{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST000925","ANALYSIS_ID":"AN001518","VERSION":"1","CREATED_ON":"January 24, 2018, 2:00 pm"},

"PROJECT":{"PROJECT_TITLE":"The Multi-Faceted Roles of MuRF1 in Unloaded HL-1 Cardiomyocyte-Derived Cell Metabolism Identified by Untargeted Metabolomics","PROJECT_TYPE":"GC-MS Non-targeted analysis","PROJECT_SUMMARY":"Stretch-induced alterations in metabolites (+/- MuRF1 knock-down) in HL-1 cardiomyocyte-derived cell line","INSTITUTE":"University of North Carolina","DEPARTMENT":"McAllister heart Institute, Dept. Pathology & Lab Medicine, Dept. Pharmacology","LABORATORY":"Multiple Centers","LAST_NAME":"Willis","FIRST_NAME":"Monte","ADDRESS":"111 Mason Farm road, Chapel Hill, North Carolina, 27599-7126, USA","EMAIL":"monte_willis@med.unc.edu","PHONE":"(984) 999-5431","FUNDING_SOURCE":"NIH, Leducq Foundation"},

"STUDY":{"STUDY_TITLE":"MuRF1-Related Metabolomic Changes in Stretched and Unloaded HL-1 Cells","STUDY_SUMMARY":"Introduction: Left ventricular assist devices (LVADs) provide significant pressure and volume unloading, which reverse key structural features of heart failure, including hypertrophy, fibrosis, and altered sympathetic innervation. This has led to LVADs increasing utilization as both a bridge or destination therapy for heart failure. While distinct metabolic changes occur in the human myocardium with LVAD placement, the specific molecular mechanisms underlying these changes have not been identified. Objectives: To identify the role of MuRF1 in the metabolic changes in cardiomyocytes unloading in vitro. Methods: HL-1 atrial cardiomyocyte cells were plated on silastic membranes coated with gelatin/fibronectin and transduced with AdshRNA MuRF1 (or AdshRNA Scramble control) to knock-down MuRF1 protein to <25% of controls and subjected to 15% biaxial stretch at 1 Hz using the Flexcell FX-5000™ Compression System in serum free DMEM (or no-stretch). After 6 hours stretch, media was collected in parallel with time-matched no-stretch controls, followed by serial collections at 1, 3, 6, and 12 hours unloading (i.e. after termination of stretch). Media was analyzed by untargeted metabolomics using GC-MS. Results: After 6 hours stretch, control HL-1 cell media (AdshRNA Scramble) had 19 significantly altered metabolites compared to non-stretched control cell media (AdshRNA Scramble) by t-test, involved in: 1) glyoxylate and dicarboxylate metabolism (p=0.00087043, FDR=0.071375), 2) methane metabolism (p=0.0041113, FDR=0.089824), 3) glycine, serine and threonine metabolism (p=0.0043816, FDR=0.089824), and 4) aminoacyl-tRNA biosynthesis(p=0.0060141, FDR=0.09863). To determine the role of MuRF1 in stretch, we additionally compared the AdshRNA Scramble groups to AdshRNA MuRF1 +/- stretch at 6 hours and identified 41 significant metabolites (of 79 identified) by ANOVA, involved in: 1) phenylalanine, tyrosine, and tryptophan biosynthesis (p=0.0036482, FDR=0.05983), 2) aminoacyl-tRNA biosynthesis (p=3.74E-07, FDR=3.06E-05), and 3) valine, leucine, and isoleucine biosynthesis (p=0.0021624, FDR=0.053255). We next compared the 6 hour stretch time point of the four groups to the 1, 3, 6, and 12 hours unloading conditions to identify MuRF1-associated metabolites during the unloading period. At 12 hours of unloading (representative 1, 3, and 6 hours unloading), MuRF1 knock-down cell media had 35 (of 82 named metabolites) significantly different metabolites by ANOVA involved in 1) phenylalanine, tyrosine and tryptophan biosynthesis (p=0.0023668, FDR=0.048519), 2) aminoacyl-tRNA biosynthesis (p=0.0011403, FDR=0.0032631), 3) phenylalanine metabolism (P= 0.0011403, FDR 0.042673),and arginine and proline metabolism (p=0.0015612, FDR 0.042673). A final analysis comparing all four groups across all five time points identified 21 significant metabolites. When MuRF1 was knocked down (no stretch), these 21 metabolites were significantly increased without stretch. In response to stretch and unloading, these metabolites were further decreased in AdshRNA Scramble (control) cell media decreased. In contrast, these stretch and unloading induced decreases were attenuated in AdshRNA MuRF1 cell media. These metabolites included nine (9) amino acids (citrulline, phenylalanine, tyrosine, asparagine, 2-ketovaline, and -ketoleucine/ketoisoleucine, threonine, isoleucine, leucine), three (3) metabolic co-factors (Pantothenic acid, Myoinositol, 5,6-Dihydrouracil), and one fatty acid (stearic acid). Conclusion: These studies identify for the first time a role for MuRF1 in generating key amino acids recently reported in LVAD unloading in human myocardium using an in vitro model of atrial cardiomyocyte unloading.","INSTITUTE":"University of North Carolina","DEPARTMENT":"McAllister heart Institute, Department of Internal medicine","LABORATORY":"Multiple Centers","LAST_NAME":"Willis","FIRST_NAME":"Monte","ADDRESS":"111 Mason Farm road, Chapel Hill, North Carolina, 27599-7126, USA","EMAIL":"monte_willis@med.unc.edu","PHONE":"(984) 999-5431","STUDY_COMMENTS":"Cell culture media"},

"SUBJECT":{"SUBJECT_TYPE":"Animal","SUBJECT_SPECIES":"Mus musculus","TAXONOMY_ID":"10090"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"1",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"2",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"3",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"4",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"5",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"6",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"7",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"8",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"9",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"10",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"11",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"12",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"13",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"14",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"15",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"16",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"17",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"18",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"Non-stretched"}
},
{
"Subject ID":"-",
"Sample ID":"19",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"20",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"21",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"22",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"23",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"24",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch"}
},
{
"Subject ID":"-",
"Sample ID":"31",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"32",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"33",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"34",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"35",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"36",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"43",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"44",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"45",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"46",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"47",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"48",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 1 hour unloading"}
},
{
"Subject ID":"-",
"Sample ID":"55",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"56",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"57",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"58",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"59",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"60",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"67",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"68",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"69",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"70",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"71",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"72",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 3 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"79",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"80",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"81",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"82",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"83",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"84",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"91",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"92",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"93",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"94",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"95",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"96",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 6 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"103",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"104",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"105",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"106",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"107",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"108",
"Factors":{"Sample type":"Ad.shRNA Scramble","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"115",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"116",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"117",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"118",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"119",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
},
{
"Subject ID":"-",
"Sample ID":"120",
"Factors":{"Sample type":"Ad.shRNA MuRF1","Stretch Cycle":"6 hours stretch, 12 hours unloading"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Cell culture media was collected and immediately stored at -80C.","SAMPLE_TYPE":"cardiomyocyte cells"},

"TREATMENT":{"TREATMENT_SUMMARY":"No further treatment prior to extraction was performed."},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"The samples were crash deprotonized by methanol precipitation and spiked with D27-deuterated myristic acid (D27-C14:0) as an internal standard for retention-time locking and dried. The trimethylsilyl-D27-C14:0 standard retention time (RT) was set at 16.727 min. Reactive carbonyls were stabilized at 50C with methoxyamine hydrochloride in dry pyridine. Metabolites were made volatile with TMS groups using N-methyl N-(trimethylsilyl) trifluoroacetamide or MSTFA with catalytic trimethylchlorosilane at 50C."},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_SUMMARY":"GC/MS methods follow previous studies using a 6890 N GC connected to a 5975 Inert single quadrupole MS (Agilent Technologies, Santa Clara, CA) (Bonikos et al. 1975; Fiehn 2008; Kind et al. 2009). The two wall-coated, open-tubular GC columns connected in series are both from J&W/Agilent (part 122-5512), DB5-MS, 15 meters in length, 0.25 mm in diameter, with an 0.25-l m luminal film. Positive ions generated with conventional electron ionization at 70 eV are scanned broadly from 600 to 50 m/z in the detector throughout the 45 min cycle time.","CHROMATOGRAPHY_TYPE":"GC","INSTRUMENT_NAME":"Agilent 6890N","COLUMN_NAME":"Agilent DB5-MS (15m × 0.25mm, 0.25um)"},

"ANALYSIS":{"ANALYSIS_TYPE":"MS"},

"MS":{"MS_COMMENTS":"-","INSTRUMENT_NAME":"Agilent 5975","INSTRUMENT_TYPE":"Single quadrupole","MS_TYPE":"EI","ION_MODE":"POSITIVE"},

"MS_METABOLITE_DATA":{
"Units":"Peak values (Log transformed)",

"Data":[{"Metabolite":"5,6-Dihydrouracil","1":"","2":"","3":"","4":"","5":"","6":"","7":"13.90","8":"","9":"14.47","10":"","11":"14.73","12":"15.18","13":"14.72","14":"13.85","15":"16.32","16":"","17":"13.64","18":"14.90","19":"14.69","20":"14.41","21":"15.60","22":"15.11","23":"14.61","24":"15.26","31":"14.88","32":"14.86","33":"","34":"15.35","35":"15.14","36":"15.32","43":"15.06","44":"15.60","45":"15.70","46":"16.07","47":"16.10","48":"15.89","55":"15.58","56":"15.36","57":"15.41","58":"15.31","59":"15.61","60":"16.18","67":"15.12","68":"16.17","69":"16.47","70":"15.89","71":"15.48","72":"15.83","79":"15.30","80":"15.43","81":"15.88","82":"15.96","83":"15.57","84":"16.21","91":"15.43","92":"15.53","93":"16.82","94":"15.79","95":"16.20","96":"15.99","103":"14.79","104":"14.52","105":"16.45","106":"15.88","107":"12.87","108":"15.87","115":"16.03","116":"15.43","117":"15.94","118":"16.00","119":"16.44","120":"16.40"},{"Metabolite":"1-Dodecanol","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"","16":"14.05","17":"13.78","18":"","19":"","20":"","21":"","22":"15.23","23":"13.31","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"14.02","48":"","55":"","56":"","57":"","58":"","59":"","60":"","67":"","68":"15.77","69":"","70":"","71":"13.82","72":"14.20","79":"","80":"","81":"","82":"","83":"13.39","84":"","91":"13.16","92":"","93":"13.88","94":"","95":"","96":"","103":"13.42","104":"","105":"","106":"","107":"","108":"","115":"","116":"","117":"13.98","118":"","119":"","120":"14.26"},{"Metabolite":"1,2-Propanediol","1":"19.03","2":"18.86","3":"19.03","4":"19.12","5":"18.89","6":"18.93","7":"19.22","8":"18.41","9":"19.19","10":"19.76","11":"19.15","12":"19.99","13":"18.50","14":"18.70","15":"19.61","16":"19.22","17":"18.34","18":"19.16","19":"20.00","20":"19.84","21":"20.35","22":"20.35","23":"20.19","24":"20.61","31":"19.99","32":"19.24","33":"19.90","34":"19.93","35":"20.13","36":"20.15","43":"20.14","44":"20.02","45":"20.46","46":"20.50","47":"20.00","48":"20.47","55":"19.62","56":"19.90","57":"19.97","58":"20.35","59":"20.35","60":"20.75","67":"19.59","68":"20.00","69":"","70":"20.60","71":"20.16","72":"20.92","79":"20.23","80":"20.07","81":"19.91","82":"20.16","83":"20.54","84":"20.80","91":"20.82","92":"19.89","93":"21.11","94":"19.58","95":"20.54","96":"20.64","103":"19.10","104":"19.82","105":"19.67","106":"20.53","107":"19.71","108":"20.77","115":"21.11","116":"20.59","117":"","118":"","119":"20.70","120":"21.21"},{"Metabolite":"1,3-Dihydroxyacetone","1":"18.84","2":"18.18","3":"18.95","4":"18.74","5":"18.94","6":"18.58","7":"18.27","8":"17.67","9":"18.11","10":"18.67","11":"17.87","12":"18.97","13":"17.98","14":"18.24","15":"17.79","16":"17.79","17":"18.16","18":"17.52","19":"18.25","20":"17.84","21":"17.51","22":"17.96","23":"18.18","24":"17.79","31":"18.73","32":"18.29","33":"","34":"18.68","35":"18.89","36":"18.31","43":"17.74","44":"17.81","45":"","46":"17.43","47":"","48":"","55":"18.64","56":"18.37","57":"18.83","58":"18.73","59":"18.41","60":"18.63","67":"18.42","68":"18.18","69":"","70":"18.68","71":"17.83","72":"18.10","79":"17.82","80":"18.58","81":"18.40","82":"18.76","83":"18.91","84":"19.02","91":"","92":"17.89","93":"16.87","94":"16.40","95":"17.86","96":"17.76","103":"18.52","104":"19.04","105":"17.29","106":"19.44","107":"18.58","108":"19.50","115":"17.89","116":"17.86","117":"17.74","118":"17.79","119":"","120":"18.37"},{"Metabolite":"2-Amino-2-Methyl-1,3-Propanediol","1":"18.02","2":"17.48","3":"","4":"18.25","5":"","6":"17.92","7":"","8":"","9":"","10":"18.08","11":"17.67","12":"","13":"17.69","14":"17.77","15":"16.81","16":"17.47","17":"","18":"17.52","19":"17.46","20":"17.82","21":"17.81","22":"17.72","23":"17.58","24":"18.18","31":"17.86","32":"17.56","33":"","34":"","35":"","36":"","43":"","44":"17.69","45":"","46":"","47":"","48":"","55":"17.88","56":"17.98","57":"","58":"","59":"","60":"","67":"","68":"17.62","69":"","70":"","71":"","72":"","79":"17.64","80":"","81":"","82":"","83":"","84":"","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"","105":"","106":"","107":"","108":"","115":"","116":"","117":"","118":"","119":"","120":"17.70"},{"Metabolite":"2-Ethylhexanoic Acid","1":"","2":"","3":"","4":"","5":"","6":"14.07","7":"","8":"","9":"","10":"13.27","11":"","12":"","13":"","14":"15.71","15":"13.26","16":"","17":"14.68","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"13.78","47":"","48":"15.81","55":"","56":"","57":"","58":"","59":"","60":"","67":"","68":"","69":"","70":"","71":"15.90","72":"16.22","79":"","80":"","81":"","82":"","83":"","84":"14.20","91":"","92":"15.37","93":"","94":"","95":"","96":"","103":"","104":"","105":"","106":"","107":"","108":"","115":"14.83","116":"","117":"","118":"13.06","119":"","120":"16.53"},{"Metabolite":"2-Hydroxy-3-Methylvaleric Acid","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"13.53","9":"14.03","10":"13.22","11":"","12":"15.09","13":"","14":"14.93","15":"14.93","16":"15.27","17":"","18":"14.82","19":"14.12","20":"14.30","21":"","22":"14.00","23":"","24":"13.53","31":"14.46","32":"13.34","33":"13.08","34":"13.69","35":"14.71","36":"","43":"14.30","44":"13.30","45":"13.22","46":"14.75","47":"","48":"14.71","55":"14.04","56":"","57":"","58":"14.80","59":"","60":"13.59","67":"","68":"","69":"12.48","70":"15.10","71":"","72":"","79":"14.29","80":"14.89","81":"13.72","82":"14.11","83":"","84":"14.82","91":"14.79","92":"","93":"14.37","94":"13.16","95":"13.91","96":"14.12","103":"14.24","104":"","105":"14.69","106":"14.73","107":"14.83","108":"15.65","115":"","116":"13.75","117":"14.04","118":"","119":"","120":""},{"Metabolite":"2-Hydroxybutyric Acid","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"14.69","11":"","12":"","13":"13.96","14":"","15":"","16":"","17":"14.26","18":"","19":"","20":"","21":"","22":"","23":"","24":"13.97","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"","57":"","58":"","59":"","60":"","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"","81":"","82":"","83":"","84":"","91":"","92":"","93":"","94":"15.73","95":"","96":"","103":"","104":"14.14","105":"","106":"","107":"","108":"","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"2-Hydroxyglutaric Acid","1":"18.92","2":"18.38","3":"19.13","4":"18.74","5":"19.65","6":"18.72","7":"18.47","8":"17.01","9":"17.18","10":"18.34","11":"17.93","12":"18.82","13":"18.14","14":"18.75","15":"18.51","16":"18.95","17":"18.46","18":"18.79","19":"18.06","20":"17.81","21":"19.24","22":"18.07","23":"","24":"18.01","31":"18.24","32":"18.51","33":"18.73","34":"18.41","35":"18.56","36":"18.77","43":"17.74","44":"17.70","45":"17.76","46":"","47":"18.25","48":"","55":"18.56","56":"18.53","57":"16.65","58":"18.34","59":"18.27","60":"18.87","67":"18.05","68":"18.30","69":"17.13","70":"18.81","71":"18.29","72":"18.84","79":"18.30","80":"19.29","81":"15.33","82":"","83":"18.79","84":"19.18","91":"18.29","92":"17.42","93":"18.19","94":"","95":"18.15","96":"18.14","103":"17.16","104":"18.69","105":"18.85","106":"18.83","107":"18.35","108":"19.30","115":"18.59","116":"17.96","117":"18.25","118":"18.25","119":"18.30","120":"18.52"},{"Metabolite":"2-Isopropylmalic Acid","1":"","2":"","3":"19.26","4":"19.70","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"19.73","14":"19.60","15":"","16":"20.48","17":"20.23","18":"20.47","19":"19.91","20":"20.39","21":"22.62","22":"20.09","23":"20.78","24":"20.54","31":"","32":"","33":"","34":"","35":"","36":"","43":"19.88","44":"19.94","45":"19.67","46":"","47":"20.58","48":"20.82","55":"","56":"","57":"","58":"","59":"","60":"","67":"20.45","68":"","69":"","70":"19.74","71":"20.86","72":"21.51","79":"19.73","80":"","81":"","82":"","83":"","84":"","91":"20.48","92":"","93":"19.80","94":"","95":"21.44","96":"21.69","103":"","104":"","105":"","106":"","107":"","108":"","115":"20.28","116":"19.49","117":"","118":"","119":"20.95","120":"21.62"},{"Metabolite":"2-Ketoleucine/Ketoisoleucine","1":"23.49","2":"23.35","3":"23.51","4":"22.42","5":"23.41","6":"23.32","7":"22.62","8":"20.85","9":"22.36","10":"22.99","11":"22.35","12":"23.28","13":"23.24","14":"23.72","15":"23.54","16":"23.91","17":"23.37","18":"23.70","19":"23.43","20":"23.19","21":"23.94","22":"23.45","23":"23.46","24":"23.59","31":"23.44","32":"23.04","33":"23.98","34":"23.19","35":"23.47","36":"23.23","43":"23.33","44":"23.47","45":"23.58","46":"23.69","47":"23.98","48":"23.34","55":"23.32","56":"23.45","57":"23.00","58":"23.56","59":"22.48","60":"23.83","67":"23.65","68":"23.88","69":"23.25","70":"24.23","71":"24.06","72":"24.39","79":"23.72","80":"23.36","81":"23.19","82":"23.83","83":"23.55","84":"23.64","91":"23.85","92":"23.24","93":"23.87","94":"21.84","95":"23.57","96":"23.99","103":"21.70","104":"23.33","105":"23.09","106":"23.36","107":"22.47","108":"23.85","115":"24.08","116":"23.74","117":"24.06","118":"23.87","119":"23.94","120":"24.10"},{"Metabolite":"2-Ketovaline","1":"20.68","2":"20.14","3":"20.53","4":"20.00","5":"20.37","6":"20.14","7":"19.78","8":"18.28","9":"19.35","10":"20.26","11":"19.38","12":"20.37","13":"20.65","14":"21.06","15":"20.70","16":"21.30","17":"20.87","18":"21.12","19":"20.63","20":"20.41","21":"21.02","22":"20.90","23":"20.50","24":"20.77","31":"20.44","32":"20.14","33":"20.44","34":"20.27","35":"20.48","36":"20.38","43":"20.53","44":"20.58","45":"20.65","46":"20.95","47":"21.08","48":"20.27","55":"20.24","56":"20.57","57":"19.99","58":"20.55","59":"20.15","60":"20.89","67":"20.98","68":"20.86","69":"19.75","70":"21.55","71":"21.33","72":"21.60","79":"21.02","80":"20.63","81":"20.22","82":"21.03","83":"20.61","84":"20.79","91":"21.00","92":"20.59","93":"20.79","94":"19.48","95":"21.04","96":"21.10","103":"18.49","104":"20.81","105":"19.92","106":"20.46","107":"19.78","108":"20.95","115":"21.23","116":"20.79","117":"21.10","118":"21.08","119":"21.08","120":"21.21"},{"Metabolite":"2-Phenylacetamide","1":"17.38","2":"","3":"15.91","4":"17.24","5":"16.11","6":"17.28","7":"16.90","8":"","9":"16.02","10":"17.30","11":"17.22","12":"17.72","13":"","14":"","15":"16.20","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"17.39","32":"","33":"","34":"17.21","35":"18.19","36":"17.04","43":"","44":"","45":"14.98","46":"15.21","47":"","48":"","55":"17.01","56":"17.31","57":"17.11","58":"17.59","59":"17.26","60":"17.86","67":"16.04","68":"16.50","69":"","70":"","71":"","72":"16.69","79":"16.15","80":"18.17","81":"","82":"16.86","83":"17.62","84":"17.87","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"16.83","105":"17.68","106":"16.93","107":"17.63","108":"18.00","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"2-Phenylacetic Acid","1":"16.06","2":"15.95","3":"15.92","4":"15.69","5":"16.04","6":"16.00","7":"16.19","8":"","9":"14.23","10":"15.77","11":"15.82","12":"15.95","13":"","14":"","15":"","16":"","17":"14.42","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"16.12","32":"16.00","33":"15.89","34":"16.03","35":"16.21","36":"","43":"","44":"13.68","45":"14.90","46":"","47":"","48":"14.16","55":"16.28","56":"16.09","57":"15.90","58":"16.08","59":"16.28","60":"16.57","67":"14.58","68":"","69":"14.53","70":"","71":"","72":"14.44","79":"","80":"13.80","81":"15.96","82":"15.32","83":"16.45","84":"","91":"","92":"14.77","93":"","94":"","95":"14.10","96":"","103":"15.91","104":"15.65","105":"16.43","106":"16.52","107":"15.80","108":"16.68","115":"","116":"","117":"","118":"14.87","119":"","120":""},{"Metabolite":"3- Or 4-Methylcatechol","1":"12.56","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"13.14","15":"","16":"","17":"","18":"","19":"","20":"","21":"13.68","22":"","23":"","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"","48":"12.67","55":"","56":"","57":"","58":"11.68","59":"","60":"","67":"","68":"","69":"","70":"","71":"","72":"13.36","79":"13.00","80":"","81":"","82":"","83":"","84":"","91":"","92":"","93":"","94":"","95":"13.06","96":"","103":"","104":"","105":"","106":"","107":"","108":"","115":"","116":"","117":"","118":"","119":"13.08","120":""},{"Metabolite":"3-Indolelactic Acid","1":"","2":"","3":"","4":"13.07","5":"","6":"","7":"13.87","8":"","9":"","10":"14.63","11":"","12":"15.15","13":"14.33","14":"15.22","15":"14.67","16":"15.86","17":"14.98","18":"15.12","19":"14.39","20":"","21":"15.02","22":"","23":"","24":"","31":"14.65","32":"14.49","33":"14.49","34":"","35":"","36":"14.89","43":"14.68","44":"14.12","45":"","46":"","47":"","48":"","55":"14.33","56":"","57":"14.40","58":"14.24","59":"","60":"15.88","67":"15.23","68":"14.84","69":"","70":"15.76","71":"","72":"","79":"14.39","80":"15.29","81":"","82":"15.76","83":"","84":"16.25","91":"14.76","92":"","93":"14.18","94":"13.86","95":"","96":"","103":"","104":"15.27","105":"14.52","106":"14.78","107":"14.11","108":"15.73","115":"14.59","116":"15.24","117":"14.78","118":"15.09","119":"","120":""},{"Metabolite":"3-Phenyllactic Acid","1":"","2":"","3":"16.06","4":"","5":"","6":"","7":"15.06","8":"","9":"","10":"15.77","11":"","12":"","13":"","14":"16.48","15":"","16":"","17":"16.06","18":"","19":"15.44","20":"","21":"","22":"","23":"","24":"","31":"15.60","32":"15.38","33":"16.32","34":"","35":"15.72","36":"16.23","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"16.64","57":"","58":"","59":"15.46","60":"16.57","67":"","68":"","69":"","70":"","71":"","72":"16.95","79":"","80":"16.27","81":"15.44","82":"","83":"15.62","84":"17.23","91":"","92":"","93":"","94":"","95":"","96":"","103":"15.71","104":"","105":"17.03","106":"16.23","107":"15.89","108":"17.19","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"4-Hydroxy-3-Methoxybenzoic Acid","1":"16.58","2":"16.59","3":"18.39","4":"15.94","5":"","6":"16.37","7":"16.32","8":"16.32","9":"16.95","10":"17.54","11":"","12":"","13":"15.89","14":"16.49","15":"16.77","16":"16.68","17":"","18":"16.88","19":"17.36","20":"16.95","21":"17.20","22":"17.38","23":"17.14","24":"17.06","31":"17.10","32":"15.66","33":"16.80","34":"16.59","35":"17.14","36":"","43":"17.36","44":"16.90","45":"17.06","46":"17.93","47":"17.31","48":"17.04","55":"17.49","56":"16.45","57":"16.54","58":"17.15","59":"","60":"","67":"17.22","68":"16.98","69":"16.78","70":"17.22","71":"16.38","72":"17.36","79":"17.28","80":"15.87","81":"16.26","82":"17.26","83":"17.18","84":"16.22","91":"17.84","92":"16.57","93":"17.72","94":"16.63","95":"17.90","96":"18.04","103":"16.72","104":"15.70","105":"16.10","106":"16.72","107":"15.20","108":"16.26","115":"18.07","116":"17.15","117":"17.61","118":"17.89","119":"18.04","120":"17.43"},{"Metabolite":"4-Hydroxybenzaldehyde","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"14.60","11":"","12":"","13":"","14":"","15":"","16":"","17":"15.16","18":"14.65","19":"14.33","20":"","21":"","22":"","23":"","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"","48":"","55":"14.87","56":"","57":"14.77","58":"","59":"","60":"15.43","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"15.94","81":"","82":"","83":"","84":"","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"14.59","105":"","106":"","107":"","108":"","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"4-Hydroxymandelic Acid","1":"17.50","2":"17.08","3":"17.18","4":"17.80","5":"17.75","6":"17.93","7":"17.54","8":"16.95","9":"17.05","10":"18.18","11":"17.97","12":"18.46","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"18.09","32":"17.59","33":"18.12","34":"18.33","35":"17.79","36":"18.14","43":"","44":"","45":"","46":"","47":"","48":"","55":"18.02","56":"17.79","57":"18.18","58":"18.22","59":"18.27","60":"18.56","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"18.50","81":"19.01","82":"18.42","83":"18.41","84":"18.86","91":"","92":"","93":"","94":"","95":"","96":"","103":"17.84","104":"18.18","105":"19.37","106":"18.90","107":"18.04","108":"18.74","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"4-Hydroxyphenylacetic Acid","1":"16.67","2":"16.46","3":"16.84","4":"16.51","5":"16.87","6":"16.64","7":"16.89","8":"15.96","9":"15.96","10":"16.57","11":"16.23","12":"16.35","13":"","14":"14.15","15":"14.05","16":"14.39","17":"13.92","18":"14.43","19":"","20":"","21":"","22":"14.67","23":"","24":"13.28","31":"16.56","32":"16.73","33":"16.94","34":"17.22","35":"16.72","36":"16.60","43":"13.24","44":"","45":"13.73","46":"14.32","47":"","48":"","55":"16.94","56":"17.03","57":"16.74","58":"16.93","59":"17.30","60":"18.01","67":"","68":"","69":"","70":"","71":"14.38","72":"14.67","79":"","80":"17.05","81":"16.52","82":"15.73","83":"17.43","84":"17.58","91":"14.02","92":"13.40","93":"14.24","94":"","95":"","96":"14.80","103":"16.55","104":"16.55","105":"17.09","106":"17.51","107":"16.10","108":"18.09","115":"14.67","116":"13.01","117":"15.18","118":"","119":"","120":""},{"Metabolite":"4-Hydroxypyridine","1":"","2":"","3":"14.84","4":"14.99","5":"14.53","6":"14.89","7":"14.75","8":"14.14","9":"","10":"","11":"","12":"15.17","13":"14.61","14":"14.00","15":"14.60","16":"13.04","17":"14.84","18":"14.23","19":"","20":"14.71","21":"","22":"","23":"13.85","24":"14.21","31":"14.47","32":"","33":"14.67","34":"","35":"15.30","36":"","43":"","44":"","45":"13.82","46":"","47":"14.43","48":"14.26","55":"14.15","56":"","57":"14.49","58":"14.17","59":"","60":"15.20","67":"14.74","68":"14.42","69":"14.72","70":"13.76","71":"14.29","72":"13.71","79":"14.62","80":"15.02","81":"14.91","82":"14.87","83":"","84":"","91":"","92":"14.04","93":"","94":"","95":"","96":"15.35","103":"14.71","104":"","105":"","106":"14.84","107":"","108":"","115":"14.77","116":"14.76","117":"","118":"15.16","119":"12.80","120":"14.78"},{"Metabolite":"4-Methyl-5-Thiazoleethanol","1":"","2":"","3":"","4":"","5":"","6":"","7":"17.45","8":"","9":"","10":"17.12","11":"","12":"","13":"15.43","14":"15.61","15":"16.14","16":"15.97","17":"","18":"15.65","19":"15.95","20":"","21":"15.42","22":"","23":"","24":"16.20","31":"17.48","32":"17.57","33":"17.35","34":"17.68","35":"18.01","36":"16.69","43":"16.27","44":"16.16","45":"16.87","46":"17.21","47":"","48":"16.38","55":"17.81","56":"17.70","57":"17.64","58":"","59":"18.56","60":"17.75","67":"16.70","68":"17.04","69":"15.61","70":"17.41","71":"16.94","72":"17.40","79":"16.62","80":"","81":"17.46","82":"17.28","83":"17.99","84":"17.48","91":"16.69","92":"16.55","93":"17.51","94":"15.49","95":"16.87","96":"16.75","103":"","104":"16.51","105":"18.31","106":"17.49","107":"17.93","108":"18.22","115":"","116":"17.05","117":"17.39","118":"17.25","119":"17.78","120":"17.33"},{"Metabolite":"5-(Hydroxymethyl)Furfural","1":"19.17","2":"18.82","3":"19.16","4":"19.55","5":"18.95","6":"19.28","7":"18.26","8":"17.73","9":"18.49","10":"18.48","11":"17.85","12":"18.46","13":"19.44","14":"19.71","15":"19.41","16":"19.89","17":"19.11","18":"19.61","19":"19.52","20":"19.46","21":"19.56","22":"19.48","23":"19.48","24":"19.77","31":"19.12","32":"","33":"18.92","34":"18.85","35":"19.30","36":"18.62","43":"19.41","44":"19.43","45":"19.52","46":"19.77","47":"19.79","48":"19.52","55":"19.14","56":"18.82","57":"18.95","58":"19.11","59":"19.16","60":"19.42","67":"19.55","68":"19.59","69":"19.23","70":"20.06","71":"19.66","72":"19.98","79":"19.67","80":"18.65","81":"19.20","82":"19.60","83":"19.03","84":"19.20","91":"19.79","92":"19.11","93":"19.86","94":"","95":"19.79","96":"19.77","103":"18.06","104":"","105":"18.30","106":"19.05","107":"","108":"19.20","115":"19.94","116":"19.59","117":"19.83","118":"19.83","119":"19.95","120":"20.03"},{"Metabolite":"5-Aminovaleric Acid","1":"15.67","2":"","3":"","4":"16.25","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"16.62","13":"16.50","14":"16.58","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"16.12","32":"15.89","33":"","34":"","35":"","36":"15.95","43":"","44":"","45":"16.54","46":"","47":"","48":"","55":"16.09","56":"","57":"","58":"16.54","59":"","60":"","67":"15.80","68":"","69":"","70":"","71":"","72":"","79":"16.46","80":"16.86","81":"","82":"","83":"16.20","84":"16.32","91":"16.52","92":"","93":"","94":"","95":"","96":"16.41","103":"","104":"16.28","105":"16.48","106":"","107":"","108":"","115":"16.75","116":"","117":"","118":"16.75","119":"","120":""},{"Metabolite":"5-Hydroxylysine","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"14.36","11":"","12":"","13":"14.60","14":"15.47","15":"","16":"","17":"","18":"","19":"15.20","20":"14.11","21":"","22":"","23":"13.38","24":"","31":"","32":"","33":"","34":"13.79","35":"","36":"","43":"14.76","44":"","45":"","46":"14.29","47":"13.52","48":"","55":"12.41","56":"","57":"","58":"","59":"","60":"14.99","67":"","68":"","69":"","70":"13.60","71":"13.73","72":"","79":"","80":"","81":"","82":"","83":"14.57","84":"15.03","91":"13.64","92":"12.95","93":"","94":"","95":"14.33","96":"14.26","103":"","104":"","105":"","106":"","107":"13.93","108":"","115":"15.74","116":"12.93","117":"","118":"","119":"14.22","120":""},{"Metabolite":"Adenine","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"14.08","16":"","17":"","18":"","19":"","20":"","21":"","22":"14.20","23":"","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"15.02","45":"15.14","46":"15.20","47":"15.56","48":"14.78","55":"","56":"","57":"","58":"","59":"","60":"","67":"","68":"16.25","69":"","70":"15.91","71":"14.56","72":"14.47","79":"","80":"","81":"","82":"","83":"","84":"","91":"15.10","92":"15.98","93":"15.80","94":"","95":"14.64","96":"14.90","103":"","104":"","105":"","106":"","107":"","108":"","115":"14.86","116":"15.47","117":"","118":"15.95","119":"15.44","120":"15.65"},{"Metabolite":"Alanine","1":"22.15","2":"21.76","3":"22.24","4":"21.76","5":"22.08","6":"21.86","7":"22.04","8":"22.33","9":"22.16","10":"22.25","11":"21.92","12":"22.40","13":"22.35","14":"22.62","15":"22.67","16":"22.71","17":"22.13","18":"22.21","19":"22.20","20":"22.11","21":"20.98","22":"22.16","23":"22.03","24":"21.91","31":"22.67","32":"22.12","33":"22.30","34":"21.91","35":"21.89","36":"22.33","43":"21.61","44":"21.89","45":"21.89","46":"21.83","47":"22.17","48":"21.77","55":"22.25","56":"22.30","57":"22.03","58":"22.13","59":"22.02","60":"22.60","67":"22.37","68":"21.72","69":"20.72","70":"22.12","71":"22.10","72":"22.70","79":"22.37","80":"22.38","81":"22.29","82":"22.00","83":"22.43","84":"22.34","91":"21.98","92":"21.72","93":"21.10","94":"20.58","95":"22.10","96":"22.46","103":"21.81","104":"22.26","105":"22.23","106":"22.12","107":"21.65","108":"22.64","115":"21.84","116":"22.10","117":"22.03","118":"21.68","119":"22.07","120":"22.49"},{"Metabolite":"Aldopentoses","1":"21.52","2":"20.87","3":"21.64","4":"21.35","5":"21.45","6":"21.33","7":"21.07","8":"19.97","9":"20.29","10":"21.06","11":"20.37","12":"21.61","13":"21.11","14":"21.83","15":"21.60","16":"21.87","17":"21.48","18":"21.79","19":"21.29","20":"20.60","21":"21.10","22":"21.14","23":"20.55","24":"20.98","31":"21.46","32":"21.15","33":"21.52","34":"21.26","35":"21.52","36":"20.98","43":"20.92","44":"20.89","45":"21.03","46":"21.31","47":"21.11","48":"19.88","55":"21.51","56":"21.40","57":"21.08","58":"21.44","59":"21.16","60":"21.80","67":"21.40","68":"21.62","69":"20.63","70":"22.16","71":"21.46","72":"21.57","79":"21.72","80":"21.99","81":"21.34","82":"21.93","83":"21.60","84":"21.90","91":"21.52","92":"20.98","93":"21.33","94":"20.31","95":"20.80","96":"20.66","103":"20.68","104":"21.81","105":"21.83","106":"21.72","107":"21.32","108":"22.30","115":"21.92","116":"21.50","117":"21.68","118":"21.74","119":"21.08","120":"21.17"},{"Metabolite":"Alpha Ketoglutaric Acid","1":"20.11","2":"18.56","3":"17.84","4":"","5":"20.07","6":"","7":"17.74","8":"","9":"","10":"18.36","11":"","12":"19.18","13":"18.98","14":"19.72","15":"","16":"20.34","17":"20.43","18":"20.16","19":"18.86","20":"18.00","21":"","22":"","23":"","24":"18.42","31":"17.49","32":"17.41","33":"18.98","34":"18.19","35":"18.60","36":"18.21","43":"18.69","44":"19.54","45":"18.89","46":"19.00","47":"20.58","48":"18.79","55":"17.66","56":"18.38","57":"17.09","58":"18.91","59":"17.88","60":"19.72","67":"18.98","68":"17.06","69":"","70":"21.10","71":"20.44","72":"21.53","79":"18.83","80":"","81":"17.80","82":"19.79","83":"18.51","84":"17.93","91":"19.49","92":"17.17","93":"19.00","94":"","95":"20.01","96":"19.91","103":"","104":"17.84","105":"18.31","106":"16.52","107":"","108":"19.37","115":"20.08","116":"18.57","117":"19.75","118":"19.20","119":"20.13","120":"20.43"},{"Metabolite":"Aminomalonic Acid","1":"21.70","2":"21.51","3":"21.45","4":"21.95","5":"20.73","6":"21.59","7":"20.38","8":"20.47","9":"21.14","10":"21.21","11":"20.00","12":"21.51","13":"21.85","14":"22.15","15":"21.41","16":"22.81","17":"21.90","18":"22.34","19":"21.73","20":"22.18","21":"23.81","22":"22.09","23":"22.57","24":"22.48","31":"21.07","32":"20.02","33":"20.35","34":"20.04","35":"21.29","36":"20.42","43":"21.81","44":"22.03","45":"21.70","46":"21.70","47":"23.08","48":"22.46","55":"21.16","56":"20.71","57":"20.64","58":"20.94","59":"21.55","60":"22.09","67":"22.53","68":"21.65","69":"20.34","70":"22.58","71":"22.96","72":"23.40","79":"22.21","80":"20.61","81":"20.54","82":"22.21","83":"21.69","84":"21.40","91":"22.72","92":"20.73","93":"21.96","94":"20.65","95":"23.16","96":"23.26","103":"20.13","104":"20.80","105":"20.07","106":"20.68","107":"19.68","108":"21.41","115":"22.55","116":"21.68","117":"21.74","118":"21.83","119":"23.04","120":"23.54"},{"Metabolite":"Arachidic Acid","1":"18.57","2":"","3":"18.97","4":"19.20","5":"18.95","6":"19.63","7":"19.08","8":"19.35","9":"19.26","10":"18.75","11":"19.11","12":"19.21","13":"19.10","14":"19.14","15":"18.78","16":"19.78","17":"19.19","18":"19.29","19":"18.75","20":"19.24","21":"19.41","22":"18.98","23":"19.57","24":"18.88","31":"19.09","32":"18.14","33":"19.61","34":"19.07","35":"19.94","36":"19.88","43":"19.10","44":"18.86","45":"19.63","46":"19.58","47":"20.11","48":"19.93","55":"19.37","56":"19.28","57":"19.03","58":"19.10","59":"19.58","60":"19.92","67":"19.15","68":"18.81","69":"18.97","70":"19.67","71":"19.60","72":"19.64","79":"19.55","80":"19.59","81":"18.71","82":"19.43","83":"19.53","84":"19.39","91":"19.41","92":"17.12","93":"19.66","94":"19.41","95":"19.56","96":"20.42","103":"19.49","104":"17.18","105":"19.46","106":"18.37","107":"19.10","108":"19.59","115":"19.75","116":"19.30","117":"19.51","118":"19.84","119":"20.04","120":"19.76"},{"Metabolite":"Asparagine","1":"","2":"","3":"","4":"","5":"","6":"","7":"18.82","8":"","9":"","10":"18.60","11":"18.29","12":"","13":"18.16","14":"","15":"","16":"","17":"","18":"","19":"17.90","20":"17.82","21":"","22":"18.19","23":"","24":"","31":"18.69","32":"","33":"","34":"18.39","35":"19.19","36":"18.59","43":"17.70","44":"17.57","45":"17.50","46":"17.85","47":"19.48","48":"17.88","55":"18.60","56":"18.64","57":"17.79","58":"18.83","59":"19.11","60":"19.72","67":"18.44","68":"","69":"","70":"18.06","71":"18.76","72":"19.78","79":"","80":"18.71","81":"18.55","82":"18.57","83":"19.06","84":"19.14","91":"18.14","92":"17.03","93":"17.38","94":"","95":"19.43","96":"19.73","103":"","104":"18.41","105":"18.96","106":"17.63","107":"18.37","108":"19.53","115":"","116":"17.75","117":"17.88","118":"17.81","119":"19.61","120":"19.54"},{"Metabolite":"Aspartic Acid","1":"18.93","2":"18.58","3":"19.10","4":"19.24","5":"18.59","6":"18.57","7":"17.48","8":"","9":"16.33","10":"16.85","11":"","12":"18.07","13":"17.90","14":"17.99","15":"16.73","16":"18.40","17":"17.19","18":"18.39","19":"18.15","20":"17.62","21":"19.23","22":"17.96","23":"17.31","24":"17.91","31":"17.70","32":"16.45","33":"17.65","34":"16.82","35":"17.47","36":"16.11","43":"17.16","44":"17.39","45":"17.46","46":"16.77","47":"18.26","48":"17.52","55":"","56":"16.53","57":"16.14","58":"","59":"","60":"17.29","67":"16.86","68":"","69":"","70":"17.92","71":"17.45","72":"17.67","79":"17.61","80":"17.91","81":"16.89","82":"17.44","83":"16.95","84":"","91":"18.06","92":"16.94","93":"17.58","94":"","95":"","96":"18.17","103":"","104":"","105":"17.44","106":"15.77","107":"","108":"17.13","115":"18.09","116":"17.37","117":"18.06","118":"17.25","119":"17.75","120":"17.96"},{"Metabolite":"Benzene-1,2,4-Triol","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"","32":"","33":"","34":"17.80","35":"","36":"19.17","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"","57":"18.43","58":"","59":"","60":"","67":"","68":"","69":"17.65","70":"","71":"","72":"","79":"","80":"","81":"","82":"","83":"","84":"18.29","91":"","92":"","93":"","94":"","95":"","96":"","103":"17.15","104":"","105":"","106":"17.57","107":"15.71","108":"19.93","115":"","116":"","117":"","118":"19.40","119":"","120":""},{"Metabolite":"Benzoic Acid","1":"21.37","2":"21.41","3":"21.37","4":"21.54","5":"21.35","6":"21.53","7":"21.14","8":"21.28","9":"21.42","10":"21.02","11":"21.00","12":"21.39","13":"21.25","14":"21.46","15":"21.14","16":"21.54","17":"21.17","18":"21.54","19":"21.36","20":"21.32","21":"21.89","22":"21.41","23":"21.42","24":"21.52","31":"21.31","32":"21.15","33":"21.55","34":"21.25","35":"21.55","36":"21.22","43":"21.10","44":"21.24","45":"21.28","46":"21.44","47":"21.71","48":"21.56","55":"21.40","56":"21.28","57":"21.12","58":"21.04","59":"21.28","60":"21.49","67":"21.21","68":"21.21","69":"21.48","70":"21.60","71":"21.80","72":"21.83","79":"21.45","80":"21.60","81":"20.99","82":"21.40","83":"21.49","84":"21.32","91":"21.42","92":"21.40","93":"21.67","94":"21.46","95":"21.45","96":"21.56","103":"21.31","104":"20.91","105":"21.47","106":"21.09","107":"21.27","108":"21.47","115":"21.60","116":"21.37","117":"21.58","118":"21.48","119":"21.63","120":"21.83"},{"Metabolite":"Beta-Alanine","1":"17.00","2":"17.20","3":"17.04","4":"17.18","5":"16.92","6":"17.31","7":"17.14","8":"17.05","9":"15.79","10":"16.89","11":"16.50","12":"17.20","13":"16.87","14":"16.75","15":"16.91","16":"17.49","17":"16.87","18":"17.21","19":"17.11","20":"17.31","21":"16.56","22":"17.40","23":"17.44","24":"17.25","31":"16.99","32":"17.40","33":"17.16","34":"17.26","35":"18.45","36":"17.07","43":"17.27","44":"17.19","45":"17.49","46":"17.74","47":"","48":"","55":"17.36","56":"17.12","57":"17.70","58":"17.33","59":"17.59","60":"17.62","67":"19.56","68":"","69":"16.56","70":"17.22","71":"17.65","72":"18.07","79":"","80":"17.06","81":"17.63","82":"17.49","83":"17.41","84":"17.69","91":"","92":"17.42","93":"17.62","94":"15.58","95":"17.54","96":"","103":"17.05","104":"17.93","105":"17.28","106":"17.73","107":"17.05","108":"17.59","115":"17.69","116":"","117":"17.49","118":"17.52","119":"17.90","120":"16.60"},{"Metabolite":"Cholesterol","1":"19.90","2":"19.61","3":"19.74","4":"18.67","5":"19.18","6":"19.00","7":"19.24","8":"18.79","9":"19.33","10":"19.24","11":"18.62","12":"19.76","13":"19.75","14":"19.78","15":"19.59","16":"20.00","17":"20.12","18":"20.54","19":"19.43","20":"19.05","21":"18.63","22":"19.71","23":"18.07","24":"19.64","31":"18.98","32":"17.68","33":"18.92","34":"18.78","35":"17.91","36":"18.90","43":"19.31","44":"18.98","45":"19.55","46":"18.53","47":"19.63","48":"18.58","55":"19.93","56":"19.32","57":"19.55","58":"19.38","59":"18.95","60":"20.05","67":"20.05","68":"19.26","69":"19.49","70":"19.93","71":"19.45","72":"19.86","79":"20.72","80":"19.14","81":"18.47","82":"20.49","83":"19.47","84":"20.23","91":"20.48","92":"19.15","93":"20.23","94":"20.30","95":"19.93","96":"19.78","103":"18.65","104":"18.89","105":"19.48","106":"19.12","107":"17.17","108":"19.09","115":"19.47","116":"17.74","117":"19.30","118":"18.63","119":"18.68","120":"19.09"},{"Metabolite":"Citramalic Acid","1":"16.43","2":"16.35","3":"16.00","4":"16.43","5":"16.11","6":"16.39","7":"17.57","8":"15.55","9":"","10":"","11":"16.28","12":"17.03","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"16.89","32":"16.46","33":"16.56","34":"16.20","35":"16.51","36":"15.70","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"16.46","57":"16.37","58":"15.85","59":"16.67","60":"16.09","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"18.27","81":"16.81","82":"","83":"16.95","84":"16.49","91":"","92":"","93":"","94":"","95":"","96":"","103":"17.32","104":"15.23","105":"18.41","106":"","107":"17.59","108":"17.10","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"Citric Acid/Isocitric Acid","1":"21.37","2":"20.12","3":"20.29","4":"20.97","5":"21.40","6":"19.83","7":"20.08","8":"","9":"","10":"20.01","11":"","12":"20.45","13":"20.06","14":"21.78","15":"19.88","16":"21.32","17":"21.30","18":"22.04","19":"20.42","20":"19.45","21":"21.73","22":"20.20","23":"","24":"20.04","31":"20.10","32":"19.52","33":"19.88","34":"19.42","35":"19.88","36":"","43":"","44":"19.70","45":"19.63","46":"","47":"20.73","48":"","55":"20.21","56":"19.49","57":"","58":"","59":"","60":"","67":"20.23","68":"19.62","69":"","70":"20.83","71":"","72":"20.89","79":"20.52","80":"20.93","81":"","82":"20.46","83":"","84":"","91":"20.36","92":"19.96","93":"19.91","94":"","95":"","96":"21.23","103":"","104":"","105":"20.47","106":"","107":"","108":"20.81","115":"20.97","116":"19.87","117":"20.52","118":"20.37","119":"21.35","120":"21.29"},{"Metabolite":"Citrulline","1":"16.20","2":"","3":"15.82","4":"16.40","5":"16.28","6":"16.61","7":"17.59","8":"14.73","9":"14.37","10":"18.75","11":"17.82","12":"18.15","13":"18.21","14":"17.09","15":"16.30","16":"17.79","17":"18.47","18":"17.58","19":"18.84","20":"18.66","21":"18.37","22":"19.13","23":"19.00","24":"18.51","31":"17.39","32":"17.77","33":"17.79","34":"18.41","35":"18.66","36":"19.16","43":"19.29","44":"19.29","45":"19.45","46":"19.72","47":"20.78","48":"19.86","55":"17.96","56":"18.46","57":"18.40","58":"19.12","59":"20.27","60":"20.75","67":"19.50","68":"17.10","69":"16.51","70":"18.97","71":"20.87","72":"21.14","79":"17.63","80":"16.98","81":"19.31","82":"18.67","83":"20.60","84":"21.28","91":"18.88","92":"18.73","93":"19.19","94":"16.84","95":"21.65","96":"21.30","103":"15.70","104":"18.86","105":"19.06","106":"18.78","107":"19.82","108":"20.40","115":"18.21","116":"19.05","117":"19.45","118":"19.18","119":"22.00","120":"21.91"},{"Metabolite":"Decanoic Acid","1":"14.76","2":"15.15","3":"14.90","4":"","5":"14.62","6":"","7":"13.08","8":"14.27","9":"14.09","10":"13.13","11":"13.52","12":"15.07","13":"14.60","14":"14.80","15":"14.80","16":"15.46","17":"14.92","18":"14.92","19":"14.34","20":"15.26","21":"15.35","22":"14.87","23":"14.89","24":"15.05","31":"13.94","32":"","33":"14.61","34":"14.51","35":"14.64","36":"","43":"14.46","44":"","45":"14.95","46":"13.98","47":"","48":"15.01","55":"14.90","56":"14.92","57":"","58":"14.60","59":"14.29","60":"15.27","67":"14.26","68":"15.42","69":"14.46","70":"14.97","71":"15.82","72":"15.21","79":"14.20","80":"14.65","81":"14.42","82":"14.38","83":"14.51","84":"15.69","91":"14.57","92":"14.81","93":"14.20","94":"15.94","95":"15.37","96":"13.33","103":"14.32","104":"13.73","105":"14.34","106":"13.61","107":"13.93","108":"14.25","115":"14.92","116":"14.64","117":"14.89","118":"14.52","119":"14.88","120":"15.64"},{"Metabolite":"Diethylene Glycol","1":"15.82","2":"16.66","3":"16.38","4":"16.44","5":"","6":"","7":"15.91","8":"15.14","9":"","10":"15.97","11":"15.39","12":"16.17","13":"12.26","14":"","15":"15.12","16":"","17":"15.06","18":"15.74","19":"","20":"12.90","21":"17.68","22":"16.02","23":"","24":"","31":"16.10","32":"15.61","33":"17.14","34":"13.54","35":"16.79","36":"16.17","43":"","44":"","45":"16.94","46":"","47":"15.97","48":"","55":"","56":"16.22","57":"","58":"","59":"15.99","60":"","67":"15.68","68":"15.49","69":"16.61","70":"17.38","71":"13.52","72":"16.81","79":"","80":"16.68","81":"16.10","82":"","83":"16.26","84":"16.48","91":"16.87","92":"","93":"17.34","94":"","95":"16.28","96":"16.60","103":"15.47","104":"16.18","105":"16.90","106":"16.00","107":"16.16","108":"16.87","115":"17.39","116":"","117":"17.37","118":"","119":"","120":"16.91"},{"Metabolite":"Docosanoic Acid","1":"","2":"","3":"","4":"13.36","5":"","6":"14.17","7":"14.56","8":"","9":"","10":"12.95","11":"","12":"14.34","13":"","14":"","15":"","16":"13.02","17":"14.59","18":"13.68","19":"14.11","20":"13.86","21":"14.54","22":"13.56","23":"13.50","24":"","31":"15.39","32":"","33":"14.83","34":"13.42","35":"15.11","36":"13.96","43":"","44":"12.43","45":"","46":"13.31","47":"13.88","48":"13.00","55":"13.42","56":"","57":"13.60","58":"","59":"13.32","60":"13.39","67":"14.32","68":"","69":"","70":"","71":"14.25","72":"14.77","79":"16.30","80":"14.10","81":"13.56","82":"12.92","83":"13.72","84":"12.82","91":"12.65","92":"","93":"","94":"","95":"14.27","96":"14.32","103":"13.77","104":"","105":"14.02","106":"","107":"13.30","108":"14.41","115":"14.20","116":"","117":"","118":"","119":"13.25","120":"14.19"},{"Metabolite":"Erythronic Acid","1":"18.61","2":"19.04","3":"18.80","4":"18.59","5":"18.60","6":"18.57","7":"19.36","8":"17.35","9":"17.94","10":"19.08","11":"19.14","12":"19.36","13":"19.44","14":"19.52","15":"19.00","16":"19.64","17":"19.36","18":"19.57","19":"19.35","20":"18.82","21":"19.42","22":"19.74","23":"19.36","24":"19.52","31":"19.12","32":"18.57","33":"19.77","34":"19.20","35":"19.68","36":"19.81","43":"19.71","44":"19.92","45":"22.71","46":"22.78","47":"19.33","48":"19.12","55":"19.62","56":"19.40","57":"19.24","58":"20.20","59":"19.66","60":"19.88","67":"19.56","68":"19.51","69":"18.22","70":"20.05","71":"19.32","72":"19.90","79":"19.36","80":"19.01","81":"20.05","82":"19.78","83":"19.71","84":"19.98","91":"19.94","92":"19.44","93":"20.11","94":"17.91","95":"19.26","96":"19.38","103":"18.08","104":"19.32","105":"19.90","106":"19.50","107":"19.44","108":"19.94","115":"19.83","116":"19.78","117":"20.16","118":"20.08","119":"19.35","120":"19.42"},{"Metabolite":"Ethanolamine","1":"","2":"","3":"","4":"","5":"","6":"","7":"17.27","8":"17.86","9":"18.09","10":"17.65","11":"17.82","12":"18.04","13":"18.06","14":"17.75","15":"","16":"18.30","17":"17.35","18":"17.96","19":"17.93","20":"18.20","21":"","22":"17.82","23":"18.51","24":"18.18","31":"18.07","32":"17.84","33":"18.16","34":"18.31","35":"17.81","36":"","43":"17.65","44":"17.66","45":"18.07","46":"18.45","47":"18.62","48":"18.22","55":"18.07","56":"17.61","57":"17.96","58":"18.02","59":"","60":"17.98","67":"18.07","68":"18.19","69":"18.16","70":"18.83","71":"18.64","72":"18.44","79":"18.35","80":"18.05","81":"17.18","82":"18.38","83":"","84":"17.88","91":"18.37","92":"18.05","93":"18.84","94":"18.63","95":"18.41","96":"18.56","103":"17.58","104":"17.53","105":"18.32","106":"17.69","107":"","108":"17.75","115":"18.39","116":"18.23","117":"18.66","118":"18.60","119":"18.09","120":"18.60"},{"Metabolite":"Fructose Or Similar Ketohexose","1":"23.05","2":"22.83","3":"22.96","4":"23.36","5":"22.93","6":"23.31","7":"24.30","8":"22.86","9":"23.20","10":"24.01","11":"23.76","12":"24.46","13":"24.42","14":"24.05","15":"24.29","16":"23.73","17":"24.32","18":"23.89","19":"24.71","20":"24.51","21":"23.51","22":"24.73","23":"24.36","24":"23.64","31":"24.21","32":"24.27","33":"23.07","34":"24.20","35":"23.29","36":"24.01","43":"24.55","44":"24.80","45":"24.81","46":"24.86","47":"24.19","48":"24.51","55":"24.34","56":"24.35","57":"23.56","58":"24.27","59":"23.90","60":"24.32","67":"24.64","68":"23.89","69":"23.69","70":"25.00","71":"24.97","72":"25.13","79":"23.86","80":"23.27","81":"24.45","82":"24.70","83":"24.62","84":"24.36","91":"22.49","92":"24.73","93":"24.92","94":"23.83","95":"25.28","96":"24.12","103":"23.28","104":"24.20","105":"23.16","106":"24.15","107":"24.44","108":"24.83","115":"23.86","116":"24.98","117":"22.94","118":"24.91","119":"25.26","120":"25.43"},{"Metabolite":"Fumaric Acid","1":"18.08","2":"17.04","3":"18.08","4":"17.41","5":"17.92","6":"17.69","7":"17.18","8":"","9":"16.68","10":"17.17","11":"16.54","12":"18.30","13":"18.02","14":"18.64","15":"18.11","16":"18.75","17":"18.29","18":"18.78","19":"17.86","20":"17.39","21":"18.31","22":"17.76","23":"17.53","24":"17.46","31":"17.44","32":"17.11","33":"17.82","34":"17.43","35":"17.12","36":"17.40","43":"17.64","44":"17.40","45":"17.76","46":"17.98","47":"18.06","48":"16.96","55":"17.47","56":"17.06","57":"17.32","58":"17.71","59":"17.37","60":"17.95","67":"17.98","68":"18.06","69":"12.90","70":"18.83","71":"18.32","72":"18.90","79":"17.88","80":"17.97","81":"17.27","82":"18.07","83":"17.38","84":"17.60","91":"18.26","92":"16.89","93":"18.14","94":"15.63","95":"17.79","96":"17.85","103":"16.21","104":"17.34","105":"18.08","106":"17.35","107":"17.08","108":"18.00","115":"18.45","116":"17.75","117":"18.17","118":"18.25","119":"18.21","120":"18.12"},{"Metabolite":"Gamma-Hydroxybutyric Acid/Ethylmalonic Acid","1":"","2":"14.39","3":"15.17","4":"15.98","5":"14.22","6":"14.67","7":"16.36","8":"15.05","9":"14.15","10":"","11":"","12":"16.97","13":"14.60","14":"16.23","15":"14.70","16":"14.75","17":"15.86","18":"15.35","19":"16.31","20":"","21":"17.06","22":"16.15","23":"","24":"16.47","31":"13.90","32":"16.72","33":"16.62","34":"15.49","35":"","36":"16.68","43":"16.47","44":"16.25","45":"","46":"16.76","47":"16.45","48":"","55":"16.63","56":"16.48","57":"","58":"16.19","59":"","60":"","67":"15.14","68":"","69":"13.64","70":"16.80","71":"17.00","72":"","79":"","80":"14.68","81":"16.30","82":"","83":"","84":"16.56","91":"16.71","92":"13.91","93":"14.50","94":"","95":"15.00","96":"15.93","103":"14.71","104":"16.60","105":"","106":"","107":"16.64","108":"17.07","115":"","116":"15.13","117":"","118":"16.09","119":"","120":"17.20"},{"Metabolite":"Gluconic Acid Lactone","1":"28.20","2":"28.15","3":"28.13","4":"28.22","5":"28.30","6":"28.21","7":"28.14","8":"28.60","9":"27.86","10":"28.10","11":"28.28","12":"28.17","13":"28.32","14":"28.17","15":"28.18","16":"28.23","17":"28.09","18":"28.30","19":"28.15","20":"28.20","21":"28.17","22":"28.12","23":"28.20","24":"28.26","31":"28.32","32":"28.16","33":"28.37","34":"28.26","35":"28.11","36":"27.89","43":"28.20","44":"28.36","45":"28.03","46":"28.34","47":"28.20","48":"28.45","55":"28.42","56":"28.19","57":"27.86","58":"28.05","59":"28.31","60":"28.12","67":"28.13","68":"27.83","69":"27.92","70":"28.21","71":"28.35","72":"28.26","79":"28.47","80":"28.40","81":"28.16","82":"28.34","83":"28.17","84":"28.20","91":"28.23","92":"28.21","93":"28.56","94":"28.58","95":"28.20","96":"28.45","103":"28.50","104":"28.23","105":"28.33","106":"28.10","107":"28.15","108":"28.13","115":"28.16","116":"28.27","117":"28.39","118":"28.10","119":"28.36","120":"28.34"},{"Metabolite":"Gluconic Acid Or Similar Sugar Acid","1":"18.21","2":"18.33","3":"18.72","4":"18.56","5":"18.07","6":"18.42","7":"18.44","8":"16.82","9":"17.66","10":"17.98","11":"17.78","12":"18.36","13":"18.12","14":"18.55","15":"18.22","16":"18.62","17":"18.08","18":"18.27","19":"18.05","20":"17.86","21":"18.74","22":"18.14","23":"18.21","24":"18.33","31":"18.40","32":"17.79","33":"18.39","34":"18.00","35":"18.52","36":"18.02","43":"17.67","44":"18.69","45":"19.53","46":"18.66","47":"19.37","48":"19.60","55":"18.43","56":"18.47","57":"18.02","58":"17.93","59":"18.27","60":"18.45","67":"18.67","68":"19.01","69":"17.49","70":"19.48","71":"18.78","72":"19.52","79":"18.78","80":"18.43","81":"18.42","82":"18.80","83":"18.67","84":"18.46","91":"19.19","92":"17.23","93":"19.35","94":"16.93","95":"19.47","96":"20.37","103":"17.42","104":"18.00","105":"18.89","106":"18.03","107":"17.40","108":"18.71","115":"19.79","116":"19.06","117":"","118":"19.69","119":"20.33","120":"20.78"},{"Metabolite":"Glucose And Other Aldohexoses","1":"27.44","2":"27.65","3":"27.69","4":"27.15","5":"27.80","6":"27.53","7":"27.86","8":"27.52","9":"27.55","10":"27.79","11":"27.72","12":"27.73","13":"27.90","14":"27.87","15":"27.80","16":"27.38","17":"27.70","18":"27.68","19":"27.01","20":"27.85","21":"27.66","22":"27.80","23":"27.90","24":"27.79","31":"27.85","32":"27.88","33":"28.00","34":"27.92","35":"27.99","36":"27.51","43":"27.64","44":"28.02","45":"27.95","46":"27.99","47":"27.48","48":"27.16","55":"27.86","56":"27.93","57":"27.47","58":"27.99","59":"27.36","60":"27.91","67":"27.73","68":"27.83","69":"27.67","70":"27.80","71":"27.97","72":"27.91","79":"27.80","80":"27.81","81":"27.88","82":"27.75","83":"28.10","84":"27.65","91":"27.84","92":"28.10","93":"27.19","94":"27.40","95":"28.07","96":"27.85","103":"27.49","104":"28.02","105":"27.97","106":"27.29","107":"28.08","108":"27.95","115":"27.98","116":"27.89","117":"27.90","118":"27.78","119":"27.83","120":"27.88"},{"Metabolite":"Glutamic Acid","1":"23.41","2":"22.46","3":"23.61","4":"22.92","5":"23.21","6":"22.98","7":"23.80","8":"22.00","9":"22.53","10":"24.22","11":"23.34","12":"24.22","13":"23.82","14":"24.12","15":"22.98","16":"24.18","17":"24.02","18":"23.88","19":"23.90","20":"23.47","21":"23.45","22":"24.09","23":"23.78","24":"23.56","31":"23.77","32":"23.87","33":"24.00","34":"23.92","35":"24.54","36":"24.44","43":"23.82","44":"23.85","45":"23.78","46":"23.99","47":"24.58","48":"23.73","55":"24.24","56":"24.10","57":"23.96","58":"24.45","59":"24.74","60":"25.29","67":"24.40","68":"23.78","69":"21.90","70":"24.58","71":"24.90","72":"25.36","79":"24.12","80":"24.21","81":"24.06","82":"24.64","83":"24.98","84":"25.06","91":"24.22","92":"23.33","93":"23.89","94":"20.27","95":"24.74","96":"24.78","103":"22.03","104":"24.54","105":"24.39","106":"24.28","107":"24.27","108":"25.41","115":"24.03","116":"23.99","117":"24.09","118":"24.09","119":"25.02","120":"24.82"},{"Metabolite":"Glutamine","1":"23.49","2":"22.07","3":"23.88","4":"23.21","5":"23.44","6":"23.81","7":"23.44","8":"21.70","9":"21.27","10":"23.96","11":"23.29","12":"23.76","13":"24.18","14":"23.46","15":"21.21","16":"24.12","17":"23.58","18":"23.83","19":"24.67","20":"24.28","21":"24.72","22":"24.46","23":"24.67","24":"24.14","31":"23.30","32":"22.89","33":"23.54","34":"22.59","35":"24.56","36":"24.12","43":"24.26","44":"23.81","45":"23.32","46":"23.26","47":"25.68","48":"24.79","55":"23.36","56":"22.95","57":"23.14","58":"23.46","59":"25.01","60":"25.12","67":"24.14","68":"22.01","69":"18.81","70":"22.81","71":"25.16","72":"25.34","79":"23.50","80":"23.29","81":"23.35","82":"23.20","83":"25.14","84":"25.23","91":"23.65","92":"22.51","93":"23.57","94":"","95":"25.97","96":"25.82","103":"20.66","104":"22.84","105":"23.18","106":"22.33","107":"24.37","108":"24.76","115":"23.45","116":"23.60","117":"23.11","118":"22.75","119":"26.05","120":"25.93"},{"Metabolite":"Glyceric Acid","1":"19.56","2":"19.35","3":"19.49","4":"19.41","5":"19.38","6":"19.45","7":"18.77","8":"17.90","9":"18.70","10":"19.06","11":"19.08","12":"19.64","13":"19.44","14":"19.60","15":"19.22","16":"19.56","17":"18.86","18":"19.29","19":"19.11","20":"18.86","21":"19.93","22":"19.14","23":"19.00","24":"19.00","31":"19.05","32":"18.54","33":"19.23","34":"18.58","35":"19.03","36":"18.90","43":"18.69","44":"18.85","45":"18.99","46":"19.30","47":"19.22","48":"18.91","55":"18.85","56":"18.95","57":"18.91","58":"19.15","59":"18.93","60":"19.53","67":"18.89","68":"19.27","69":"18.22","70":"19.63","71":"19.19","72":"19.58","79":"19.12","80":"19.08","81":"18.85","82":"19.19","83":"19.11","84":"19.26","91":"19.41","92":"18.44","93":"19.32","94":"17.84","95":"19.18","96":"19.42","103":"17.87","104":"18.88","105":"19.13","106":"19.10","107":"18.47","108":"19.58","115":"19.52","116":"18.95","117":"19.44","118":"19.38","119":"19.38","120":"19.55"},{"Metabolite":"Glycerol","1":"26.02","2":"25.70","3":"25.78","4":"25.39","5":"25.81","6":"25.89","7":"25.73","8":"24.38","9":"24.88","10":"25.64","11":"25.59","12":"25.89","13":"25.40","14":"25.36","15":"24.74","16":"25.50","17":"25.47","18":"25.31","19":"25.59","20":"25.53","21":"24.65","22":"25.62","23":"25.55","24":"25.64","31":"25.59","32":"25.51","33":"25.63","34":"25.33","35":"25.66","36":"25.25","43":"25.04","44":"25.19","45":"25.00","46":"25.08","47":"25.32","48":"24.81","55":"25.87","56":"25.68","57":"25.20","58":"25.32","59":"25.43","60":"25.76","67":"25.63","68":"25.54","69":"24.78","70":"25.97","71":"25.83","72":"25.89","79":"25.80","80":"25.59","81":"25.26","82":"25.58","83":"25.51","84":"25.77","91":"25.45","92":"25.40","93":"25.17","94":"23.97","95":"25.40","96":"25.60","103":"24.91","104":"25.36","105":"25.50","106":"25.31","107":"25.22","108":"25.68","115":"25.70","116":"25.38","117":"25.24","118":"25.07","119":"25.70","120":"25.77"},{"Metabolite":"Glycerol 1-Phosphate","1":"15.87","2":"15.58","3":"15.91","4":"","5":"15.78","6":"","7":"16.76","8":"","9":"15.89","10":"16.56","11":"16.00","12":"16.97","13":"15.87","14":"16.29","15":"","16":"16.70","17":"","18":"16.75","19":"","20":"","21":"17.91","22":"","23":"","24":"","31":"17.15","32":"","33":"17.89","34":"16.69","35":"17.25","36":"17.60","43":"","44":"16.61","45":"","46":"","47":"","48":"15.85","55":"16.70","56":"","57":"16.26","58":"17.65","59":"17.62","60":"17.92","67":"17.38","68":"16.62","69":"17.10","70":"17.24","71":"16.42","72":"16.99","79":"16.76","80":"16.52","81":"17.93","82":"17.00","83":"18.04","84":"18.64","91":"","92":"","93":"","94":"","95":"18.06","96":"18.39","103":"15.63","104":"","105":"16.70","106":"","107":"17.34","108":"17.08","115":"","116":"","117":"","118":"16.85","119":"18.27","120":"16.86"},{"Metabolite":"Glycine","1":"26.49","2":"26.15","3":"26.30","4":"26.44","5":"26.30","6":"26.33","7":"26.07","8":"25.08","9":"25.46","10":"26.23","11":"25.86","12":"26.43","13":"26.26","14":"26.34","15":"25.90","16":"26.66","17":"26.23","18":"26.34","19":"26.23","20":"26.15","21":"26.54","22":"26.38","23":"26.26","24":"26.30","31":"26.31","32":"26.17","33":"26.37","34":"25.96","35":"26.35","36":"26.16","43":"26.03","44":"26.16","45":"25.91","46":"25.93","47":"26.65","48":"25.78","55":"26.41","56":"26.32","57":"25.91","58":"26.20","59":"26.27","60":"26.70","67":"26.45","68":"25.92","69":"24.61","70":"26.51","71":"26.65","72":"26.89","79":"26.37","80":"26.64","81":"26.15","82":"26.31","83":"26.47","84":"26.48","91":"26.29","92":"25.94","93":"26.18","94":"23.69","95":"26.60","96":"26.65","103":"25.13","104":"26.29","105":"26.42","106":"26.06","107":"26.16","108":"26.71","115":"26.53","116":"26.41","117":"26.36","118":"26.09","119":"26.71","120":"26.78"},{"Metabolite":"Glycolic Acid","1":"18.84","2":"18.73","3":"18.63","4":"18.58","5":"","6":"18.75","7":"18.88","8":"17.38","9":"","10":"18.13","11":"","12":"19.06","13":"","14":"17.92","15":"","16":"18.87","17":"17.14","18":"18.89","19":"","20":"","21":"19.14","22":"","23":"18.40","24":"","31":"18.87","32":"18.58","33":"18.87","34":"","35":"19.14","36":"16.03","43":"18.61","44":"18.26","45":"","46":"18.87","47":"18.99","48":"17.73","55":"19.03","56":"","57":"18.61","58":"18.92","59":"19.04","60":"19.37","67":"18.59","68":"18.36","69":"18.47","70":"19.23","71":"19.08","72":"19.22","79":"18.84","80":"19.30","81":"19.03","82":"","83":"","84":"19.30","91":"19.05","92":"18.30","93":"19.05","94":"17.54","95":"19.45","96":"19.22","103":"","104":"18.58","105":"19.00","106":"18.70","107":"18.78","108":"19.35","115":"18.84","116":"18.83","117":"18.69","118":"18.86","119":"19.30","120":"19.14"},{"Metabolite":"Guanine","1":"17.72","2":"15.30","3":"17.44","4":"18.58","5":"16.49","6":"17.62","7":"15.51","8":"","9":"","10":"","11":"","12":"16.47","13":"","14":"","15":"","16":"16.88","17":"16.31","18":"16.82","19":"15.64","20":"","21":"","22":"","23":"","24":"","31":"15.72","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"16.37","48":"15.50","55":"","56":"","57":"","58":"","59":"16.49","60":"15.31","67":"","68":"","69":"","70":"","71":"16.85","72":"17.28","79":"15.52","80":"15.95","81":"","82":"","83":"","84":"16.58","91":"","92":"","93":"","94":"","95":"","96":"16.73","103":"","104":"","105":"","106":"","107":"","108":"15.97","115":"","116":"","117":"","118":"","119":"16.91","120":"16.82"},{"Metabolite":"Heptadecanoic Acid/Octadecanol","1":"19.45","2":"19.31","3":"19.79","4":"19.71","5":"19.51","6":"20.08","7":"18.84","8":"19.52","9":"19.31","10":"18.86","11":"19.16","12":"19.63","13":"19.39","14":"19.73","15":"19.61","16":"19.77","17":"19.47","18":"19.54","19":"19.43","20":"19.44","21":"20.32","22":"19.88","23":"19.81","24":"19.88","31":"19.61","32":"19.14","33":"20.19","34":"19.31","35":"20.16","36":"19.67","43":"19.48","44":"19.79","45":"19.72","46":"19.95","47":"19.89","48":"19.84","55":"19.58","56":"19.44","57":"19.46","58":"19.01","59":"19.66","60":"19.57","67":"19.48","68":"19.59","69":"19.94","70":"20.13","71":"19.93","72":"19.01","79":"19.71","80":"19.97","81":"19.38","82":"19.84","83":"19.75","84":"19.44","91":"19.77","92":"19.63","93":"20.10","94":"20.19","95":"19.39","96":"19.88","103":"19.98","104":"18.78","105":"19.97","106":"19.34","107":"19.67","108":"19.74","115":"19.59","116":"19.33","117":"19.76","118":"20.14","119":"19.48","120":"19.80"},{"Metabolite":"Histidine","1":"","2":"","3":"","4":"","5":"","6":"","7":"24.70","8":"","9":"","10":"24.20","11":"22.84","12":"","13":"","14":"","15":"","16":"","17":"23.35","18":"","19":"","20":"","21":"","22":"25.04","23":"","24":"","31":"","32":"","33":"","34":"23.59","35":"","36":"23.04","43":"23.19","44":"25.55","45":"25.41","46":"24.31","47":"25.03","48":"23.64","55":"","56":"","57":"23.24","58":"23.53","59":"23.83","60":"24.00","67":"24.56","68":"","69":"","70":"","71":"24.14","72":"24.23","79":"","80":"","81":"23.27","82":"","83":"23.98","84":"23.90","91":"","92":"25.27","93":"","94":"","95":"24.19","96":"24.32","103":"","104":"23.25","105":"","106":"22.69","107":"23.46","108":"23.93","115":"","116":"","117":"","118":"","119":"24.20","120":"24.33"},{"Metabolite":"Homocysteine","1":"","2":"","3":"12.42","4":"","5":"12.73","6":"","7":"14.12","8":"","9":"","10":"14.52","11":"13.99","12":"","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"","32":"14.59","33":"14.17","34":"15.08","35":"15.94","36":"15.76","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"14.99","57":"14.50","58":"14.92","59":"","60":"","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"","81":"14.94","82":"","83":"16.42","84":"16.87","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"14.30","105":"","106":"","107":"15.92","108":"16.79","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"Hydroquinone","1":"16.21","2":"17.95","3":"17.59","4":"15.99","5":"17.76","6":"17.15","7":"16.36","8":"17.14","9":"17.72","10":"16.76","11":"17.22","12":"17.07","13":"16.46","14":"17.35","15":"16.74","16":"17.36","17":"17.43","18":"17.70","19":"17.06","20":"16.44","21":"16.36","22":"16.53","23":"16.61","24":"16.81","31":"17.37","32":"16.52","33":"16.88","34":"18.16","35":"17.49","36":"17.90","43":"17.13","44":"16.48","45":"16.88","46":"17.73","47":"17.02","48":"18.03","55":"17.47","56":"17.34","57":"18.77","58":"17.21","59":"17.91","60":"18.13","67":"16.81","68":"17.44","69":"17.44","70":"17.59","71":"18.28","72":"17.91","79":"17.76","80":"16.69","81":"17.16","82":"18.47","83":"17.93","84":"19.09","91":"17.00","92":"16.34","93":"18.17","94":"16.13","95":"16.82","96":"17.00","103":"17.79","104":"16.72","105":"16.98","106":"18.86","107":"16.94","108":"18.72","115":"17.59","116":"16.59","117":"17.03","118":"17.92","119":"17.34","120":"17.22"},{"Metabolite":"Hydroxyprolines","1":"16.83","2":"","3":"17.27","4":"","5":"17.18","6":"17.05","7":"17.11","8":"","9":"","10":"17.21","11":"","12":"17.01","13":"17.26","14":"17.40","15":"17.12","16":"17.58","17":"17.26","18":"18.04","19":"17.48","20":"17.20","21":"","22":"17.83","23":"17.43","24":"17.50","31":"17.34","32":"17.01","33":"17.64","34":"","35":"17.79","36":"","43":"17.26","44":"17.54","45":"17.74","46":"17.88","47":"17.28","48":"","55":"17.21","56":"17.28","57":"","58":"17.66","59":"","60":"18.02","67":"17.09","68":"","69":"","70":"17.56","71":"17.00","72":"17.66","79":"16.90","80":"","81":"17.44","82":"17.18","83":"17.74","84":"17.90","91":"17.94","92":"16.84","93":"17.83","94":"","95":"17.46","96":"17.44","103":"","104":"","105":"17.72","106":"17.08","107":"16.63","108":"18.08","115":"17.55","116":"16.98","117":"18.01","118":"17.74","119":"17.60","120":"17.79"},{"Metabolite":"Isoleucine","1":"24.53","2":"24.33","3":"24.60","4":"24.63","5":"24.49","6":"24.55","7":"24.43","8":"23.67","9":"24.05","10":"24.48","11":"23.93","12":"24.51","13":"24.37","14":"24.56","15":"24.99","16":"25.24","17":"24.33","18":"24.99","19":"24.61","20":"24.40","21":"25.30","22":"24.78","23":"24.60","24":"24.75","31":"25.00","32":"24.70","33":"25.08","34":"24.83","35":"25.41","36":"24.94","43":"24.72","44":"25.06","45":"25.15","46":"25.19","47":"25.73","48":"24.89","55":"24.92","56":"24.82","57":"24.84","58":"25.04","59":"25.15","60":"25.41","67":"25.13","68":"25.10","69":"24.03","70":"25.50","71":"25.44","72":"25.63","79":"24.76","80":"25.27","81":"24.88","82":"25.18","83":"25.33","84":"25.11","91":"25.17","92":"24.68","93":"25.25","94":"23.93","95":"25.45","96":"25.61","103":"23.42","104":"24.83","105":"25.10","106":"24.91","107":"24.79","108":"25.39","115":"25.14","116":"25.18","117":"25.51","118":"25.32","119":"25.43","120":"25.60"},{"Metabolite":"Isomaltose Or Similar Disaccharide","1":"21.07","2":"20.53","3":"20.46","4":"21.40","5":"20.72","6":"20.96","7":"20.69","8":"18.78","9":"19.39","10":"20.21","11":"19.88","12":"21.22","13":"20.68","14":"21.13","15":"20.72","16":"21.22","17":"20.73","18":"20.97","19":"20.94","20":"20.74","21":"21.39","22":"21.23","23":"20.99","24":"21.05","31":"21.01","32":"20.77","33":"21.16","34":"20.69","35":"21.24","36":"20.32","43":"20.58","44":"20.96","45":"20.85","46":"21.19","47":"21.50","48":"20.52","55":"21.14","56":"20.99","57":"20.26","58":"20.87","59":"20.88","60":"21.06","67":"21.11","68":"20.56","69":"19.38","70":"21.63","71":"21.24","72":"21.49","79":"21.28","80":"21.35","81":"20.77","82":"21.22","83":"21.15","84":"20.24","91":"21.14","92":"20.82","93":"21.14","94":"19.26","95":"21.27","96":"21.46","103":"19.08","104":"20.87","105":"20.95","106":"20.67","107":"20.43","108":"21.27","115":"21.41","116":"21.10","117":"21.36","118":"21.16","119":"21.55","120":"21.53"},{"Metabolite":"Lactic Acid","1":"27.75","2":"27.42","3":"25.89","4":"27.47","5":"27.96","6":"27.36","7":"27.80","8":"27.69","9":"26.93","10":"27.58","11":"27.44","12":"26.94","13":"27.01","14":"27.12","15":"27.69","16":"26.37","17":"26.95","18":"27.95","19":"27.46","20":"27.10","21":"26.92","22":"27.44","23":"27.13","24":"27.47","31":"27.27","32":"27.27","33":"27.49","34":"26.90","35":"27.21","36":"27.09","43":"27.70","44":"27.04","45":"26.73","46":"27.13","47":"27.31","48":"27.26","55":"27.30","56":"27.31","57":"26.96","58":"27.09","59":"27.52","60":"26.45","67":"27.22","68":"27.55","69":"28.14","70":"27.27","71":"26.95","72":"27.54","79":"26.87","80":"26.32","81":"27.07","82":"26.94","83":"27.43","84":"26.07","91":"27.29","92":"27.03","93":"27.29","94":"27.09","95":"27.05","96":"27.05","103":"27.48","104":"27.41","105":"27.14","106":"27.17","107":"27.19","108":"26.58","115":"27.36","116":"27.12","117":"26.79","118":"27.42","119":"26.50","120":"26.97"},{"Metabolite":"Lactose Or Similar Disaccharide","1":"18.60","2":"18.82","3":"20.52","4":"18.75","5":"18.72","6":"18.81","7":"18.71","8":"16.84","9":"18.40","10":"18.93","11":"17.99","12":"14.70","13":"18.04","14":"18.77","15":"19.76","16":"19.73","17":"17.72","18":"21.22","19":"18.15","20":"16.66","21":"23.42","22":"18.19","23":"18.51","24":"16.76","31":"19.12","32":"18.68","33":"18.91","34":"18.40","35":"18.87","36":"18.77","43":"18.21","44":"18.41","45":"18.56","46":"18.35","47":"17.67","48":"","55":"18.85","56":"18.89","57":"14.88","58":"18.79","59":"17.44","60":"16.50","67":"18.59","68":"16.56","69":"17.74","70":"19.21","71":"","72":"","79":"19.57","80":"16.84","81":"18.53","82":"19.06","83":"18.87","84":"15.46","91":"18.57","92":"17.55","93":"18.10","94":"17.96","95":"18.69","96":"17.99","103":"18.02","104":"19.13","105":"18.66","106":"18.88","107":"17.51","108":"15.36","115":"19.11","116":"19.04","117":"19.20","118":"18.85","119":"17.37","120":"15.33"},{"Metabolite":"Lauric Acid","1":"16.27","2":"16.70","3":"","4":"17.31","5":"","6":"","7":"16.90","8":"16.73","9":"16.56","10":"","11":"17.17","12":"","13":"","14":"","15":"17.08","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"17.63","32":"17.60","33":"17.74","34":"17.82","35":"17.65","36":"17.86","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"","57":"17.73","58":"","59":"18.37","60":"18.07","67":"","68":"18.55","69":"18.05","70":"","71":"","72":"","79":"17.69","80":"17.79","81":"","82":"18.03","83":"","84":"","91":"","92":"18.76","93":"","94":"18.11","95":"","96":"","103":"17.73","104":"","105":"17.85","106":"","107":"18.60","108":"","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"Leucine","1":"24.72","2":"24.41","3":"24.58","4":"24.91","5":"24.43","6":"24.67","7":"24.46","8":"23.36","9":"23.96","10":"24.48","11":"23.94","12":"24.73","13":"24.68","14":"24.70","15":"25.01","16":"25.19","17":"24.23","18":"24.94","19":"24.66","20":"24.50","21":"25.34","22":"24.74","23":"24.81","24":"24.95","31":"25.02","32":"24.63","33":"25.35","34":"24.73","35":"25.27","36":"24.95","43":"24.77","44":"25.02","45":"25.05","46":"25.19","47":"25.60","48":"24.91","55":"24.93","56":"24.78","57":"24.81","58":"25.07","59":"25.13","60":"25.27","67":"25.05","68":"25.09","69":"24.16","70":"25.57","71":"25.32","72":"25.58","79":"24.84","80":"25.23","81":"24.87","82":"25.03","83":"25.37","84":"25.13","91":"25.06","92":"24.72","93":"25.23","94":"23.62","95":"25.43","96":"25.62","103":"23.62","104":"24.82","105":"24.97","106":"24.77","107":"24.72","108":"25.30","115":"25.30","116":"25.14","117":"25.64","118":"25.36","119":"25.45","120":"25.61"},{"Metabolite":"Lysine","1":"26.15","2":"25.54","3":"26.01","4":"25.82","5":"25.77","6":"25.88","7":"26.25","8":"24.86","9":"25.12","10":"26.34","11":"26.07","12":"26.29","13":"26.13","14":"26.26","15":"25.65","16":"26.31","17":"26.34","18":"26.10","19":"26.35","20":"26.28","21":"25.98","22":"26.57","23":"26.48","24":"26.29","31":"26.03","32":"26.05","33":"26.13","34":"26.10","35":"26.33","36":"26.60","43":"26.58","44":"26.69","45":"26.69","46":"26.77","47":"26.96","48":"26.46","55":"26.41","56":"25.96","57":"25.82","58":"26.56","59":"26.80","60":"26.98","67":"26.71","68":"26.13","69":"25.14","70":"26.29","71":"27.00","72":"27.05","79":"26.19","80":"25.83","81":"26.63","82":"26.02","83":"26.95","84":"26.96","91":"26.38","92":"26.50","93":"26.28","94":"24.89","95":"27.12","96":"25.18","103":"24.98","104":"26.68","105":"26.18","106":"26.09","107":"26.74","108":"27.05","115":"25.95","116":"26.40","117":"26.55","118":"26.52","119":"25.00","120":"27.25"},{"Metabolite":"Maleamic Acid","1":"","2":"","3":"","4":"","5":"15.36","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"","16":"","17":"","18":"","19":"20.91","20":"","21":"","22":"","23":"","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"14.98","47":"","48":"","55":"","56":"","57":"13.69","58":"12.96","59":"","60":"13.48","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"","81":"","82":"","83":"","84":"","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"","105":"","106":"","107":"","108":"15.26","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"Malic Acid","1":"20.60","2":"19.96","3":"20.72","4":"19.85","5":"20.59","6":"20.05","7":"20.42","8":"19.17","9":"19.52","10":"20.57","11":"19.85","12":"21.13","13":"20.39","14":"21.13","15":"20.74","16":"21.37","17":"20.95","18":"21.12","19":"20.63","20":"19.99","21":"20.97","22":"20.46","23":"19.67","24":"20.26","31":"20.48","32":"20.46","33":"20.80","34":"20.34","35":"20.65","36":"20.60","43":"19.76","44":"20.20","45":"20.24","46":"20.46","47":"20.60","48":"19.83","55":"20.68","56":"20.70","57":"20.23","58":"20.40","59":"20.43","60":"20.85","67":"20.18","68":"20.47","69":"18.92","70":"21.31","71":"20.34","72":"21.17","79":"20.70","80":"20.86","81":"20.49","82":"21.04","83":"20.64","84":"20.96","91":"20.74","92":"19.86","93":"20.26","94":"","95":"20.36","96":"20.48","103":"19.16","104":"20.59","105":"20.84","106":"20.29","107":"20.23","108":"21.31","115":"20.89","116":"20.30","117":"20.85","118":"20.83","119":"20.79","120":"20.44"},{"Metabolite":"Maltose Or Similar Disaccharide","1":"21.21","2":"20.72","3":"20.96","4":"21.25","5":"20.90","6":"20.95","7":"21.02","8":"19.74","9":"20.27","10":"21.20","11":"20.76","12":"21.82","13":"21.23","14":"21.59","15":"21.05","16":"21.73","17":"21.52","18":"21.78","19":"21.42","20":"21.19","21":"21.84","22":"21.49","23":"21.49","24":"21.53","31":"21.17","32":"21.26","33":"21.54","34":"21.10","35":"21.40","36":"21.14","43":"21.12","44":"21.27","45":"21.24","46":"21.54","47":"21.70","48":"","55":"21.45","56":"21.23","57":"21.33","58":"21.30","59":"20.46","60":"21.34","67":"21.40","68":"20.83","69":"20.40","70":"22.04","71":"21.86","72":"21.66","79":"21.65","80":"21.77","81":"21.22","82":"21.91","83":"21.62","84":"21.50","91":"21.62","92":"21.39","93":"21.55","94":"20.11","95":"21.60","96":"21.16","103":"20.04","104":"21.36","105":"21.64","106":"21.34","107":"21.14","108":"22.01","115":"21.88","116":"21.51","117":"21.92","118":"21.79","119":"21.12","120":"21.16"},{"Metabolite":"Methionine","1":"22.90","2":"22.29","3":"22.40","4":"23.24","5":"22.13","6":"22.79","7":"22.44","8":"20.87","9":"21.55","10":"22.14","11":"21.42","12":"22.95","13":"23.32","14":"23.60","15":"23.54","16":"23.88","17":"23.16","18":"23.64","19":"23.38","20":"23.25","21":"24.21","22":"23.46","23":"23.49","24":"23.57","31":"22.49","32":"21.88","33":"22.81","34":"22.04","35":"22.58","36":"21.64","43":"23.23","44":"23.54","45":"23.55","46":"23.54","47":"23.77","48":"22.94","55":"23.07","56":"22.58","57":"22.19","58":"22.39","59":"22.09","60":"22.26","67":"23.55","68":"23.45","69":"22.31","70":"24.02","71":"23.71","72":"23.78","79":"23.49","80":"22.80","81":"22.23","82":"23.21","83":"22.59","84":"22.04","91":"23.52","92":"23.22","93":"23.69","94":"21.82","95":"23.62","96":"23.84","103":"21.37","104":"22.32","105":"22.52","106":"22.26","107":"20.95","108":"21.83","115":"23.88","116":"23.62","117":"23.74","118":"23.62","119":"23.67","120":"23.85"},{"Metabolite":"Methionine Sulfoxide","1":"19.14","2":"18.18","3":"18.77","4":"19.61","5":"18.73","6":"19.19","7":"19.61","8":"17.42","9":"17.31","10":"19.51","11":"19.05","12":"19.44","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"19.16","32":"19.53","33":"19.55","34":"19.40","35":"20.06","36":"19.86","43":"","44":"","45":"","46":"","47":"","48":"","55":"19.61","56":"19.84","57":"19.18","58":"19.79","59":"19.57","60":"20.35","67":"","68":"","69":"","70":"","71":"","72":"","79":"17.11","80":"19.59","81":"19.61","82":"18.25","83":"20.40","84":"20.65","91":"","92":"","93":"","94":"","95":"16.78","96":"","103":"16.71","104":"19.50","105":"19.88","106":"19.29","107":"20.55","108":"20.99","115":"","116":"","117":"","118":"","119":"17.47","120":"17.88"},{"Metabolite":"Myoinositol","1":"25.31","2":"25.26","3":"25.32","4":"25.54","5":"25.19","6":"25.36","7":"25.12","8":"24.09","9":"24.57","10":"25.02","11":"24.84","12":"25.39","13":"25.16","14":"25.36","15":"25.19","16":"25.51","17":"25.02","18":"25.38","19":"25.23","20":"25.11","21":"25.75","22":"25.47","23":"25.34","24":"25.55","31":"25.35","32":"25.10","33":"25.44","34":"25.07","35":"25.54","36":"25.06","43":"25.16","44":"25.27","45":"25.41","46":"25.60","47":"25.76","48":"25.29","55":"25.55","56":"25.37","57":"25.15","58":"25.35","59":"25.38","60":"25.63","67":"25.38","68":"25.41","69":"24.62","70":"25.83","71":"25.68","72":"25.83","79":"25.48","80":"25.48","81":"25.22","82":"25.35","83":"25.10","84":"25.48","91":"25.62","92":"25.05","93":"25.69","94":"24.34","95":"25.58","96":"25.67","103":"24.55","104":"25.08","105":"25.39","106":"25.19","107":"24.92","108":"25.61","115":"25.64","116":"25.47","117":"25.68","118":"25.56","119":"25.74","120":"25.84"},{"Metabolite":"N-Acetylleucine","1":"16.87","2":"15.27","3":"16.42","4":"18.17","5":"16.18","6":"16.89","7":"17.20","8":"","9":"","10":"15.99","11":"15.52","12":"16.28","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"","32":"16.43","33":"16.34","34":"16.37","35":"17.76","36":"15.66","43":"","44":"","45":"","46":"","47":"","48":"","55":"16.87","56":"16.55","57":"16.49","58":"16.09","59":"18.36","60":"16.85","67":"","68":"","69":"","70":"","71":"","72":"","79":"15.85","80":"18.25","81":"16.58","82":"15.65","83":"17.61","84":"16.80","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"","105":"","106":"","107":"17.49","108":"","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"N-Methylglutamic Acid","1":"19.23","2":"18.79","3":"19.73","4":"20.47","5":"18.23","6":"19.48","7":"18.65","8":"19.16","9":"20.30","10":"19.78","11":"18.56","12":"20.69","13":"21.01","14":"21.22","15":"21.05","16":"22.02","17":"20.86","18":"21.57","19":"21.55","20":"22.09","21":"23.90","22":"21.52","23":"22.61","24":"22.38","31":"19.95","32":"18.44","33":"19.68","34":"18.48","35":"19.73","36":"18.75","43":"21.75","44":"21.56","45":"22.06","46":"22.18","47":"22.26","48":"22.57","55":"20.41","56":"19.40","57":"19.73","58":"19.65","59":"20.19","60":"20.22","67":"22.06","68":"22.37","69":"21.07","70":"22.30","71":"22.12","72":"22.63","79":"22.07","80":"","81":"19.08","82":"21.83","83":"19.47","84":"18.15","91":"22.38","92":"20.04","93":"22.43","94":"21.10","95":"22.45","96":"22.64","103":"19.11","104":"","105":"","106":"19.09","107":"17.57","108":"18.54","115":"22.20","116":"21.70","117":"21.97","118":"22.06","119":"22.45","120":"22.66"},{"Metabolite":"N1-Methyltryptamine","1":"14.46","2":"","3":"14.43","4":"14.95","5":"15.14","6":"15.55","7":"14.64","8":"14.19","9":"14.53","10":"14.15","11":"14.73","12":"","13":"14.80","14":"14.58","15":"","16":"14.78","17":"14.74","18":"14.65","19":"14.60","20":"14.68","21":"","22":"14.86","23":"15.19","24":"15.21","31":"14.51","32":"14.44","33":"14.99","34":"15.39","35":"14.56","36":"14.63","43":"14.56","44":"14.93","45":"14.95","46":"15.07","47":"15.26","48":"14.52","55":"15.52","56":"14.91","57":"15.51","58":"15.36","59":"14.82","60":"15.44","67":"14.81","68":"14.17","69":"14.06","70":"15.43","71":"15.35","72":"15.67","79":"14.54","80":"14.83","81":"15.16","82":"14.88","83":"15.46","84":"15.64","91":"14.83","92":"15.31","93":"","94":"","95":"15.09","96":"15.07","103":"14.22","104":"14.30","105":"14.95","106":"14.85","107":"15.36","108":"15.08","115":"15.05","116":"14.89","117":"15.13","118":"15.18","119":"15.37","120":"15.15"},{"Metabolite":"Nicotinamide","1":"19.59","2":"19.89","3":"19.59","4":"20.22","5":"19.30","6":"19.96","7":"20.21","8":"","9":"19.77","10":"20.20","11":"","12":"20.63","13":"20.58","14":"20.52","15":"20.46","16":"20.22","17":"20.44","18":"21.04","19":"20.48","20":"20.49","21":"20.30","22":"20.66","23":"","24":"20.89","31":"20.74","32":"20.12","33":"20.63","34":"20.40","35":"20.87","36":"20.18","43":"20.34","44":"20.62","45":"20.40","46":"20.37","47":"21.09","48":"20.09","55":"20.32","56":"20.46","57":"20.40","58":"20.33","59":"20.55","60":"21.15","67":"20.82","68":"20.45","69":"19.25","70":"21.02","71":"21.03","72":"21.31","79":"20.86","80":"20.31","81":"20.29","82":"20.82","83":"20.70","84":"20.83","91":"20.90","92":"20.17","93":"20.31","94":"19.73","95":"20.83","96":"21.15","103":"19.46","104":"19.59","105":"","106":"20.38","107":"19.25","108":"21.10","115":"21.09","116":"20.71","117":"19.71","118":"20.61","119":"21.05","120":"21.26"},{"Metabolite":"Nonanoic Acid","1":"14.96","2":"","3":"16.33","4":"15.37","5":"15.56","6":"14.49","7":"16.00","8":"15.68","9":"15.35","10":"16.08","11":"15.18","12":"15.74","13":"14.83","14":"16.67","15":"16.82","16":"15.66","17":"16.50","18":"16.66","19":"16.65","20":"15.61","21":"16.23","22":"16.90","23":"15.57","24":"16.75","31":"16.09","32":"16.41","33":"16.60","34":"16.32","35":"17.26","36":"","43":"15.34","44":"16.04","45":"15.52","46":"15.11","47":"14.96","48":"16.19","55":"15.50","56":"16.60","57":"16.39","58":"15.62","59":"16.08","60":"15.87","67":"14.60","68":"15.56","69":"16.82","70":"","71":"16.73","72":"17.16","79":"15.95","80":"17.18","81":"16.54","82":"16.19","83":"17.32","84":"16.71","91":"16.49","92":"16.88","93":"15.82","94":"17.02","95":"16.67","96":"","103":"16.92","104":"","105":"16.78","106":"16.32","107":"16.64","108":"16.86","115":"15.61","116":"15.41","117":"15.79","118":"15.40","119":"17.29","120":""},{"Metabolite":"O-Methylphosphate","1":"","2":"","3":"","4":"","5":"","6":"","7":"11.88","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"","32":"","33":"","34":"","35":"12.85","36":"","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"","57":"","58":"","59":"","60":"","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"","81":"","82":"","83":"","84":"","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"","105":"","106":"","107":"","108":"","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"Ornithine","1":"20.59","2":"20.58","3":"20.35","4":"20.27","5":"19.97","6":"20.31","7":"20.63","8":"18.73","9":"19.40","10":"20.24","11":"19.93","12":"20.51","13":"20.36","14":"20.42","15":"20.74","16":"20.74","17":"19.95","18":"20.70","19":"20.55","20":"20.08","21":"20.66","22":"20.69","23":"20.23","24":"20.51","31":"20.70","32":"20.27","33":"20.95","34":"20.41","35":"20.65","36":"20.28","43":"20.40","44":"20.33","45":"20.63","46":"20.87","47":"20.50","48":"19.93","55":"21.09","56":"20.47","57":"20.25","58":"20.72","59":"20.23","60":"20.60","67":"20.85","68":"20.77","69":"19.63","70":"21.42","71":"20.37","72":"20.72","79":"21.01","80":"20.76","81":"20.47","82":"20.85","83":"20.39","84":"20.20","91":"21.02","92":"20.18","93":"20.94","94":"18.87","95":"20.28","96":"20.58","103":"19.83","104":"20.32","105":"20.94","106":"20.57","107":"19.98","108":"20.63","115":"21.20","116":"20.70","117":"21.30","118":"21.16","119":"20.36","120":"20.69"},{"Metabolite":"Pantothenic Acid","1":"22.35","2":"22.01","3":"22.25","4":"22.50","5":"22.15","6":"22.28","7":"22.07","8":"20.93","9":"21.39","10":"22.04","11":"21.70","12":"22.31","13":"22.12","14":"22.42","15":"22.31","16":"22.63","17":"22.10","18":"22.43","19":"22.32","20":"22.14","21":"22.76","22":"22.32","23":"22.30","24":"22.35","31":"22.24","32":"22.07","33":"22.56","34":"22.08","35":"22.62","36":"22.00","43":"22.00","44":"22.23","45":"22.27","46":"22.55","47":"22.81","48":"22.05","55":"22.45","56":"22.33","57":"22.01","58":"22.29","59":"22.35","60":"22.74","67":"22.36","68":"22.27","69":"21.39","70":"22.94","71":"22.70","72":"22.90","79":"22.43","80":"22.48","81":"22.10","82":"22.48","83":"22.53","84":"22.45","91":"22.61","92":"21.99","93":"22.65","94":"20.92","95":"22.63","96":"22.79","103":"21.18","104":"22.17","105":"22.38","106":"22.25","107":"21.90","108":"22.65","115":"22.71","116":"22.35","117":"22.79","118":"22.65","119":"22.87","120":"22.84"},{"Metabolite":"Pentitols","1":"16.75","2":"17.00","3":"17.69","4":"17.96","5":"17.17","6":"17.64","7":"17.31","8":"16.63","9":"17.67","10":"17.65","11":"16.75","12":"17.71","13":"17.18","14":"18.30","15":"18.24","16":"18.22","17":"17.88","18":"18.07","19":"17.94","20":"17.17","21":"17.79","22":"18.48","23":"17.61","24":"17.57","31":"17.30","32":"17.23","33":"18.68","34":"18.05","35":"18.50","36":"18.00","43":"18.38","44":"18.17","45":"18.55","46":"19.67","47":"18.63","48":"17.69","55":"17.95","56":"17.70","57":"18.38","58":"17.77","59":"18.45","60":"18.19","67":"18.32","68":"18.35","69":"18.12","70":"18.51","71":"17.98","72":"19.00","79":"17.44","80":"17.72","81":"18.37","82":"18.12","83":"18.52","84":"18.29","91":"18.40","92":"18.07","93":"19.36","94":"18.27","95":"17.60","96":"18.80","103":"17.43","104":"17.92","105":"17.96","106":"18.33","107":"17.92","108":"18.34","115":"18.83","116":"18.04","117":"19.73","118":"19.58","119":"18.11","120":"18.81"},{"Metabolite":"Pentonic Acids","1":"16.48","2":"18.48","3":"17.19","4":"17.11","5":"16.72","6":"17.04","7":"17.53","8":"16.14","9":"15.89","10":"17.30","11":"16.80","12":"17.83","13":"17.21","14":"","15":"17.67","16":"17.31","17":"17.12","18":"17.64","19":"17.73","20":"17.24","21":"17.64","22":"17.82","23":"17.26","24":"17.69","31":"17.15","32":"17.45","33":"17.89","34":"17.55","35":"18.01","36":"17.60","43":"17.05","44":"17.81","45":"18.22","46":"17.85","47":"17.57","48":"17.47","55":"17.54","56":"17.38","57":"17.69","58":"17.65","59":"17.62","60":"17.92","67":"17.38","68":"18.24","69":"17.10","70":"18.28","71":"17.80","72":"","79":"17.27","80":"17.32","81":"17.93","82":"","83":"18.04","84":"18.64","91":"18.13","92":"16.51","93":"18.24","94":"","95":"18.06","96":"18.39","103":"16.70","104":"17.68","105":"17.64","106":"17.65","107":"17.34","108":"18.41","115":"18.23","116":"17.57","117":"18.26","118":"","119":"18.27","120":""},{"Metabolite":"Phenyl-Beta-Glucopyranoside","1":"20.54","2":"22.04","3":"22.66","4":"21.02","5":"20.13","6":"20.96","7":"19.16","8":"20.79","9":"21.61","10":"21.60","11":"20.75","12":"21.73","13":"22.36","14":"21.19","15":"21.31","16":"20.83","17":"22.06","18":"21.29","19":"21.59","20":"20.99","21":"22.45","22":"22.23","23":"21.71","24":"21.82","31":"21.75","32":"20.10","33":"22.04","34":"22.13","35":"22.04","36":"21.99","43":"21.87","44":"20.03","45":"21.98","46":"22.64","47":"20.58","48":"22.07","55":"21.19","56":"21.55","57":"23.41","58":"22.19","59":"23.30","60":"22.85","67":"21.61","68":"23.36","69":"23.77","70":"22.06","71":"22.15","72":"21.96","79":"22.65","80":"21.19","81":"21.61","82":"23.00","83":"22.81","84":"22.09","91":"21.68","92":"17.44","93":"23.05","94":"23.75","95":"20.58","96":"20.55","103":"21.35","104":"21.26","105":"21.67","106":"23.41","107":"21.69","108":"22.36","115":"22.04","116":"20.61","117":"21.65","118":"22.69","119":"21.22","120":"21.37"},{"Metabolite":"Phenylalanine","1":"24.73","2":"24.03","3":"24.70","4":"24.88","5":"24.45","6":"24.58","7":"24.81","8":"22.99","9":"23.61","10":"25.02","11":"24.36","12":"25.16","13":"25.01","14":"25.00","15":"24.44","16":"25.36","17":"25.06","18":"24.96","19":"25.30","20":"25.11","21":"25.13","22":"25.57","23":"25.43","24":"25.37","31":"24.92","32":"24.83","33":"25.09","34":"24.74","35":"25.65","36":"25.08","43":"25.33","44":"25.49","45":"25.42","46":"25.17","47":"26.20","48":"25.44","55":"25.20","56":"25.03","57":"24.84","58":"25.26","59":"25.62","60":"26.08","67":"25.57","68":"25.28","69":"23.82","70":"25.73","71":"26.13","72":"26.38","79":"25.07","80":"25.10","81":"24.98","82":"25.31","83":"25.88","84":"25.79","91":"25.45","92":"25.07","93":"25.51","94":"23.34","95":"26.26","96":"26.34","103":"23.20","104":"25.11","105":"25.17","106":"24.90","107":"24.92","108":"26.04","115":"25.41","116":"25.58","117":"25.80","118":"25.62","119":"26.45","120":"26.45"},{"Metabolite":"Phenylpyruvate","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"14.41","13":"15.42","14":"16.53","15":"15.55","16":"16.26","17":"16.77","18":"16.97","19":"16.07","20":"15.35","21":"16.07","22":"","23":"16.17","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"16.65","47":"15.51","48":"","55":"","56":"","57":"","58":"","59":"","60":"","67":"16.21","68":"","69":"","70":"17.40","71":"","72":"16.92","79":"16.48","80":"","81":"","82":"17.31","83":"","84":"","91":"16.89","92":"","93":"15.46","94":"","95":"","96":"16.41","103":"","104":"","105":"","106":"","107":"","108":"15.55","115":"16.69","116":"14.56","117":"15.28","118":"","119":"","120":"15.87"},{"Metabolite":"Phosphoric Acid","1":"21.84","2":"22.10","3":"21.85","4":"21.57","5":"21.11","6":"20.78","7":"23.97","8":"22.42","9":"22.58","10":"21.70","11":"21.19","12":"22.04","13":"21.35","14":"21.27","15":"20.59","16":"21.50","17":"21.90","18":"21.19","19":"20.96","20":"22.09","21":"24.21","22":"23.23","23":"21.95","24":"21.10","31":"22.30","32":"21.21","33":"21.28","34":"21.90","35":"23.88","36":"22.51","43":"21.85","44":"23.78","45":"22.19","46":"21.97","47":"24.52","48":"21.09","55":"21.40","56":"21.53","57":"23.60","58":"22.45","59":"22.53","60":"22.52","67":"21.06","68":"20.94","69":"20.80","70":"20.97","71":"21.35","72":"22.14","79":"21.42","80":"21.77","81":"21.91","82":"22.23","83":"21.67","84":"21.85","91":"21.85","92":"20.30","93":"20.73","94":"20.04","95":"20.88","96":"21.98","103":"22.20","104":"21.44","105":"21.48","106":"23.36","107":"22.55","108":"22.94","115":"22.27","116":"21.77","117":"20.23","118":"21.03","119":"20.95","120":"20.69"},{"Metabolite":"Proline","1":"20.76","2":"20.48","3":"20.40","4":"20.66","5":"20.15","6":"20.43","7":"20.46","8":"16.85","9":"18.08","10":"20.45","11":"19.69","12":"20.91","13":"20.10","14":"20.15","15":"19.14","16":"20.31","17":"20.48","18":"19.66","19":"20.40","20":"19.96","21":"20.86","22":"20.37","23":"20.12","24":"20.20","31":"19.58","32":"19.62","33":"20.14","34":"19.35","35":"19.68","36":"19.27","43":"19.41","44":"19.28","45":"19.52","46":"19.73","47":"19.75","48":"18.70","55":"20.25","56":"20.02","57":"18.99","58":"19.69","59":"19.45","60":"20.38","67":"19.82","68":"19.67","69":"","70":"20.53","71":"19.94","72":"20.38","79":"20.30","80":"19.37","81":"19.37","82":"19.79","83":"19.75","84":"20.55","91":"20.13","92":"19.42","93":"20.02","94":"","95":"19.87","96":"20.10","103":"18.29","104":"19.70","105":"19.53","106":"19.57","107":"19.32","108":"20.60","115":"20.87","116":"19.81","117":"20.21","118":"20.21","119":"20.45","120":"20.51"},{"Metabolite":"Pseudouridine","1":"","2":"","3":"","4":"","5":"","6":"","7":"17.36","8":"","9":"","10":"17.22","11":"","12":"17.83","13":"","14":"","15":"","16":"","17":"18.84","18":"18.11","19":"","20":"","21":"","22":"18.92","23":"17.55","24":"","31":"","32":"","33":"17.40","34":"","35":"17.70","36":"17.09","43":"","44":"16.41","45":"","46":"","47":"18.99","48":"","55":"","56":"","57":"","58":"16.57","59":"17.94","60":"","67":"","68":"","69":"","70":"","71":"17.66","72":"18.51","79":"","80":"16.85","81":"","82":"17.76","83":"","84":"","91":"","92":"","93":"","94":"","95":"18.67","96":"18.98","103":"","104":"","105":"16.78","106":"","107":"15.68","108":"","115":"","116":"","117":"","118":"","119":"17.99","120":"17.48"},{"Metabolite":"Putrescine","1":"15.12","2":"15.20","3":"14.81","4":"14.98","5":"14.86","6":"14.45","7":"15.00","8":"13.16","9":"13.59","10":"15.16","11":"14.23","12":"15.38","13":"15.16","14":"15.49","15":"15.27","16":"15.42","17":"15.00","18":"15.35","19":"15.33","20":"14.71","21":"15.62","22":"15.22","23":"14.93","24":"14.72","31":"15.12","32":"14.89","33":"15.25","34":"14.82","35":"14.94","36":"14.50","43":"14.97","44":"14.89","45":"15.37","46":"15.39","47":"15.05","48":"14.08","55":"15.38","56":"15.15","57":"14.67","58":"15.27","59":"15.06","60":"15.01","67":"15.18","68":"15.15","69":"14.10","70":"15.77","71":"15.19","72":"15.57","79":"15.33","80":"15.69","81":"14.90","82":"15.48","83":"15.23","84":"15.36","91":"15.69","92":"14.95","93":"15.21","94":"13.67","95":"14.82","96":"15.37","103":"14.01","104":"15.27","105":"15.69","106":"15.29","107":"15.08","108":"15.61","115":"15.79","116":"15.41","117":"15.59","118":"15.54","119":"15.32","120":"15.29"},{"Metabolite":"Pyridine-2,6-Dicarboxylic Acid","1":"14.69","2":"","3":"16.37","4":"17.04","5":"16.59","6":"16.74","7":"16.38","8":"","9":"16.86","10":"15.73","11":"16.16","12":"17.07","13":"17.05","14":"17.80","15":"","16":"","17":"16.91","18":"17.34","19":"16.42","20":"17.23","21":"","22":"17.02","23":"","24":"","31":"15.81","32":"16.08","33":"17.18","34":"16.87","35":"","36":"16.67","43":"16.66","44":"16.84","45":"17.07","46":"17.35","47":"17.75","48":"16.74","55":"16.88","56":"15.92","57":"","58":"16.63","59":"16.76","60":"17.24","67":"16.21","68":"16.95","69":"17.08","70":"17.82","71":"16.79","72":"17.69","79":"","80":"","81":"15.67","82":"17.22","83":"16.40","84":"","91":"16.64","92":"17.19","93":"17.70","94":"16.94","95":"15.16","96":"","103":"16.34","104":"15.83","105":"","106":"15.92","107":"17.40","108":"17.29","115":"17.30","116":"17.14","117":"16.78","118":"17.43","119":"17.33","120":"17.56"},{"Metabolite":"Pyridoxine","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"16.98","21":"","22":"","23":"","24":"","31":"","32":"","33":"","34":"","35":"19.07","36":"20.42","43":"21.22","44":"","45":"21.20","46":"20.78","47":"","48":"20.64","55":"16.88","56":"","57":"21.58","58":"21.32","59":"20.34","60":"","67":"","68":"18.44","69":"","70":"19.02","71":"","72":"20.82","79":"","80":"","81":"","82":"","83":"21.09","84":"","91":"20.23","92":"","93":"","94":"19.65","95":"22.69","96":"","103":"","104":"","105":"17.73","106":"20.71","107":"","108":"","115":"","116":"","117":"","118":"","119":"20.98","120":""},{"Metabolite":"Pyruvic Acid","1":"22.23","2":"20.88","3":"21.27","4":"22.09","5":"21.41","6":"21.48","7":"21.24","8":"19.28","9":"20.11","10":"21.77","11":"20.84","12":"21.48","13":"22.44","14":"21.46","15":"23.82","16":"23.49","17":"22.21","18":"22.55","19":"21.99","20":"22.15","21":"21.92","22":"21.57","23":"22.96","24":"21.32","31":"21.37","32":"20.96","33":"20.99","34":"21.38","35":"21.72","36":"21.64","43":"20.17","44":"20.45","45":"20.26","46":"20.81","47":"21.14","48":"23.23","55":"21.40","56":"21.49","57":"20.74","58":"21.83","59":"22.39","60":"21.05","67":"21.08","68":"21.33","69":"22.03","70":"23.50","71":"20.41","72":"20.51","79":"20.07","80":"21.48","81":"21.23","82":"23.24","83":"21.77","84":"21.31","91":"20.15","92":"23.09","93":"20.63","94":"22.79","95":"22.45","96":"22.47","103":"19.42","104":"21.97","105":"21.79","106":"21.14","107":"22.46","108":"21.67","115":"23.17","116":"23.03","117":"20.79","118":"20.40","119":"23.48","120":"22.67"},{"Metabolite":"Serine","1":"25.71","2":"25.62","3":"25.59","4":"25.84","5":"25.57","6":"25.63","7":"25.28","8":"24.34","9":"24.97","10":"25.42","11":"25.05","12":"25.78","13":"25.72","14":"25.84","15":"25.55","16":"26.15","17":"25.38","18":"25.95","19":"25.56","20":"25.36","21":"26.08","22":"25.70","23":"25.81","24":"25.76","31":"25.80","32":"25.36","33":"25.90","34":"25.05","35":"25.81","36":"25.20","43":"25.21","44":"25.59","45":"25.30","46":"25.38","47":"26.07","48":"25.11","55":"25.64","56":"25.62","57":"25.24","58":"25.38","59":"25.55","60":"26.11","67":"25.71","68":"25.36","69":"23.78","70":"25.96","71":"25.94","72":"26.14","79":"25.81","80":"25.97","81":"25.27","82":"25.63","83":"25.79","84":"25.77","91":"25.86","92":"25.18","93":"25.63","94":"22.29","95":"25.98","96":"26.10","103":"24.38","104":"25.52","105":"25.70","106":"25.21","107":"25.15","108":"25.97","115":"25.82","116":"25.67","117":"25.61","118":"25.34","119":"26.15","120":"26.32"},{"Metabolite":"Spermidine","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"14.24","16":"13.92","17":"","18":"13.86","19":"","20":"","21":"","22":"","23":"","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"","48":"","55":"14.51","56":"","57":"","58":"","59":"","60":"","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"14.62","81":"","82":"13.59","83":"","84":"","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"","105":"14.64","106":"","107":"","108":"","115":"14.14","116":"","117":"14.65","118":"","119":"","120":""},{"Metabolite":"Stearic Acid","1":"25.44","2":"25.52","3":"25.65","4":"25.80","5":"25.59","6":"25.99","7":"25.20","8":"25.71","9":"25.48","10":"25.20","11":"25.41","12":"25.59","13":"25.32","14":"25.76","15":"25.70","16":"25.92","17":"25.57","18":"25.74","19":"25.64","20":"25.54","21":"26.18","22":"25.65","23":"25.64","24":"25.66","31":"25.58","32":"25.17","33":"26.02","34":"25.55","35":"26.08","36":"25.94","43":"25.39","44":"25.50","45":"25.84","46":"25.91","47":"25.91","48":"26.04","55":"25.70","56":"25.65","57":"25.67","58":"25.29","59":"25.91","60":"25.88","67":"25.47","68":"25.74","69":"25.96","70":"26.00","71":"26.14","72":"26.14","79":"25.71","80":"26.07","81":"25.40","82":"25.86","83":"26.16","84":"25.77","91":"25.82","92":"25.81","93":"26.12","94":"26.32","95":"26.05","96":"26.24","103":"26.04","104":"25.08","105":"25.98","106":"25.58","107":"25.81","108":"26.02","115":"25.88","116":"25.51","117":"26.06","118":"26.02","119":"26.23","120":"25.97"},{"Metabolite":"Succinic Acid","1":"22.05","2":"21.64","3":"22.21","4":"21.70","5":"22.15","6":"22.04","7":"21.81","8":"20.80","9":"21.22","10":"21.78","11":"21.48","12":"22.33","13":"21.63","14":"21.82","15":"21.67","16":"22.41","17":"21.77","18":"22.18","19":"21.53","20":"21.19","21":"22.03","22":"21.72","23":"21.32","24":"21.52","31":"22.04","32":"21.68","33":"22.04","34":"21.83","35":"22.11","36":"21.91","43":"21.43","44":"21.54","45":"21.39","46":"21.57","47":"21.90","48":"21.17","55":"22.09","56":"21.74","57":"21.80","58":"22.18","59":"21.95","60":"22.57","67":"21.46","68":"21.54","69":"20.49","70":"22.20","71":"21.91","72":"22.38","79":"21.59","80":"22.59","81":"21.90","82":"22.01","83":"22.25","84":"22.30","91":"21.88","92":"21.09","93":"21.91","94":"20.91","95":"21.72","96":"21.72","103":"21.11","104":"21.74","105":"22.61","106":"22.11","107":"21.63","108":"22.78","115":"22.13","116":"21.48","117":"22.10","118":"22.00","119":"21.95","120":"22.04"},{"Metabolite":"Sucrose And Similar Disaccharides","1":"17.95","2":"17.08","3":"","4":"18.34","5":"18.33","6":"18.25","7":"15.70","8":"15.72","9":"18.04","10":"18.33","11":"16.60","12":"16.48","13":"20.36","14":"15.76","15":"16.50","16":"17.76","17":"18.18","18":"15.59","19":"17.79","20":"16.38","21":"18.79","22":"16.40","23":"19.36","24":"17.55","31":"17.16","32":"18.46","33":"17.91","34":"18.15","35":"17.32","36":"17.56","43":"16.45","44":"17.36","45":"18.87","46":"17.39","47":"17.62","48":"16.68","55":"17.48","56":"17.95","57":"19.59","58":"19.23","59":"18.83","60":"18.86","67":"19.03","68":"19.97","69":"16.91","70":"18.70","71":"19.45","72":"19.08","79":"19.17","80":"20.03","81":"18.29","82":"20.14","83":"20.06","84":"19.75","91":"18.91","92":"18.71","93":"19.46","94":"19.13","95":"19.57","96":"20.76","103":"15.68","104":"19.10","105":"18.33","106":"17.39","107":"19.09","108":"19.11","115":"17.65","116":"18.05","117":"17.67","118":"16.09","119":"19.52","120":"19.06"},{"Metabolite":"Tartaric Acid","1":"","2":"","3":"","4":"","5":"13.81","6":"","7":"14.90","8":"","9":"","10":"","11":"","12":"14.63","13":"14.92","14":"15.08","15":"","16":"15.02","17":"","18":"15.34","19":"15.36","20":"13.92","21":"","22":"14.63","23":"","24":"14.81","31":"","32":"","33":"14.06","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"15.27","48":"","55":"15.18","56":"","57":"","58":"","59":"","60":"","67":"","68":"","69":"","70":"","71":"","72":"","79":"","80":"","81":"15.47","82":"","83":"","84":"","91":"15.12","92":"","93":"","94":"","95":"","96":"15.48","103":"","104":"","105":"","106":"","107":"","108":"","115":"15.00","116":"","117":"14.98","118":"15.59","119":"15.57","120":"15.96"},{"Metabolite":"Tetradecanedioic Acid","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"13.02","9":"","10":"","11":"","12":"","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"","31":"","32":"","33":"","34":"13.44","35":"","36":"","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"","57":"","58":"","59":"","60":"","67":"","68":"12.58","69":"14.24","70":"","71":"","72":"","79":"","80":"15.87","81":"","82":"","83":"","84":"","91":"","92":"14.35","93":"","94":"14.05","95":"","96":"","103":"13.79","104":"","105":"","106":"","107":"","108":"","115":"","116":"","117":"","118":"","119":"","120":""},{"Metabolite":"Threitol/Erythritol","1":"20.20","2":"19.66","3":"20.40","4":"20.36","5":"20.25","6":"20.32","7":"19.79","8":"18.70","9":"19.75","10":"20.04","11":"19.59","12":"20.31","13":"20.49","14":"20.50","15":"20.49","16":"20.92","17":"20.29","18":"20.80","19":"20.43","20":"20.00","21":"20.87","22":"20.51","23":"20.19","24":"20.27","31":"20.12","32":"19.87","33":"20.44","34":"20.13","35":"20.44","36":"20.38","43":"20.46","44":"20.25","45":"20.63","46":"20.73","47":"20.73","48":"20.28","55":"20.31","56":"20.00","57":"20.09","58":"20.40","59":"20.19","60":"20.85","67":"20.35","68":"20.14","69":"19.76","70":"20.86","71":"20.50","72":"20.98","79":"20.19","80":"20.05","81":"20.15","82":"20.56","83":"20.30","84":"20.63","91":"20.77","92":"20.05","93":"20.84","94":"19.85","95":"20.58","96":"20.67","103":"19.52","104":"19.99","105":"20.44","106":"20.36","107":"19.93","108":"20.86","115":"21.00","116":"20.38","117":"20.99","118":"20.85","119":"20.73","120":"20.72"},{"Metabolite":"Threonic Acid","1":"18.74","2":"18.30","3":"19.12","4":"18.09","5":"18.78","6":"18.80","7":"18.51","8":"17.06","9":"18.01","10":"18.51","11":"18.26","12":"18.70","13":"18.86","14":"18.80","15":"18.60","16":"19.15","17":"19.17","18":"19.18","19":"18.96","20":"18.55","21":"19.46","22":"19.24","23":"18.93","24":"18.83","31":"","32":"18.14","33":"19.11","34":"18.53","35":"19.40","36":"19.45","43":"18.97","44":"","45":"19.45","46":"19.62","47":"20.31","48":"19.34","55":"","56":"18.49","57":"18.94","58":"19.28","59":"19.74","60":"20.20","67":"","68":"18.99","69":"18.70","70":"","71":"20.09","72":"20.42","79":"18.64","80":"18.36","81":"18.91","82":"19.20","83":"19.54","84":"19.61","91":"19.22","92":"","93":"19.32","94":"","95":"20.08","96":"20.33","103":"17.99","104":"","105":"","106":"18.94","107":"18.85","108":"20.02","115":"","116":"19.45","117":"","118":"","119":"20.41","120":"19.80"},{"Metabolite":"Threonine","1":"25.93","2":"25.83","3":"25.94","4":"26.16","5":"25.86","6":"25.81","7":"25.82","8":"25.15","9":"25.62","10":"25.77","11":"25.54","12":"26.01","13":"25.97","14":"26.01","15":"26.39","16":"26.52","17":"25.89","18":"26.21","19":"25.97","20":"25.92","21":"26.49","22":"26.22","23":"26.29","24":"26.25","31":"26.19","32":"26.02","33":"26.54","34":"26.12","35":"26.77","36":"26.31","43":"26.09","44":"26.46","45":"26.43","46":"26.45","47":"27.06","48":"26.16","55":"26.28","56":"26.21","57":"26.19","58":"26.28","59":"26.58","60":"26.90","67":"26.50","68":"26.40","69":"25.09","70":"26.85","71":"26.84","72":"27.01","79":"26.25","80":"26.66","81":"26.27","82":"26.57","83":"26.76","84":"26.61","91":"26.46","92":"26.14","93":"26.63","94":"23.93","95":"26.71","96":"26.91","103":"25.39","104":"26.16","105":"26.56","106":"26.31","107":"26.24","108":"26.84","115":"26.55","116":"26.54","117":"26.66","118":"26.52","119":"26.80","120":"27.03"},{"Metabolite":"Threose/Erythrose","1":"14.10","2":"16.57","3":"16.22","4":"15.63","5":"15.15","6":"14.79","7":"14.52","8":"13.96","9":"14.87","10":"15.03","11":"","12":"","13":"15.44","14":"15.93","15":"17.46","16":"15.74","17":"15.50","18":"16.55","19":"15.84","20":"15.53","21":"16.11","22":"15.72","23":"15.90","24":"15.96","31":"15.77","32":"14.53","33":"","34":"14.79","35":"14.85","36":"13.24","43":"16.05","44":"15.81","45":"15.75","46":"16.32","47":"15.84","48":"16.71","55":"15.74","56":"14.53","57":"15.79","58":"13.98","59":"15.68","60":"15.24","67":"15.66","68":"17.90","69":"16.12","70":"16.27","71":"15.79","72":"16.08","79":"16.49","80":"","81":"14.68","82":"16.17","83":"15.90","84":"15.66","91":"16.30","92":"15.52","93":"16.30","94":"16.76","95":"16.22","96":"16.42","103":"14.01","104":"14.94","105":"","106":"","107":"14.55","108":"15.75","115":"16.36","116":"16.09","117":"16.26","118":"","119":"16.32","120":"16.40"},{"Metabolite":"Trisaccharide","1":"18.16","2":"17.91","3":"18.52","4":"17.50","5":"18.45","6":"18.26","7":"18.50","8":"16.89","9":"17.46","10":"18.62","11":"18.28","12":"19.70","13":"18.58","14":"19.35","15":"18.59","16":"19.42","17":"19.16","18":"19.62","19":"18.52","20":"18.07","21":"18.89","22":"18.73","23":"18.27","24":"18.76","31":"18.04","32":"18.57","33":"18.84","34":"18.57","35":"18.17","36":"18.36","43":"18.21","44":"17.80","45":"18.44","46":"18.49","47":"18.59","48":"16.94","55":"19.03","56":"18.81","57":"18.48","58":"17.43","59":"18.54","60":"19.40","67":"18.76","68":"18.34","69":"16.72","70":"","71":"19.15","72":"19.68","79":"19.50","80":"","81":"18.75","82":"19.60","83":"18.76","84":"18.92","91":"19.01","92":"18.04","93":"18.35","94":"","95":"18.39","96":"18.53","103":"17.74","104":"19.01","105":"19.36","106":"18.68","107":"18.21","108":"19.60","115":"19.19","116":"18.32","117":"19.00","118":"19.00","119":"19.07","120":"18.96"},{"Metabolite":"Tryptophan","1":"22.68","2":"22.34","3":"23.17","4":"23.01","5":"23.23","6":"23.18","7":"23.39","8":"19.64","9":"20.53","10":"23.49","11":"22.83","12":"23.69","13":"23.35","14":"22.83","15":"21.49","16":"23.85","17":"23.67","18":"23.58","19":"23.36","20":"23.37","21":"23.44","22":"23.85","23":"23.81","24":"23.78","31":"22.99","32":"22.38","33":"22.96","34":"22.91","35":"23.86","36":"23.42","43":"23.27","44":"23.60","45":"23.13","46":"23.44","47":"24.84","48":"23.89","55":"23.25","56":"23.06","57":"23.05","58":"23.08","59":"23.68","60":"24.59","67":"23.74","68":"21.25","69":"19.26","70":"23.91","71":"24.64","72":"25.02","79":"22.90","80":"22.58","81":"22.92","82":"23.61","83":"24.27","84":"24.27","91":"23.77","92":"21.76","93":"23.50","94":"","95":"24.78","96":"25.01","103":"19.05","104":"22.90","105":"22.82","106":"23.05","107":"23.14","108":"24.47","115":"23.35","116":"22.88","117":"23.64","118":"23.48","119":"24.96","120":"25.05"},{"Metabolite":"Tyrosine","1":"25.62","2":"24.97","3":"25.49","4":"25.86","5":"25.36","6":"25.54","7":"25.86","8":"24.33","9":"24.57","10":"26.13","11":"25.54","12":"25.99","13":"25.90","14":"25.87","15":"25.35","16":"25.96","17":"25.97","18":"25.89","19":"26.11","20":"25.92","21":"26.24","22":"26.44","23":"26.29","24":"26.14","31":"25.69","32":"25.79","33":"25.89","34":"25.86","35":"26.40","36":"26.15","43":"26.28","44":"26.27","45":"26.37","46":"26.48","47":"26.79","48":"26.19","55":"26.00","56":"26.08","57":"25.94","58":"26.44","59":"26.51","60":"26.74","67":"26.36","68":"25.90","69":"24.72","70":"26.37","71":"26.79","72":"27.01","79":"25.82","80":"25.80","81":"26.22","82":"26.22","83":"26.75","84":"26.77","91":"26.39","92":"26.10","93":"26.24","94":"24.45","95":"26.97","96":"26.84","103":"24.45","104":"26.28","105":"26.07","106":"26.15","107":"26.35","108":"26.81","115":"26.01","116":"26.26","117":"26.44","118":"26.28","119":"26.87","120":"26.77"},{"Metabolite":"Uracil","1":"16.85","2":"16.92","3":"17.09","4":"16.99","5":"16.89","6":"16.79","7":"13.61","8":"","9":"15.71","10":"15.11","11":"14.36","12":"15.95","13":"15.81","14":"15.94","15":"15.62","16":"16.84","17":"15.59","18":"16.41","19":"15.65","20":"15.29","21":"17.44","22":"15.70","23":"15.80","24":"15.11","31":"15.41","32":"13.73","33":"14.84","34":"","35":"15.07","36":"14.85","43":"14.98","44":"","45":"14.88","46":"15.23","47":"15.49","48":"14.57","55":"13.14","56":"14.81","57":"14.30","58":"14.68","59":"14.78","60":"16.06","67":"15.40","68":"","69":"13.72","70":"15.67","71":"15.58","72":"16.41","79":"15.47","80":"","81":"14.77","82":"15.49","83":"15.28","84":"15.51","91":"","92":"","93":"15.52","94":"","95":"15.44","96":"15.67","103":"","104":"15.01","105":"","106":"","107":"13.69","108":"15.60","115":"16.06","116":"15.22","117":"15.70","118":"15.32","119":"","120":"16.15"},{"Metabolite":"Urea","1":"21.40","2":"21.00","3":"21.86","4":"21.64","5":"21.39","6":"21.64","7":"21.03","8":"19.81","9":"20.59","10":"21.52","11":"20.88","12":"21.61","13":"21.69","14":"21.80","15":"21.10","16":"22.01","17":"21.62","18":"22.10","19":"21.70","20":"21.50","21":"22.12","22":"21.89","23":"21.89","24":"21.67","31":"21.32","32":"20.93","33":"21.47","34":"21.29","35":"21.81","36":"21.53","43":"21.69","44":"21.55","45":"21.69","46":"21.86","47":"22.10","48":"21.80","55":"21.46","56":"21.11","57":"21.51","58":"21.42","59":"21.88","60":"22.42","67":"21.60","68":"20.74","69":"20.11","70":"21.62","71":"21.88","72":"22.40","79":"21.39","80":"21.29","81":"21.34","82":"21.63","83":"21.87","84":"22.15","91":"21.96","92":"21.22","93":"22.08","94":"19.57","95":"22.13","96":"22.17","103":"20.18","104":"20.87","105":"21.50","106":"21.51","107":"21.19","108":"22.14","115":"22.08","116":"21.69","117":"22.03","118":"21.83","119":"22.14","120":"22.29"},{"Metabolite":"Uric Acid","1":"","2":"","3":"","4":"","5":"","6":"","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"","16":"16.92","17":"","18":"16.87","19":"","20":"","21":"17.44","22":"","23":"","24":"","31":"14.06","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"","57":"","58":"","59":"","60":"","67":"","68":"","69":"","70":"","71":"","72":"15.56","79":"","80":"","81":"","82":"","83":"","84":"","91":"","92":"","93":"","94":"","95":"","96":"14.95","103":"","104":"","105":"","106":"","107":"","108":"","115":"","116":"","117":"","118":"","119":"14.30","120":"14.03"},{"Metabolite":"Valine","1":"25.22","2":"24.00","3":"25.02","4":"25.38","5":"23.54","6":"24.96","7":"24.76","8":"23.79","9":"24.23","10":"24.94","11":"24.30","12":"24.34","13":"24.48","14":"23.82","15":"24.37","16":"24.22","17":"24.28","18":"23.91","19":"24.57","20":"24.21","21":"25.38","22":"24.85","23":"24.27","24":"23.85","31":"23.71","32":"24.70","33":"24.10","34":"23.80","35":"24.44","36":"24.13","43":"24.45","44":"23.75","45":"24.28","46":"24.78","47":"24.60","48":"24.33","55":"23.70","56":"24.70","57":"24.47","58":"24.01","59":"24.14","60":"24.10","67":"23.74","68":"23.71","69":"23.25","70":"23.81","71":"24.52","72":"24.60","79":"23.88","80":"23.70","81":"24.34","82":"24.66","83":"24.33","84":"24.38","91":"24.51","92":"24.88","93":"24.43","94":"23.12","95":"24.85","96":"24.78","103":"23.23","104":"24.08","105":"24.00","106":"23.92","107":"24.42","108":"24.20","115":"24.26","116":"24.38","117":"24.93","118":"24.84","119":"24.37","120":"24.25"},{"Metabolite":"Willardiine","1":"","2":"","3":"13.37","4":"","5":"","6":"","7":"","8":"","9":"","10":"12.60","11":"","12":"","13":"","14":"","15":"","16":"13.91","17":"","18":"","19":"","20":"","21":"","22":"","23":"","24":"13.58","31":"","32":"","33":"","34":"","35":"14.30","36":"13.61","43":"13.43","44":"","45":"","46":"14.18","47":"","48":"14.24","55":"12.82","56":"","57":"","58":"","59":"15.39","60":"15.14","67":"","68":"","69":"","70":"","71":"14.87","72":"15.47","79":"","80":"","81":"","82":"12.56","83":"14.13","84":"14.28","91":"","92":"","93":"12.85","94":"","95":"","96":"14.14","103":"","104":"","105":"","106":"13.59","107":"","108":"13.55","115":"13.78","116":"","117":"","118":"","119":"14.42","120":"14.38"},{"Metabolite":"Xanthine","1":"16.54","2":"","3":"16.37","4":"16.90","5":"14.83","6":"15.88","7":"","8":"","9":"","10":"","11":"","12":"","13":"","14":"","15":"","16":"","17":"","18":"","19":"","20":"","21":"18.39","22":"","23":"","24":"","31":"","32":"","33":"","34":"","35":"","36":"","43":"","44":"","45":"","46":"","47":"","48":"","55":"","56":"","57":"","58":"","59":"","60":"","67":"","68":"","69":"","70":"","71":"","72":"15.99","79":"","80":"","81":"","82":"","83":"","84":"","91":"","92":"","93":"","94":"","95":"","96":"","103":"","104":"","105":"","106":"","107":"","108":"","115":"","116":"","117":"","118":"","119":"","120":"16.80"}],

"Metabolites":[{"Metabolite":"5,6-Dihydrouracil","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"504-07-4"},{"Metabolite":"1-Dodecanol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"112-53-8"},{"Metabolite":"1,2-Propanediol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"57-55-6"},{"Metabolite":"1,3-Dihydroxyacetone","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"96-26-4"},{"Metabolite":"2-Amino-2-Methyl-1,3-Propanediol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"115-69-5"},{"Metabolite":"2-Ethylhexanoic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"149-57-5"},{"Metabolite":"2-Hydroxy-3-Methylvaleric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"488-15-3"},{"Metabolite":"2-Hydroxybutyric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"565-70-8"},{"Metabolite":"2-Hydroxyglutaric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"13095-48-2"},{"Metabolite":"2-Isopropylmalic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"16048-89-8"},{"Metabolite":"2-Ketoleucine/Ketoisoleucine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"816-66-0"},{"Metabolite":"2-Ketovaline","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"759-05-7"},{"Metabolite":"2-Phenylacetamide","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"103-81-1"},{"Metabolite":"2-Phenylacetic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"103-82-2"},{"Metabolite":"3- Or 4-Methylcatechol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"452-86-8"},{"Metabolite":"3-Indolelactic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"1821-52-9"},{"Metabolite":"3-Phenyllactic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"828-01-3"},{"Metabolite":"4-Hydroxy-3-Methoxybenzoic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"121-34-6"},{"Metabolite":"4-Hydroxybenzaldehyde","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"123-08-0"},{"Metabolite":"4-Hydroxymandelic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"7198-10-9"},{"Metabolite":"4-Hydroxyphenylacetic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"156-38-7"},{"Metabolite":"4-Hydroxypyridine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"626-64-2"},{"Metabolite":"4-Methyl-5-Thiazoleethanol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"137-00-8"},{"Metabolite":"5-(Hydroxymethyl)Furfural","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"67-47-0"},{"Metabolite":"5-Aminovaleric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"660-88-8"},{"Metabolite":"5-Hydroxylysine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"1190-94-9"},{"Metabolite":"Adenine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"73-24-5"},{"Metabolite":"Alanine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"56-41-7"},{"Metabolite":"Aldopentoses","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"147-81-9"},{"Metabolite":"Alpha Ketoglutaric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"328-50-7"},{"Metabolite":"Aminomalonic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"1068-84-4"},{"Metabolite":"Arachidic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"506-30-9"},{"Metabolite":"Asparagine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"70-47-3"},{"Metabolite":"Aspartic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"56-84-8"},{"Metabolite":"Benzene-1,2,4-Triol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"533-73-3"},{"Metabolite":"Benzoic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"65-85-0"},{"Metabolite":"Beta-Alanine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"107-95-9"},{"Metabolite":"Cholesterol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"57-88-5"},{"Metabolite":"Citramalic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"6263-10-8"},{"Metabolite":"Citric Acid/Isocitric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"5949-29-1"},{"Metabolite":"Citrulline","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"372-75-8"},{"Metabolite":"Decanoic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"334-48-5"},{"Metabolite":"Diethylene Glycol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"111-46-6"},{"Metabolite":"Docosanoic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"112-85-6"},{"Metabolite":"Erythronic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"13752-84-6"},{"Metabolite":"Ethanolamine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"141-43-5"},{"Metabolite":"Fructose Or Similar Ketohexose","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"57-48-7"},{"Metabolite":"Fumaric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"110-17-8"},{"Metabolite":"Gamma-Hydroxybutyric Acid/Ethylmalonic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"502-85-2"},{"Metabolite":"Gluconic Acid Lactone","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"90-80-2"},{"Metabolite":"Gluconic Acid Or Similar Sugar Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"526-95-4"},{"Metabolite":"Glucose And Other Aldohexoses","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"50-99-7"},{"Metabolite":"Glutamic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"56-86-0"},{"Metabolite":"Glutamine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"56-85-9"},{"Metabolite":"Glyceric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"473-81-4"},{"Metabolite":"Glycerol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"56-81-5"},{"Metabolite":"Glycerol 1-Phosphate","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"34363-28-5"},{"Metabolite":"Glycine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"56-40-6"},{"Metabolite":"Glycolic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"79-14-1"},{"Metabolite":"Guanine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"73-40-5"},{"Metabolite":"Heptadecanoic Acid/Octadecanol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"506-12-7"},{"Metabolite":"Histidine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"5934-29-2"},{"Metabolite":"Homocysteine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"6027-13-0"},{"Metabolite":"Hydroquinone","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"123-31-9"},{"Metabolite":"Hydroxyprolines","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"51-35-4"},{"Metabolite":"Isoleucine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"443-79-8"},{"Metabolite":"Isomaltose Or Similar Disaccharide","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"499-40-1"},{"Metabolite":"Lactic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"79-33-4"},{"Metabolite":"Lactose Or Similar Disaccharide","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"63-42-3"},{"Metabolite":"Lauric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"143-07-7"},{"Metabolite":"Leucine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"61-90-5"},{"Metabolite":"Lysine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"56-87-1"},{"Metabolite":"Maleamic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"557-24-4"},{"Metabolite":"Malic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"617-48-1"},{"Metabolite":"Maltose Or Similar Disaccharide","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"69-79-4"},{"Metabolite":"Methionine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"63-68-3"},{"Metabolite":"Methionine Sulfoxide","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"3226-65-1"},{"Metabolite":"Myoinositol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"87-89-8"},{"Metabolite":"N-Acetylleucine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"1188-21-2"},{"Metabolite":"N-Methylglutamic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"6753-62-4"},{"Metabolite":"N1-Methyltryptamine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"7518-21-0"},{"Metabolite":"Nicotinamide","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"98-92-0"},{"Metabolite":"Nonanoic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"112-05-0"},{"Metabolite":"O-Methylphosphate","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"812-00-0"},{"Metabolite":"Ornithine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"70-26-8"},{"Metabolite":"Pantothenic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"137-08-6"},{"Metabolite":"Pentitols","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"488-82-4"},{"Metabolite":"Pentonic Acids","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"17812-24-7"},{"Metabolite":"Phenyl-Beta-Glucopyranoside","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"1464-44-4"},{"Metabolite":"Phenylalanine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"156-06-9"},{"Metabolite":"Phenylpyruvate","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"7664-38-2"},{"Metabolite":"Phosphoric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"147-85-3"},{"Metabolite":"Proline","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"552-59-0"},{"Metabolite":"Pseudouridine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"1445-07-4"},{"Metabolite":"Putrescine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"110-60-1"},{"Metabolite":"Pyridine-2,6-Dicarboxylic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"499-83-2"},{"Metabolite":"Pyridoxine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"65-23-6"},{"Metabolite":"Pyruvic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"127-17-3"},{"Metabolite":"Serine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"56-45-1"},{"Metabolite":"Spermidine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"124-20-9"},{"Metabolite":"Stearic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"57-11-4"},{"Metabolite":"Succinic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"110-15-6"},{"Metabolite":"Sucrose And Similar Disaccharides","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"57-50-1"},{"Metabolite":"Tartaric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"133-37-9"},{"Metabolite":"Tetradecanedioic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"821-38-5"},{"Metabolite":"Threitol/Erythritol","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"6968-16-7"},{"Metabolite":"Threonic Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"3909-12-4"},{"Metabolite":"Threonine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"72-19-5"},{"Metabolite":"Threose/Erythrose","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"95-43-2"},{"Metabolite":"Trisaccharide","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"1109-28-0"},{"Metabolite":"Tryptophan","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"73-22-3"},{"Metabolite":"Tyrosine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"60-18-4"},{"Metabolite":"Uracil","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"66-22-8"},{"Metabolite":"Urea","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"57-13-6"},{"Metabolite":"Uric Acid","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"69-93-2"},{"Metabolite":"Valine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"72-18-4"},{"Metabolite":"Willardiine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"113573-73-2"},{"Metabolite":"Xanthine","retention index":"","quantified m/z":"","PubChem ID":"","KEGG ID":"","CAS":"69-89-6"}]
}

}