06E+04 2.91E+04 8.79E+04 5.13E+04 5.08E+04 1.62E+05 1.11E+05 2.17E+05 8.59E+04 4.71E+04 9.02E+04 1.32E+05 7.41E+04 1.11E+05 2.86E+04 9.62E+04 2.93E+04 5.24E+04 4.40E+04 2.26E+04 1.68E+04 1.81E+04 Sphingosine 3.92E+04 6.24E+04 1.91E+04 3.68E+04 8.55E+03 6.00E+04 5.02E+04 4.63E+04 5.85E+04 1.91E+04 2.30E+04 5.02E+04 2.01E+04 4.26E+04 5.96E+03 2.59E+04 3.49E+04 2.86E+04 2.02E+04 3.64E+04 2.28E+04 1.56E+04 1.50E+04 1.60E+04 2.10E+04 1.07E+04 3.08E+04 2.19E+04 2.50E+04 6.03E+03 2.25E+04 2.70E+04 5.66E+04 9.76E+03 2.79E+04 3.90E+04 2.39E+04 2.44E+04 1.34E+04 2.58E+04 2.52E+04 2.03E+04 1.84E+04 5.09E+03 1.50E+04 2.96E+04 1.42E+04 1.17E+04 2.83E+04 7.98E+03 1.06E+04 1.29E+04 1.91E+04 2.33E+04 6.35E+03 9.99E+03 1.37E+04 2.70E+04 Sphingosine 1-phosphate 1.30E+05 1.04E+05 9.03E+04 1.06E+05 4.60E+04 9.92E+04 8.70E+04 8.44E+04 8.16E+04 6.92E+04 8.65E+04 7.96E+04 7.43E+04 7.64E+04 7.28E+04 9.28E+04 7.61E+04 8.63E+04 1.13E+05 8.92E+04 1.19E+05 8.67E+04 7.06E+04 8.61E+04 7.66E+04 7.64E+04 4.18E+04 8.70E+04 9.81E+04 4.73E+04 1.20E+05 1.09E+05 6.94E+04 7.64E+04 7.67E+04 7.31E+04 9.26E+04 9.38E+04 1.06E+05 1.04E+05 8.69E+04 9.00E+04 1.01E+05 3.15E+04 1.28E+05 9.95E+04 8.30E+04 5.09E+04 1.06E+05 1.05E+05 7.13E+04 7.03E+04 1.22E+05 1.15E+05 8.32E+04 6.67E+04 1.10E+05 8.94E+04 Acetylcholine 2.45E+06 2.11E+06 2.15E+06 1.46E+06 1.18E+06 1.29E+06 7.66E+05 5.61E+05 8.67E+05 1.43E+06 1.59E+06 1.53E+06 5.57E+05 8.55E+05 6.52E+05 7.97E+05 6.40E+05 7.05E+05 1.32E+06 1.37E+06 8.31E+05 1.09E+06 1.13E+06 8.62E+05 7.73E+05 6.53E+05 7.09E+05 9.62E+05 1.24E+06 1.22E+06 1.23E+06 1.23E+06 1.28E+06 6.66E+05 4.17E+05 1.63E+06 6.76E+05 8.72E+05 1.16E+06 1.09E+06 1.18E+06 1.54E+06 1.37E+06 1.50E+06 8.49E+05 7.47E+05 9.68E+05 1.07E+06 7.33E+05 9.19E+05 9.66E+05 1.11E+06 7.30E+05 1.02E+06 8.72E+05 5.31E+05 5.81E+05 3.86E+05 L-Carnitine 2.97E+07 2.96E+07 2.65E+07 2.19E+07 2.93E+07 2.90E+07 2.11E+07 2.09E+07 2.23E+07 2.59E+07 2.66E+07 2.87E+07 9.17E+06 3.30E+07 2.36E+07 2.35E+07 1.69E+07 2.29E+07 2.50E+07 2.31E+07 1.77E+07 2.65E+07 2.28E+07 3.07E+07 2.69E+07 2.39E+07 2.48E+07 1.94E+07 2.06E+07 2.24E+07 2.11E+07 1.68E+07 1.71E+07 1.91E+07 9.08E+06 3.29E+07 2.26E+07 1.76E+07 1.92E+07 1.68E+07 2.04E+07 2.27E+07 2.10E+07 3.48E+07 3.15E+07 2.88E+07 2.93E+07 2.94E+07 2.70E+07 2.35E+07 1.97E+07 2.06E+07 1.45E+07 3.45E+07 2.12E+07 1.60E+07 2.87E+07 8.55E+06 acetyl-carnitine (acyl-C2) 5.49E+07 4.77E+07 4.62E+07 3.68E+07 5.03E+07 4.70E+07 3.33E+07 2.70E+07 2.57E+07 3.85E+07 4.95E+07 4.76E+07 1.26E+07 5.28E+07 4.51E+07 3.38E+07 2.67E+07 3.18E+07 4.04E+07 4.11E+07 2.45E+07 3.44E+07 3.37E+07 4.34E+07 3.98E+07 3.96E+07 3.08E+07 3.57E+07 3.36E+07 3.55E+07 3.37E+07 2.67E+07 3.31E+07 3.98E+07 5.77E+07 5.22E+07 3.59E+07 2.73E+07 2.99E+07 2.67E+07 3.51E+07 3.38E+07 3.06E+07 5.45E+07 4.84E+07 4.35E+07 4.02E+07 3.44E+07 3.56E+07 3.49E+07 2.64E+07 3.41E+07 2.21E+07 5.83E+07 4.64E+07 3.29E+07 4.73E+07 5.96E+07 propionyl-carnitine (acyl-C3) 1.16E+06 1.10E+06 7.37E+05 4.51E+05 8.59E+05 8.82E+05 5.44E+05 4.72E+05 5.42E+05 1.04E+06 1.08E+06 7.39E+05 1.90E+05 7.54E+05 7.45E+05 5.00E+05 4.12E+05 4.87E+05 7.11E+05 7.85E+05 4.03E+05 4.33E+05 3.57E+05 6.43E+05 7.20E+05 4.69E+05 3.90E+05 7.46E+05 7.03E+05 1.02E+06 6.67E+05 7.33E+05 5.13E+05 6.94E+05 7.36E+05 1.62E+06 6.39E+05 5.36E+05 8.14E+05 7.60E+05 7.26E+05 9.05E+05 7.32E+05 2.15E+06 7.62E+05 8.67E+05 7.96E+05 1.01E+06 7.71E+05 8.69E+05 3.89E+05 6.40E+05 3.73E+05 9.93E+05 9.01E+05 5.01E+05 5.92E+05 6.04E+05 butanoyl-l-carnitine (acyl-C4) 3.22E+05 2.59E+05 3.16E+05 1.78E+05 3.14E+05 2.43E+05 3.30E+05 1.99E+05 1.32E+05 2.94E+05 3.59E+05 2.29E+05 7.62E+04 2.43E+05 2.29E+05 2.35E+05 1.62E+05 2.57E+05 2.20E+05 1.46E+05 1.14E+05 1.74E+05 1.46E+05 4.28E+05 1.35E+05 1.37E+05 1.50E+05 1.82E+05 4.64E+05 3.00E+05 2.24E+05 1.99E+05 1.64E+05 1.79E+05 4.52E+05 5.07E+05 1.49E+05 1.94E+05 2.73E+05 1.92E+05 1.96E+05 3.10E+05 3.08E+05 6.49E+05 2.49E+05 1.53E+05 2.28E+05 2.56E+05 3.09E+05 1.76E+05 1.33E+05 1.61E+05 1.79E+05 2.71E+05 1.79E+05 2.38E+05 3.02E+05 2.29E+05 acyl-C4-OH (Hydroxybutyrylcarnitine) 1.80E+05 1.21E+05 9.50E+04 9.10E+04 1.02E+05 1.16E+05 1.93E+04 7.99E+04 9.29E+04 1.36E+05 1.46E+05 2.54E+05 2.98E+04 1.04E+05 1.11E+05 5.14E+04 6.06E+04 1.02E+05 1.48E+05 1.24E+05 4.44E+04 1.15E+05 1.53E+05 1.31E+05 9.29E+04 1.18E+05 7.95E+04 2.34E+05 4.03E+04 1.05E+05 1.02E+05 1.11E+05 1.24E+05 1.21E+05 3.81E+05 1.90E+05 9.05E+04 6.50E+04 1.02E+05 7.08E+04 1.15E+05 1.31E+05 1.37E+05 2.78E+05 1.84E+05 1.58E+05 1.32E+05 1.33E+05 1.71E+04 1.01E+05 9.27E+04 6.42E+04 4.74E+04 1.49E+05 1.75E+05 6.76E+04 1.62E+05 4.82E+05 acyl-C5:1 (Tiglylcarnitine) 5.57E+04 8.62E+04 6.95E+04 5.27E+04 4.90E+04 1.59E+04 4.15E+04 2.90E+04 3.13E+04 4.89E+04 4.42E+04 9.93E+04 1.82E+04 1.72E+04 1.67E+04 2.06E+04 2.43E+04 2.31E+04 2.09E+04 2.93E+04 2.33E+04 4.05E+04 3.32E+04 4.08E+04 1.36E+04 3.53E+04 1.31E+04 1.72E+04 4.17E+04 1.89E+04 2.81E+04 5.37E+04 3.29E+04 7.58E+03 2.60E+04 3.00E+04 2.64E+04 3.42E+04 1.72E+04 2.19E+04 4.22E+04 8.70E+04 6.87E+04 8.96E+03 2.82E+04 2.70E+04 2.14E+04 1.76E+04 1.27E+04 3.72E+04 5.75E+03 3.57E+04 4.20E+04 2.23E+04 1.51E+04 7.26E+03 1.51E+04 9.32E+03 acyl-C5-OH (hydroxyisovalerylcarnitine) 1.20E+05 4.76E+04 6.72E+04 3.65E+04 7.55E+04 5.54E+04 2.86E+04 5.08E+04 3.46E+04 7.31E+04 8.92E+04 9.65E+04 1.12E+04 8.61E+04 5.01E+04 3.41E+04 7.29E+04 1.60E+04 7.85E+04 7.04E+04 3.34E+04 7.99E+04 4.82E+04 8.88E+04 9.10E+04 3.12E+04 5.53E+04 5.81E+04 6.91E+04 6.21E+04 2.06E+04 7.37E+04 4.13E+04 5.57E+04 3.43E+04 1.02E+05 3.45E+04 6.10E+04 4.04E+04 3.40E+04 6.68E+04 5.46E+04 4.40E+04 1.14E+05 6.89E+04 1.13E+05 7.83E+04 6.74E+04 1.77E+04 4.32E+04 1.67E+04 5.75E+04 2.17E+04 4.94E+04 4.71E+04 6.12E+04 6.01E+04 3.51E+04 hexanoyl-L-carnitine (acyl-C6) 1.08E+05 5.71E+04 3.29E+04 2.35E+04 2.95E+04 2.46E+04 1.86E+04 1.94E+04 2.28E+04 1.02E+04 2.91E+04 3.56E+04 4.63E+03 3.52E+04 2.66E+04 1.22E+04 1.06E+04 8.82E+03 4.37E+04 2.47E+04 1.48E+04 8.51E+03 1.61E+04 4.77E+04 2.55E+04 1.49E+04 1.30E+04 3.35E+04 2.11E+04 1.48E+04 1.44E+04 1.34E+04 2.01E+04 1.83E+04 8.38E+04 4.35E+04 1.47E+04 1.29E+04 2.91E+04 1.17E+04 1.84E+04 2.60E+04 2.14E+04 5.87E+04 1.99E+04 2.87E+04 2.12E+04 3.19E+04 2.39E+04 1.23E+04 5.92E+03 6.63E+03 2.58E+04 3.72E+04 3.54E+04 2.57E+04 3.14E+04 1.62E+05 L-octanoylcarnitine (acyl-C8) 5.37E+04 3.18E+04 2.42E+04 1.71E+04 1.07E+04 4.30E+04 2.07E+04 1.94E+04 1.89E+04 1.17E+04 2.42E+04 2.76E+04 1.43E+04 1.64E+04 1.33E+04 1.56E+04 9.15E+03 2.47E+04 1.77E+04 2.25E+04 1.08E+04 1.98E+04 1.03E+04 5.50E+04 3.54E+04 2.20E+04 2.18E+04 4.77E+04 1.68E+04 9.18E+03 9.49E+03 1.38E+04 1.04E+04 3.43E+04 6.54E+04 5.34E+04 3.20E+04 9.09E+03 2.79E+04 1.15E+04 1.76E+04 1.91E+04 3.03E+04 2.98E+04 2.87E+04 3.07E+04 3.06E+04 2.84E+04 2.68E+04 2.63E+04 9.07E+03 1.19E+04 6.60E+03 2.29E+04 4.50E+04 1.15E+04 2.59E+04 1.04E+05 O-Decenoyl-L-carnitine (acyl-C10:1) 8.18E+04 3.97E+04 3.52E+04 1.89E+04 1.51E+04 2.51E+04 2.84E+04 3.69E+04 1.57E+04 3.23E+04 1.68E+04 4.37E+04 1.57E+04 1.66E+04 1.13E+04 9.19E+03 1.88E+04 2.54E+04 2.62E+04 1.64E+04 8.93E+03 1.43E+04 2.83E+04 4.74E+04 2.19E+04 1.94E+04 2.39E+04 3.94E+04 8.38E+03 2.67E+04 1.12E+04 2.39E+04 7.15E+03 2.32E+04 6.07E+04 4.93E+04 2.28E+04 3.56E+04 2.91E+04 1.23E+04 2.99E+04 1.68E+04 8.37E+03 5.05E+04 1.87E+04 1.99E+04 3.76E+04 2.85E+04 2.71E+04 2.58E+04 2.43E+04 1.12E+04 8.03E+03 2.69E+04 3.19E+04 3.64E+04 2.93E+04 9.68E+04 O-dodecanoyl-carnitine (acyl-C12) 7.45E+04 7.18E+04 2.38E+04 1.61E+04 2.70E+04 3.62E+04 3.00E+04 2.78E+04 4.16E+04 4.05E+04 2.62E+04 6.73E+04 5.95E+03 3.71E+04 2.50E+04 1.67E+04 3.39E+04 2.19E+04 2.44E+04 3.04E+04 5.71E+03 2.57E+04 3.93E+04 5.36E+04 2.45E+04 1.85E+04 3.36E+04 4.69E+04 3.11E+04 1.14E+04 2.47E+04 2.98E+04 4.64E+04 3.43E+04 1.34E+05 5.51E+04 1.33E+05 2.22E+04 2.74E+04 2.09E+04 3.19E+04 1.84E+04 1.93E+04 5.47E+04 3.59E+04 3.00E+04 3.41E+04 6.70E+04 2.20E+04 2.07E+04 1.81E+04 1.28E+04 1.69E+04 4.18E+04 2.16E+04 3.10E+04 4.17E+04 4.33E+05 O-dodecenoyl-carnitine (acyl-C12:1) 3.05E+04 1.54E+04 5.35E+03 1.48E+04 1.55E+04 1.82E+04 6.22E+03 8.91E+03 7.28E+03 2.50E+04 1.97E+04 3.24E+04 7.04E+03 1.41E+04 1.14E+04 5.40E+03 7.96E+03 1.16E+04 1.98E+04 2.56E+04 1.09E+04 1.20E+04 1.01E+04 4.56E+04 1.13E+04 9.08E+03 8.17E+03 3.65E+04 5.48E+03 7.20E+03 7.00E+03 6.66E+03 1.59E+04 1.23E+04 5.58E+04 2.90E+04 2.07E+04 9.81E+03 2.92E+04 6.21E+03 2.66E+04 8.42E+03 6.77E+03 4.74E+04 8.01E+03 3.72E+04 2.51E+04 1.37E+04 7.59E+03 1.39E+04 1.33E+04 5.89E+03 2.81E+03 2.81E+04 1.30E+04 1.65E+04 2.62E+04 7.40E+04 O-tetradecanoyl-L-carnitine (acyl-C14) 1.12E+05 1.38E+05 4.87E+04 4.81E+04 2.52E+04 7.59E+04 4.54E+04 6.56E+04 8.43E+04 6.37E+04 4.72E+04 1.03E+05 8.19E+03 6.43E+04 1.88E+04 4.07E+04 5.68E+04 3.57E+04 6.93E+04 9.03E+04 3.00E+04 5.16E+04 6.66E+04 1.13E+05 5.59E+04 3.02E+04 5.05E+04 1.00E+05 4.89E+04 2.36E+04 3.62E+04 3.97E+04 7.69E+04 8.45E+04 2.49E+05 1.28E+05 7.59E+04 4.76E+04 6.08E+04 6.63E+04 6.25E+04 4.57E+04 2.57E+04 4.13E+04 6.39E+04 6.63E+04 4.34E+04 3.92E+04 3.72E+04 6.93E+04 2.97E+04 2.05E+04 1.49E+04 1.04E+05 4.05E+04 5.04E+04 6.38E+04 2.81E+05 Tetradecenoyl Carnitine (acyl-C14:1) 1.98E+05 9.80E+04 4.53E+04 8.12E+04 5.06E+04 7.43E+04 4.99E+04 8.49E+04 7.48E+04 7.75E+04 5.61E+04 1.22E+05 2.24E+04 7.64E+04 3.35E+04 4.13E+04 7.81E+04 4.77E+04 9.49E+04 1.17E+05 5.29E+04 7.53E+04 8.50E+04 2.00E+05 6.62E+04 4.43E+04 6.41E+04 2.02E+05 6.43E+04 4.85E+04 7.97E+04 7.29E+04 6.64E+04 9.27E+04 2.67E+05 1.92E+05 9.89E+04 6.90E+04 1.02E+05 6.15E+04 7.40E+04 4.84E+04 3.59E+04 1.05E+05 9.04E+04 8.38E+04 7.82E+04 9.70E+04 7.24E+04 8.50E+04 7.67E+04 5.39E+04 3.00E+04 1.47E+05 7.20E+04 9.65E+04 6.45E+04 3.23E+05 L-Palmitoylcarnitine (acyl-C16) 1.12E+05 1.05E+05 6.19E+04 8.77E+04 4.03E+04 9.56E+04 5.62E+04 7.73E+04 9.23E+04 7.89E+04 4.42E+04 8.97E+04 1.65E+04 5.94E+04 3.09E+04 5.47E+04 8.46E+04 5.17E+04 7.82E+04 7.88E+04 4.72E+04 5.90E+04 5.20E+04 1.32E+05 6.44E+04 4.69E+04 7.55E+04 1.09E+05 6.04E+04 2.42E+04 4.99E+04 5.96E+04 6.97E+04 9.45E+04 2.71E+05 1.02E+05 1.16E+05 5.40E+04 7.98E+04 6.46E+04 7.07E+04 4.46E+04 3.36E+04 4.29E+04 7.42E+04 9.43E+04 7.33E+04 4.84E+04 7.11E+04 8.56E+04 5.18E+04 2.88E+04 3.41E+04 9.20E+04 8.09E+04 8.90E+04 1.09E+05 3.26E+05 Hexadecenoyl-carnitine (acyl-C16:1) 8.20E+04 8.93E+04 3.46E+04 3.43E+04 1.62E+04 5.34E+04 2.88E+04 4.07E+04 6.76E+04 4.52E+04 2.48E+04 5.25E+04 1.59E+04 6.30E+04 1.98E+04 4.16E+04 8.28E+04 3.36E+04 3.72E+04 6.34E+04 2.91E+04 3.82E+04 4.52E+04 6.59E+04 3.42E+04 2.66E+04 5.93E+04 1.01E+05 3.81E+04 1.79E+04 3.40E+04 3.05E+04 6.43E+04 8.14E+04 2.03E+05 9.41E+04 8.45E+04 3.35E+04 4.42E+04 4.03E+04 5.95E+04 2.85E+04 1.51E+04 3.04E+04 5.37E+04 5.41E+04 3.60E+04 4.82E+04 2.63E+04 5.00E+04 2.79E+04 1.76E+04 1.67E+04 8.91E+04 5.85E+04 3.50E+04 6.29E+04 1.79E+05 O-octadecenoyl-L-carnitine (acyl-C18:1) 1.07E+05 6.18E+04 4.05E+04 5.94E+04 3.52E+04 9.24E+04 3.64E+04 9.36E+04 8.52E+04 4.79E+04 3.61E+04 8.83E+04 1.98E+04 6.91E+04 3.01E+04 5.22E+04 9.89E+04 5.51E+04 6.62E+04 8.05E+04 3.78E+04 4.76E+04 6.47E+04 1.21E+05 7.51E+04 4.19E+04 7.01E+04 1.12E+05 4.06E+04 2.72E+04 5.14E+04 5.35E+04 5.92E+04 7.26E+04 3.01E+05 8.75E+04 1.15E+05 4.83E+04 5.68E+04 4.36E+04 7.55E+04 4.59E+04 2.88E+04 5.13E+04 8.79E+04 1.22E+05 9.33E+04 5.77E+04 6.41E+04 8.71E+04 4.53E+04 2.95E+04 2.03E+04 9.75E+04 1.01E+05 9.64E+04 1.28E+05 2.71E+05 acyl-C18:2 (Linoleoyl-CoA) 1.07E+05 9.98E+04 5.77E+04 8.33E+04 2.16E+04 6.06E+04 3.29E+04 5.26E+04 5.23E+04 3.78E+04 4.04E+04 9.63E+04 2.26E+04 6.95E+04 2.57E+04 3.87E+04 1.01E+05 4.78E+04 5.93E+04 7.87E+04 2.76E+04 4.41E+04 6.64E+04 1.38E+05 3.33E+04 3.42E+04 6.27E+04 1.47E+05 3.87E+04 2.70E+04 5.48E+04 7.94E+04 6.68E+04 5.97E+04 1.67E+05 9.79E+04 1.02E+05 4.05E+04 5.09E+04 4.78E+04 7.00E+04 6.53E+04 5.39E+04 3.89E+04 7.53E+04 8.66E+04 6.69E+04 4.81E+04 4.40E+04 8.25E+04 3.33E+04 3.16E+04 3.57E+04 1.38E+05 5.72E+04 5.25E+04 6.81E+04 1.52E+05 acyl-C18:2-OH 1.41E+04 9.17E+03 1.15E+04 2.62E+04 1.70E+03 5.41E+03 0.00E+00 0.00E+00 1.10E+04 1.21E+04 6.77E+03 1.99E+04 0.00E+00 1.68E+04 0.00E+00 1.02E+04 1.19E+04 1.36E+04 8.73E+03 1.32E+04 0.00E+00 1.22E+04 1.46E+04 2.83E+03 2.72E+03 7.43E+03 0.00E+00 2.74E+04 5.56E+03 1.81E+03 1.29E+04 1.07E+04 1.53E+04 8.91E+03 2.80E+04 8.94E+03 9.97E+03 5.07E+03 3.07E+03 4.77E+03 1.06E+04 1.50E+04 1.51E+04 1.01E+04 1.47E+04 1.06E+04 1.04E+04 1.01E+04 1.21E+04 1.27E+04 0.00E+00 8.07E+03 4.97E+03 1.89E+04 3.25E+03 9.34E+03 6.06E+03 3.57E+04 acyl-C20:4 2.30E+04 1.26E+04 1.36E+04 1.45E+04 5.65E+03 1.09E+04 6.12E+03 1.43E+04 1.19E+04 8.29E+03 8.61E+03 1.77E+04 6.47E+03 2.62E+04 3.24E+03 5.29E+03 1.50E+04 9.36E+03 2.32E+04 1.84E+04 6.35E+03 9.29E+03 1.22E+04 3.28E+04 1.25E+04 7.52E+03 1.35E+04 2.73E+04 8.93E+03 5.11E+03 1.11E+04 1.97E+04 1.07E+04 1.21E+04 3.01E+04 2.00E+04 1.39E+04 8.54E+03 1.55E+04 1.06E+04 2.09E+04 1.18E+04 4.73E+03 1.30E+04 1.89E+04 1.79E+04 1.49E+04 1.06E+04 1.10E+04 1.78E+04 9.03E+03 7.29E+03 5.94E+03 2.32E+04 9.46E+03 7.30E+03 9.81E+03 1.50E+04 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name KEGG ID parent medRt L-alanine C00041 90.0549 0.68 L-arginine C00062 175.1189 0.62 L-asparagine C00152 133.0606 0.70 L-aspartate C00049 134.0447 0.71 L-glutamate C00025 148.0605 0.68 L-glutamine C00064 147.0763 0.67 L-histidine C00135 156.0768 0.61 L-leucine/isoleucine C00123 132.1017 0.67 L-lysine C00047 147.1127 0.59 L-methionine C00073 150.0583 0.67 L-phenylalanine C00079 166.0860 0.67 L-proline C00148 116.0705 0.67 L-serine C00065 106.0498 0.68 L-threonine C00188 120.0654 0.66 L-tryptophan C00078 205.0969 1.72 L-tyrosine C00082 182.0810 0.68 L-valine C00183 118.0860 0.68 L-cystine C00491 241.0305 0.70 Cytosine C00380 112.0505 0.67 IDP C00104 429.0241 0.87 Allantoate C00499 177.0608 0.60 5-Hydroxyisourate C11821 185.0322 0.66 2',3'-Cyclic CMP C02354 306.0489 0.70 5-6-Dihydrothymine C00906 129.0658 0.66 Pyridoxal C00250 168.0654 0.68 Pyridoxamine 5'-phosphate C00647 249.0605 1.72 Nicotinamide C00153 123.0552 0.83 Phosphate C00009 98.9840 0.76 Glutathione C00051 308.0905 0.87 Glutathione disulfide C00127 613.1578 0.87 5-Oxoproline C01879 130.0498 0.67 S-Glutathionyl-L-cysteine C05526 427.0940 0.70 Dimethylglycine C01026 104.0705 0.67 Phosphoserine C02532 186.0185 0.70 Ornithine C01602 133.0971 0.59 L-Citrulline C00327 176.1028 0.66 Spermidine C00315 146.1651 0.63 5-Guanidino-2-oxopentanoate C03771 174.0871 0.67 Creatine C00300 132.0768 0.67 Creatinine C00791 114.0661 0.67 N-Acetylornithine C00437 175.1076 0.67 Guanidinoacetate C00581 118.0612 0.66 trans-4-Hydroxy-L-proline C01157 132.0656 0.67 Pantothenol C00864 220.1174 1.70 5-6-Dihydrouracil C00429 115.0502 0.68 Taurine C00245 126.0219 0.70 L-Methionine S-oxide C02989 166.0531 0.85 Indole C00463 118.0650 1.73 Indole-3-acetaldehyde C00637 160.0756 0.67 Indole-3-acetate C00954 176.0704 1.88 Indoxyl C05658 134.0600 1.84 kynurenine C00328 209.0918 0.67 Anthranilate C00108 138.0550 0.67 Serotonin C00780 177.1021 0.67 Ectoine C06231 143.0815 0.67 N-Methylethanolamine phosphate C01210 156.0420 0.65 Sphingosine C00319 300.2891 1.98 Sphingosine 1-phosphate C06124 380.2553 1.90 Acetylcholine C01996 146.1175 0.67 L-Carnitine C00318 162.1123 0.66 acetyl-carnitine (acyl-C2) C02571 204.1229 0.67 propionyl-carnitine (acyl-C3) C03017 218.1385 0.67 butanoyl-l-carnitine (acyl-C4) C02862 232.1540 1.70 acyl-C4-OH (Hydroxybutyrylcarnitine) HMDB13127 248.1486 0.67 acyl-C5:1 (Tiglylcarnitine) HMDB02366 244.1540 1.92 acyl-C5-OH (hydroxyisovalerylcarnitine) ac107 262.1642 0.67 hexanoyl-L-carnitine (acyl-C6) HMDB00756 260.1854 1.77 L-octanoylcarnitine (acyl-C8) C02838 288.2163 1.83 O-Decenoyl-L-carnitine (acyl-C10:1) CID57357170 314.2321 1.85 O-dodecanoyl-carnitine (acyl-C12) HMDB02250 344.2791 1.93 O-dodecenoyl-carnitine (acyl-C12:1) HMDB13326 342.2635 1.91 O-tetradecanoyl-L-carnitine (acyl-C14) HMDB05066 372.3103 1.99 Tetradecenoyl Carnitine (acyl-C14:1) HMDB13329 370.2948 1.96 L-Palmitoylcarnitine (acyl-C16) C02990 400.3417 2.06 Hexadecenoyl-carnitine (acyl-C16:1) HMDB06317 398.3260 2.00 O-octadecenoyl-L-carnitine (acyl-C18:1) HMDB06351 426.3573 2.07 acyl-C18:2 (Linoleoyl-CoA) HMDB01064 424.3414 2.02 acyl-C18:2-OH ac123 440.3362 1.97 acyl-C20:4 ac125 448.3408 2.01 METABOLITES_END #END