{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST001329","ANALYSIS_ID":"AN002215","VERSION":"1","CREATED_ON":"March 23, 2020, 2:18 pm"},

"PROJECT":{"PROJECT_TITLE":"Metabolic Effects of SS-31 and NMN on Aged Mouse Hearts","PROJECT_SUMMARY":"In this study we analyzed common metabolites in hearts taken from young mice and old mice that were either controls or treated with SS-31, NMN, or SS-31 + NMN.","INSTITUTE":"University of Washington","LAST_NAME":"Whitson","FIRST_NAME":"Jeremy","ADDRESS":"1959 NE Pacific St, Seattle, WA, 98195, USA","EMAIL":"whitsonj@uw.edu","PHONE":"3307605189"},

"STUDY":{"STUDY_TITLE":"SS-31 and NMN: Two Paths to Improve Metabolism and Function in Aged Hearts","STUDY_SUMMARY":"The effects of two different mitochondrial-targeted drugs, SS-31 and NMN, were tested on Old mouse hearts. After treatment with the drugs, individually or Combined, heart function was examined by echocardiography. SS-31 partially reversed an age-related decline in diastolic function while NMN fully reversed an age-related deficiency in systolic function at a higher workload. Metabolomic analysis revealed that both NMN and the Combined treatment increased nicotinamide and 1-methylnicotinamide levels, indicating greater NAD+ turnover, but only the Combined treatment resulted in significantly greater steady state NAD(H) levels. A novel magnetic resonance approach was used to assess how metabolite levels responded to changing workload. PCr/ATP decreased in response to increased workload in Old Control, but not Young, hearts, indicating an age-related decline in energetic capacity. Both drugs were able to normalize the PCr/ATP dynamics. SS-31 and NMN treatment also increased mitochondrial NAD(P)H production under the higher workload while only NMN increased NAD+ in response to the work jump. These measures did not shift in hearts given the Combined treatment, which may be owed to the enhanced NAD(H) levels in the resting state after this treatment. Overall, these results indicate that both drugs are effective at restoring different aspects of mitochondrial and heart health and that combining them results in a synergistic effect that rejuvenates Old hearts and best recapitulates the Young state.","INSTITUTE":"University of Washington","LAST_NAME":"Whitson","FIRST_NAME":"Jeremy","ADDRESS":"1959 NE Pacific St, Seattle, WA, 98195, USA","EMAIL":"whitsonj@uw.edu","PHONE":"3307605189","NUM_GROUPS":"5","TOTAL_SUBJECTS":"53","NUM_MALES":"53"},

"SUBJECT":{"SUBJECT_TYPE":"Mammal","SUBJECT_SPECIES":"Mus musculus","TAXONOMY_ID":"10090","GENOTYPE_STRAIN":"C57BL/6","AGE_OR_AGE_RANGE":"5-6 months or 26 months","ANIMAL_ANIMAL_SUPPLIER":"NIA","ANIMAL_HOUSING":"UW ARCF","ANIMAL_FEED":"Ad libitum","ANIMAL_WATER":"Ad libitum"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"JWY1-RF",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"5"}
},
{
"Subject ID":"-",
"Sample ID":"JWY1-LB",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"12"}
},
{
"Subject ID":"-",
"Sample ID":"JWY1-RB",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"15"}
},
{
"Subject ID":"-",
"Sample ID":"JWY1-LF",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"17"}
},
{
"Subject ID":"-",
"Sample ID":"JWY2-LB",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"20"}
},
{
"Subject ID":"-",
"Sample ID":"JWY2-RB",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"21"}
},
{
"Subject ID":"-",
"Sample ID":"JWY2-LF",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"33"}
},
{
"Subject ID":"-",
"Sample ID":"JWY2-RF",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"34"}
},
{
"Subject ID":"-",
"Sample ID":"JWY4-RF",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"40"}
},
{
"Subject ID":"-",
"Sample ID":"JWY4-LF",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"41"}
},
{
"Subject ID":"-",
"Sample ID":"JWY4-RB",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"43"}
},
{
"Subject ID":"-",
"Sample ID":"JWY4-LB",
"Factors":{"Age (Months)":"5-6","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"48"}
},
{
"Subject ID":"-",
"Sample ID":"JW42-NP",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"4"}
},
{
"Subject ID":"-",
"Sample ID":"JW41-RF",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"6"}
},
{
"Subject ID":"-",
"Sample ID":"JW42-LF",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"13"}
},
{
"Subject ID":"-",
"Sample ID":"JW43-RB",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"18"}
},
{
"Subject ID":"-",
"Sample ID":"JW49-RF",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"24"}
},
{
"Subject ID":"-",
"Sample ID":"JW48-NP",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"40"}
},
{
"Subject ID":"-",
"Sample ID":"JW49-LB",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"36"}
},
{
"Subject ID":"-",
"Sample ID":"JW25-NP",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"44"}
},
{
"Subject ID":"-",
"Sample ID":"JW37-LB",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"50"}
},
{
"Subject ID":"-",
"Sample ID":"JW25-R",
"Factors":{"Age (Months)":"26","Treatment":"None"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"55"}
},
{
"Subject ID":"-",
"Sample ID":"JW42-RF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"1"}
},
{
"Subject ID":"-",
"Sample ID":"JW43-LB ",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"3"}
},
{
"Subject ID":"-",
"Sample ID":"JW41-LF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"11"}
},
{
"Subject ID":"-",
"Sample ID":"JW41-NP",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"14"}
},
{
"Subject ID":"-",
"Sample ID":"JW47-LF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"22"}
},
{
"Subject ID":"-",
"Sample ID":"JW34-RF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"26"}
},
{
"Subject ID":"-",
"Sample ID":"JW34-LB",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"32"}
},
{
"Subject ID":"-",
"Sample ID":"JW49-LF ",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"37"}
},
{
"Subject ID":"-",
"Sample ID":"JW35-RF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"46"}
},
{
"Subject ID":"-",
"Sample ID":"JW37-RB",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"49"}
},
{
"Subject ID":"-",
"Sample ID":"JW36-RF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"52"}
},
{
"Subject ID":"-",
"Sample ID":"JW35-RB",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"53"}
},
{
"Subject ID":"-",
"Sample ID":"JW44-RF",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"9"}
},
{
"Subject ID":"-",
"Sample ID":"JW46-LF",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"10"}
},
{
"Subject ID":"-",
"Sample ID":"JW45-LF",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"16"}
},
{
"Subject ID":"-",
"Sample ID":"JW45-NP",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"19"}
},
{
"Subject ID":"-",
"Sample ID":"JW51-LF",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"27"}
},
{
"Subject ID":"-",
"Sample ID":"JW39-RB",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"28"}
},
{
"Subject ID":"-",
"Sample ID":"JW46-RB",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"38"}
},
{
"Subject ID":"-",
"Sample ID":"JW39-RF",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"39"}
},
{
"Subject ID":"-",
"Sample ID":"JW27-LB",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"42"}
},
{
"Subject ID":"-",
"Sample ID":"JW29-LB",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"45"}
},
{
"Subject ID":"-",
"Sample ID":"JW33-LF",
"Factors":{"Age (Months)":"26","Treatment":"NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"56"}
},
{
"Subject ID":"-",
"Sample ID":"JW45-RF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day) + NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"2"}
},
{
"Subject ID":"-",
"Sample ID":"JW44-LF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day) + NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"7"}
},
{
"Subject ID":"-",
"Sample ID":"JW44-NP",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day) + NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"8"}
},
{
"Subject ID":"-",
"Sample ID":"JW51-RF ",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day) + NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"29"}
},
{
"Subject ID":"-",
"Sample ID":"JW50-LF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day) + NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"31"}
},
{
"Subject ID":"-",
"Sample ID":"JW50-NP ",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day) + NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"35"}
},
{
"Subject ID":"-",
"Sample ID":"JW52-RF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day) + NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"47"}
},
{
"Subject ID":"-",
"Sample ID":"JW52-LF",
"Factors":{"Age (Months)":"26","Treatment":"SS-31 (3 mg/kg/day) + NMN (300 mg/kg/day)"},
"Additional sample data":{"RAW_FILE_NAME":"2019-06-07_Rabinovitch-56.wiff","Injection Number":"51"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Hearts were removed from mice immediately following live cervical dislocation euthanasia. Hearts were flushed with sterile normal saline, cut into large chunks, and snap frozen in liquid nitrogen.","SAMPLE_TYPE":"Heart"},

"TREATMENT":{"TREATMENT_SUMMARY":"Mice were treated with SS-31, NMN, neither, or both for 8 weeks. SS-31 was administered through subdermal osmotic pumps at a 3 mg/kg body weight/day dose. NMN was administered through drinking water at a 300 mg/kg body weight/day dose.","TREATMENT_ROUTE":"Subdermal osmotic pump for SS-31, drinking water for NMN","TREATMENT_DOSE":"3 mg/kg body weight/day for SS-31, 300 mg/kg body weight/day for NMN","TREATMENT_COMPOUND":"SS-31 and NMN"},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"Heart tissue samples were homogenized in water and methanol with spiked stable isotopes as internal QC standards. Samples were purified by pelleting proteins, drying of the solution via Speedvac (Thermo Fisher Scientific), and reconstituting in HILIC solvent."},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_SUMMARY":"Samples were injected into a chromatography system consisting of a dual injection valve setup allowing injections onto two different LC columns with each column dedicated to an ESI polarity. 5 µL were injected on the positive mode column and 10 µL on the negative side column. The columns were a matched pair from the same production lot number and were both a Waters XBridge BEH amide column (2.1 x 150 mm). Autosampler was maintained at 4 °C and column oven was set to 40 °C. 0.3 mL/min gradient was 0-3 min 95% B, 3-8 min 95 -> 50% B, 8-12 min 50% B, 12-13 min 50 – 95% B, 13-18 min 95% B. After completion of the 18 minute gradient, injection on the opposite column was initiated and the inactive column was allowed to equilibrate at starting gradient conditions. A set of QC injections for both instrument and sample QC were run at the beginning and end of the sample run.","CHROMATOGRAPHY_TYPE":"HILIC","INSTRUMENT_NAME":"Shimadzu Nexera XR LC-20AD","COLUMN_NAME":"Waters Acquity BEH Amide (150 x 2.1mm, 1.7um)","COLUMN_TEMPERATURE":"40","SOLVENT_A":"10 mM ammonium acetate in 95% water, 3% acetonitrile, 2% methanol, and 0.2% acetic acid","SOLVENT_B":"10 mM ammonium acetate in 93% acetonitrile, 5% water, 2% methanol, and 0.2% acetic acid"},

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

"MS":{"INSTRUMENT_NAME":"ABI Sciex 6500 QTrap","INSTRUMENT_TYPE":"Triple quadrupole","MS_TYPE":"ESI","ION_MODE":"UNSPECIFIED","MS_COMMENTS":"Samples were injected into a chromatography system consisting of a dual injection valve setup allowing injections onto two different LC columns with each column dedicated to an ESI polarity. 5 µL were injected on the positive mode column and 10 µL on the negative side column. The columns were a matched pair from the same production lot number and were both a Waters XBridge BEH amide column (2.1 x 150 mm). Autosampler was maintained at 4 °C and column oven was set to 40 °C. 0.3 mL/min gradient was 0-3 min 95% B, 3-8 min 95 -> 50% B, 8-12 min 50% B, 12-13 min 50 – 95% B, 13-18 min 95% B. After completion of the 18 minute gradient, injection on the opposite column was initiated and the inactive column was allowed to equilibrate at starting gradient conditions. A set of QC injections for both instrument and sample QC were run at the beginning and end of the sample run. Data was integrated by MultiQuant 3.0.2 or Sciex-OS v1.5 software. Peaks were selected based on peak shape, a signal-to-noise of 10 or better and retention times consistent with previously run standards and sample sets."},

"MS_METABOLITE_DATA":{
"Units":"Peak Area",

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Accession":"HMDB0001112","quantitated m/z":"169"},{"Metabolite":"DHAP","HMDB Accession":"HMDB0001473","quantitated m/z":"168.99"},{"Metabolite":"dimethylarginine (A/SDMA)","HMDB Accession":"HMDB0001539","quantitated m/z":"203"},{"Metabolite":"Dimethylglycine","HMDB Accession":"HMDB0000092","quantitated m/z":"104"},{"Metabolite":"Epinephrine","HMDB Accession":"HMDB0000068","quantitated m/z":"166"},{"Metabolite":"Ergocalciferol","HMDB Accession":"HMDB0000900","quantitated m/z":"397"},{"Metabolite":"erythronic acid","HMDB Accession":"HMDB0000613","quantitated m/z":"135.01"},{"Metabolite":"Erythrose-4-phosphate","HMDB Accession":"HMDB0001321","quantitated m/z":"199"},{"Metabolite":"ethanolamine","HMDB Accession":"HMDB0000149","quantitated m/z":"62"},{"Metabolite":"Ethylmalonic acid","HMDB Accession":"HMDB0000622","quantitated m/z":"131.02"},{"Metabolite":"F16BP/F26BP/G16BP","HMDB Accession":"HMDB0003514","quantitated m/z":"339"},{"Metabolite":"FAD","HMDB Accession":"HMDB0001248","quantitated m/z":"786"},{"Metabolite":"Fumaric Acid","HMDB Accession":"HMDB0000134","quantitated m/z":"114.99"},{"Metabolite":"G1P/G6P/F6P/F1P","HMDB Accession":"HMDB0001401","quantitated m/z":"259"},{"Metabolite":"gamma-Aminobutyrate","HMDB Accession":"HMDB0000112","quantitated m/z":"102"},{"Metabolite":"Glucoronate","HMDB Accession":"HMDB0000127","quantitated m/z":"193"},{"Metabolite":"Glucose","HMDB Accession":"HMDB0000122","quantitated m/z":"178.98"},{"Metabolite":"Glutamic acid","HMDB Accession":"HMDB0000148","quantitated m/z":"148"},{"Metabolite":"Glutamine","HMDB Accession":"HMDB0000641","quantitated m/z":"146.99"},{"Metabolite":"glutarylcarnitine","HMDB Accession":"HMDB0013130","quantitated m/z":"276"},{"Metabolite":"Glycerate","HMDB Accession":"HMDB0000139","quantitated m/z":"105"},{"Metabolite":"Glycerol-3-P","HMDB Accession":"HMDB0000126","quantitated m/z":"171"},{"Metabolite":"Glycerophosphocholine","HMDB Accession":"HMDB0000086","quantitated m/z":"258"},{"Metabolite":"Glycine","HMDB Accession":"HMDB0000123","quantitated m/z":"76"},{"Metabolite":"GMP","HMDB Accession":"HMDB0001397","quantitated m/z":"364.1"},{"Metabolite":"GTP","HMDB Accession":"HMDB0001273","quantitated m/z":"522"},{"Metabolite":"Guanidinoacetate","HMDB Accession":"HMDB0000128","quantitated m/z":"116"},{"Metabolite":"Guanine","HMDB Accession":"HMDB0000132","quantitated m/z":"152"},{"Metabolite":"Guanosine","HMDB Accession":"HMDB0000133","quantitated m/z":"284.2"},{"Metabolite":"Histamine","HMDB Accession":"HMDB0000870","quantitated m/z":"112.01"},{"Metabolite":"Histidine","HMDB Accession":"HMDB0000177","quantitated m/z":"156"},{"Metabolite":"homoarginine","HMDB Accession":"HMDB0000670","quantitated m/z":"189"},{"Metabolite":"homocitrulline","HMDB Accession":"HMDB0000679","quantitated m/z":"190"},{"Metabolite":"Hydroxyproline","HMDB Accession":"HMDB0000725","quantitated m/z":"131.99"},{"Metabolite":"Hypotaurine","HMDB Accession":"HMDB0000965","quantitated m/z":"110.01"},{"Metabolite":"Hypoxanthine","HMDB Accession":"HMDB0000157","quantitated m/z":"134.99"},{"Metabolite":"IMP","HMDB Accession":"HMDB0000175","quantitated m/z":"347.1"},{"Metabolite":"indole-3-carboxylic acid","HMDB Accession":"HMDB0003320","quantitated m/z":"160"},{"Metabolite":"Indole-3-Lactate","HMDB Accession":"HMDB0000671","quantitated m/z":"204.11"},{"Metabolite":"Inosine","HMDB Accession":"HMDB0000195","quantitated m/z":"269.2"},{"Metabolite":"Inositol","HMDB Accession":"HMDB0000211","quantitated m/z":"178.97"},{"Metabolite":"iso-Leucine /allo-isoleucine","HMDB Accession":"HMDB0000172","quantitated m/z":"132.02"},{"Metabolite":"isoValeric Acid /4-oxobutanoate/acetoacetate","HMDB Accession":"HMDB0000060","quantitated m/z":"101"},{"Metabolite":"isovalerylcarnitine","HMDB Accession":"HMDB0000688","quantitated m/z":"246"},{"Metabolite":"lactate","HMDB Accession":"HMDB0001311","quantitated m/z":"88.99"},{"Metabolite":"Lactose/Trehalose","HMDB Accession":"HMDB0000186","quantitated m/z":"341"},{"Metabolite":"Leucine /D-norleucine","HMDB Accession":"HMDB0000687","quantitated m/z":"132.01"},{"Metabolite":"Linoleic Acid","HMDB Accession":"HMDB0000673","quantitated m/z":"279.1"},{"Metabolite":"Linolenic Acid","HMDB Accession":"HMDB0001388","quantitated m/z":"277.1"},{"Metabolite":"L-Kynurenine","HMDB Accession":"HMDB0000684","quantitated m/z":"209.1"},{"Metabolite":"Lysine","HMDB Accession":"HMDB0000182","quantitated m/z":"147"},{"Metabolite":"Malate","HMDB Accession":"HMDB0000744","quantitated m/z":"133"},{"Metabolite":"Malondialdehyde","HMDB Accession":"HMDB0006112","quantitated m/z":"71"},{"Metabolite":"mannitol","HMDB Accession":"HMDB0000765","quantitated m/z":"181.01"},{"Metabolite":"Mannose","HMDB Accession":"HMDB0000169","quantitated m/z":"179"},{"Metabolite":"Methionine","HMDB Accession":"HMDB0000696","quantitated m/z":"149.99"},{"Metabolite":"methionine sulfoxide","HMDB Accession":"HMDB0002005","quantitated m/z":"166"},{"Metabolite":"Methylmalonate","HMDB Accession":"HMDB00202","quantitated m/z":"117"},{"Metabolite":"Mevalonate","HMDB Accession":"HMDB0000227","quantitated m/z":"146.99"},{"Metabolite":"N2,N2-Dimethylguanosine","HMDB Accession":"HMDB0004824","quantitated m/z":"312.2"},{"Metabolite":"N6-Acetyl-lysine","HMDB Accession":"HMDB0000446","quantitated m/z":"188.99"},{"Metabolite":"N6-Trimethyllysine","HMDB Accession":"HMDB0001325","quantitated m/z":"189.01"},{"Metabolite":"N-Ac-Alanine","HMDB Accession":"HMDB0000766","quantitated m/z":"130"},{"Metabolite":"N-Acetyl-aspartyl-glutamate (naag)","HMDB Accession":"HMDB0001067","quantitated m/z":"303"},{"Metabolite":"N-AcetylGlycine","HMDB Accession":"HMDB0000532","quantitated m/z":"115.99"},{"Metabolite":"N-Acetylneuraminate","HMDB Accession":"HMDB0000230","quantitated m/z":"308.1"},{"Metabolite":"N-Ac-L-Glutamine","HMDB Accession":"HMDB0001138","quantitated m/z":"187.01"},{"Metabolite":"N-Ac-Methionine","HMDB Accession":"HMDB0011745","quantitated m/z":"190"},{"Metabolite":"NAD","HMDB Accession":"HMDB0000902","quantitated m/z":"664"},{"Metabolite":"NADH","HMDB Accession":"HMDB0001487","quantitated m/z":"666"},{"Metabolite":"NADP","HMDB Accession":"HMDB0000217","quantitated m/z":"743"},{"Metabolite":"NADPH","HMDB Accession":"HMDB0000221","quantitated m/z":"746"},{"Metabolite":"N-Carbamoyl-B-Alanine","HMDB Accession":"HMDB0000026","quantitated m/z":"131.02"},{"Metabolite":"n-formylmethionine","HMDB Accession":"HMDB0001015","quantitated m/z":"176"},{"Metabolite":"n-glycylproline","HMDB Accession":"HMDB0000721","quantitated m/z":"173"},{"Metabolite":"Niacinamide","HMDB Accession":"HMDB01406","quantitated m/z":"123"},{"Metabolite":"n-isobutyrylglycine","HMDB Accession":"HMDB0000730","quantitated m/z":"144"},{"Metabolite":"n-isovalerylglycine","HMDB Accession":"HMDB0000678","quantitated m/z":"158"},{"Metabolite":"o-phosphoethanolamine","HMDB Accession":"HMDB0000224","quantitated m/z":"140"},{"Metabolite":"Ornithine","HMDB Accession":"HMDB0000214","quantitated m/z":"132.9"},{"Metabolite":"Orotate","HMDB Accession":"HMDB0000226","quantitated m/z":"155"},{"Metabolite":"Oxidized glutathione","HMDB Accession":"HMDB03337","quantitated m/z":"611.2"},{"Metabolite":"Palmitic Acid","HMDB Accession":"HMDB0000220","quantitated m/z":"255"},{"Metabolite":"Pentothenate","HMDB Accession":"HMDB0000210","quantitated m/z":"218.1"},{"Metabolite":"PGE","HMDB Accession":"HMDB0001220","quantitated m/z":"351.2"},{"Metabolite":"Phenylalanine","HMDB Accession":"HMDB0000159","quantitated m/z":"165.99"},{"Metabolite":"Phosphoadenosine phosphosulfate","HMDB Accession":"HMDB0001134","quantitated m/z":"506"},{"Metabolite":"phosphocreatine","HMDB Accession":"HMDB0001511","quantitated m/z":"212"},{"Metabolite":"Phosphotyrosine","HMDB Accession":"HMDB0006049","quantitated m/z":"261.99"},{"Metabolite":"Pipecolate","HMDB Accession":"HMDB0000070","quantitated m/z":"130"},{"Metabolite":"Proline","HMDB Accession":"HMDB0000162","quantitated m/z":"116"},{"Metabolite":"pseudouridine","HMDB Accession":"HMDB0000767","quantitated m/z":"243"},{"Metabolite":"Putrescine","HMDB Accession":"HMDB0001414","quantitated m/z":"89"},{"Metabolite":"Pyridoxal-5-P","HMDB Accession":"HMDB0001491","quantitated m/z":"246"},{"Metabolite":"Pyridoxamine","HMDB Accession":"HMDB0001431","quantitated m/z":"169"},{"Metabolite":"Pyroglutamic Acid","HMDB Accession":"HMDB0000267","quantitated m/z":"129.99"},{"Metabolite":"Pyruvate","HMDB Accession":"HMDB0000243","quantitated m/z":"87"},{"Metabolite":"Reduced glutathione","HMDB Accession":"HMDB0000125","quantitated m/z":"306.3"},{"Metabolite":"riboflavin","HMDB Accession":"HMDB0000244","quantitated m/z":"377"},{"Metabolite":"Ribose-5-P","HMDB Accession":"HMDB0001548","quantitated m/z":"229"},{"Metabolite":"Ribulose 5-phosphate","HMDB Accession":"HMDB0000618","quantitated m/z":"229.01"},{"Metabolite":"S-adenosylmethionine (SAM)","HMDB Accession":"HMDB0001185","quantitated m/z":"399"},{"Metabolite":"SAH","HMDB Accession":"HMDB0000939","quantitated m/z":"385"},{"Metabolite":"Sedoheptulose 7-phosphate","HMDB Accession":"HMDB0001068","quantitated m/z":"289"},{"Metabolite":"Serine","HMDB Accession":"HMDB0000187","quantitated m/z":"106.01"},{"Metabolite":"Serotonin","HMDB Accession":"HMDB0000259","quantitated m/z":"160"},{"Metabolite":"Sorbitol","HMDB Accession":"HMDB0000247","quantitated m/z":"180.99"},{"Metabolite":"succinylcarnitine","HMDB Accession":"HMDB0061717","quantitated m/z":"262"},{"Metabolite":"Sucrose","HMDB Accession":"HMDB0000258","quantitated m/z":"341.01"},{"Metabolite":"Taurine","HMDB Accession":"HMDB0000251","quantitated m/z":"125.99"},{"Metabolite":"Taurocyamine","HMDB Accession":"HMDB0003584","quantitated m/z":"168"},{"Metabolite":"Tetrahydrobiopterin","HMDB Accession":"HMDB0000027","quantitated m/z":"240"},{"Metabolite":"Thiamine","HMDB Accession":"HMDB0000235","quantitated m/z":"265"},{"Metabolite":"Thiamine pyrophosphate","HMDB Accession":"HMDB0001372","quantitated m/z":"425"},{"Metabolite":"threonic acid","HMDB Accession":"HMDB0000943","quantitated m/z":"135.01"},{"Metabolite":"Threonine","HMDB Accession":"HMDB0000167","quantitated m/z":"120"},{"Metabolite":"Thymine","HMDB Accession":"HMDB0000262","quantitated m/z":"125"},{"Metabolite":"trigonelline","HMDB Accession":"HMDB0000875","quantitated m/z":"138.01"},{"Metabolite":"Trimethylamine-N-oxide (TMAO)","HMDB Accession":"HMDB0000925","quantitated m/z":"76.1"},{"Metabolite":"Tryptophan","HMDB Accession":"HMDB0000929","quantitated m/z":"205.1"},{"Metabolite":"Tyrosine","HMDB Accession":"HMDB0000158","quantitated m/z":"182.1"},{"Metabolite":"UDP-GlcNAc","HMDB Accession":"HMDB0000290","quantitated m/z":"606"},{"Metabolite":"UDP-Glucose","HMDB Accession":"HMDB0000286","quantitated m/z":"565"},{"Metabolite":"UMP","HMDB Accession":"HMDB0000288","quantitated m/z":"325"},{"Metabolite":"Uracil","HMDB Accession":"HMDB0000300","quantitated m/z":"111"},{"Metabolite":"Urate","HMDB Accession":"HMDB0000289","quantitated m/z":"167.01"},{"Metabolite":"Uridine","HMDB Accession":"HMDB0000296","quantitated m/z":"245.2"},{"Metabolite":"Valine","HMDB Accession":"HMDB0000883","quantitated m/z":"118"},{"Metabolite":"Xanthine","HMDB Accession":"HMDB0000292","quantitated m/z":"150.99"},{"Metabolite":"Xanthosine","HMDB Accession":"HMDB0000299","quantitated m/z":"283.1"},{"Metabolite":"xylonate","HMDB Accession":"HMDB0060256","quantitated m/z":"164.99"}]
}

}