{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST000150","ANALYSIS_ID":"AN000237","VERSION":"1","CREATED_ON":"08-08-2023"},

"PROJECT":{"PROJECT_TITLE":"Association of Metabolic Profile and Microbiome in Chronic Pressure Ulcer Wounds","PROJECT_TYPE":"NMR metabolomic and 16S rRNA taxonomic profiling in chronic pressure ulcer wounds","PROJECT_SUMMARY":"Chronic, non-healing wounds contribute significantly to the suffering of patients with co-morbidities in the clinical population with mild to severely compromised immune systems. Normal wound healing proceeds through a well-described process. However, in chronic wounds this process seems to become dysregulated at the transition between resolution of inflammation and re-epithelialization. Bioburden in the form of colonizing bacteria is a major contributor to the delayed headlining in chronic wounds such as pressure ulcers. However how the microbiome influences the wound metabolic landscape is unknown. Here, we have used a Systems Biology approach to determine the association between the taxonomic and metabolomic profile of wounds colonized by bacteria. Pressure ulcer biopsies were harvested from primary chronic wounds and bisected into top and bottom sections prior to analysis of microbiome by pyrosequencing and analysis of metabolome using 1H nuclear magnetic resonance (NMR) spectroscopy. Bacterial taxonomy revealed that wounds were colonized predominantly by three main phyla, but differed significantly at the genus level. While taxonomic profiles demonstrated significant variability between wounds, metabolic profiles shared significant similarity based on the depth of the wound biopsy. Association between taxonomy and metabolic landscape indicated significant wound-to-wound similarity in metabolite enrichment sets and metabolic pathway impacts, especially with regard to amino acid metabolism. To our knowledge, this is the first demonstration of a statistically robust correlation between bacterial colonization and metabolic landscape within the chronic wound environment.","INSTITUTE":"Montana State University","DEPARTMENT":"Chemistry and Biochemistry","LABORATORY":"Ammons and Copie","LAST_NAME":"Ammons","FIRST_NAME":"Mary Cloud","ADDRESS":"103 CBB, Montana State University, Bozeman, MT 59717","EMAIL":"mcammons@chemistry.montana.edu","PHONE":"406-600-0301","FUNDING_SOURCE":"NIH 1KO1GM103821-01 and 1RO3AR060995-01A1","DOI":"http://dx.doi.org/10.21228/M8WW2P"},

"STUDY":{"STUDY_TITLE":"Association of Metabolic Profile and Microbiome in Chronic Pressure Ulcer Wounds","STUDY_SUMMARY":"Chronic, non-healing wounds contribute significantly to the suffering of patients with co-morbidities in the clinical population with mild to severely compromised immune systems. Normal wound healing proceeds through a well-described process. However, in chronic wounds this process seems to become dysregulated at the transition between resolution of inflammation and re-epithelialization. Bioburden in the form of colonizing bacteria is a major contributor to the delayed headlining in chronic wounds such as pressure ulcers. However how the microbiome influences the wound metabolic landscape is unknown. Here, we have used a Systems Biology approach to determine the association between the taxonomic and metabolomic profile of wounds colonized by bacteria. Pressure ulcer biopsies were harvested from primary chronic wounds and bisected into top and bottom sections prior to analysis of microbiome by pyrosequencing and analysis of metabolome using 1H nuclear magnetic resonance (NMR) spectroscopy. Bacterial taxonomy revealed that wounds were colonized predominantly by three main phyla, but differed significantly at the genus level. While taxonomic profiles demonstrated significant variability between wounds, metabolic profiles shared significant similarity based on the depth of the wound biopsy. Association between taxonomy and metabolic landscape indicated significant wound-to-wound similarity in metabolite enrichment sets and metabolic pathway impacts, especially with regard to amino acid metabolism. To our knowledge, this is the first demonstration of a statistically robust correlation between bacterial colonization and metabolic landscape within the chronic wound environment.","INSTITUTE":"Montana State University","DEPARTMENT":"Chemistry and Biochemistry","LABORATORY":"Ammons","LAST_NAME":"Ammons","FIRST_NAME":"Mary Cloud","ADDRESS":"103 CBB, Montana State University, Bozeman, MT 59717","EMAIL":"mcammons@chemistry.montana.edu","PHONE":"406-600-0301","SUBMIT_DATE":"2015-03-10"},

"SUBJECT":{"SUBJECT_TYPE":"Human","SUBJECT_SPECIES":"Homo sapiens","TAXONOMY_ID":"9606","AGE_OR_AGE_RANGE":"63|27|23|43","GENDER":"Male|Female|Female|Male","HUMAN_RACE":"African American|African American|White, non-hispanic|African American","HUMAN_ETHNICITY":"Cerebral palsy, mental retardation, scoliosis, seizure disorder|Deep vein thrombosis, anemia, bipolar, herpes simplex virus|Urinary tract infection, anxiety, depression","HUMAN_LIFESTYLE_FACTORS":"None|Cerebral palsy, mental retardation, scoliosis, seizure disorder|Deep vein thrombosis, anemia, bipolar, herpes simplex virus|Urinary tract infection, anxiety, depression","HUMAN_MEDICATIONS":"Systemic:Bactrim Topical:None|None|Systemic:Vancomycin|Systemic:Doxycycline Topical:Mesalt","HUMAN_NUTRITION":"Well nourished|G-tube fed, liquid only, malnourished|Well nourished|Inadequate protein intake","SPECIES_GROUP":"Human"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"P1T/P1B",
"Sample ID":"P1B",
"Factors":{"Patient":"Patient 1"}
},
{
"Subject ID":"P1T/P1B",
"Sample ID":"P1T",
"Factors":{"Patient":"Patient 1"}
},
{
"Subject ID":"P2T/P2B",
"Sample ID":"P2B",
"Factors":{"Patient":"Patient 2"}
},
{
"Subject ID":"P2T/P2B",
"Sample ID":"P2T",
"Factors":{"Patient":"Patient 2"}
},
{
"Subject ID":"P3T/P3B",
"Sample ID":"P3B",
"Factors":{"Patient":"Patient 3"}
},
{
"Subject ID":"P3T/P3B",
"Sample ID":"P3T",
"Factors":{"Patient":"Patient 3"}
},
{
"Subject ID":"P4T/P4B",
"Sample ID":"P4B",
"Factors":{"Patient":"Patient 4"}
},
{
"Subject ID":"P4T/P4B",
"Sample ID":"P4T",
"Factors":{"Patient":"Patient 4"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Samples were collected via punch biopsy from wound edge and sectioned into top and bottom
","COLLECTION_PROTOCOL_COMMENTS":"Chronicity is defined as wounds lasting more than 30 days","SAMPLE_TYPE":"Tissue","COLLECTION_METHOD":"Punch biopsy","COLLECTION_LOCATION":"Wound Edge","COLLECTION_FREQUENCY":"Single Collection","VOLUMEORAMOUNT_COLLECTED":"9-32 mg","STORAGE_CONDITIONS":"Flash frozen in liquid nitrogen, shipped on dry ice, stored at -80C
","TISSUE_CELL_IDENTIFICATION":"T=Top section    B=Bottom section","TISSUE_CELL_QUANTITY_TAKEN":"9-32mg"},

"TREATMENT":[],

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"Cold methanol/chloroform extraction","PROCESSING_METHOD":"Biopsy samples were resuspended in ice-cold 60% aqueous methanol and homogenized using a tissue homogenizer (Tissue Tearor™ Model 985370-395, Biospec Products Inc., Bartlesville, OK) set to 2-minute intervals of 10 seconds on and 5 seconds off","PROCESSING_STORAGE_CONDITIONS":"On ice","EXTRACTION_METHOD":"1:1 aqueous chloroform","EXTRACT_CLEANUP":"Aqueous layers collected and lyophilized","EXTRACT_STORAGE":"Lyophilized samples were stored at -80C","SAMPLE_RESUSPENSION":"Resuspended in 10mM NaH2PO4/Na2HPO4","ORGAN":"Skin","ORGAN_SPECIFICATION":"Chronic wound biopsy"},

"CHROMATOGRAPHY":[],

"ANALYSIS":{"LABORATORY_NAME":"Copie Lab","ANALYSIS_TYPE":"NMR","SOFTWARE_VERSION":"Topspin version 3","OPERATOR_NAME":"Brian Tripet","DETECTOR_TYPE":"cryoprobeTM"},

"NM":{"INSTRUMENT_NAME":"Bruker Avance III","INSTRUMENT_TYPE":"FT-NMR","NMR_EXPERIMENT_TYPE":"1D 1H","SPECTROMETER_FREQUENCY":"600 MHz","OFFSET_FREQUENCY":"600 mHz","PRESATURATION_POWER_LEVEL":"cryoprobeTM","CHEMICAL_SHIFT_REF_CPD":"10mM NaH2PO4/ Na2HPO4"},

"NMR_METABOLITE_DATA":{
"Units":"mM/gm tissue",

"Data":[{"Metabolite":"1_3-dihydroxyacetone","P1B":"0.1591","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"1_3-dimethylurate","P1B":"","P1T":"","P2B":"0.0548","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"2-aminobutyrate","P1B":"","P1T":"","P2B":"0.2581","P2T":"0.1545","P3B":"0.3645","P3T":"0.6474","P4B":"","P4T":""},{"Metabolite":"2-ethylacrylate","P1B":"","P1T":"","P2B":"0.1548","P2T":"","P3B":"","P3T":"0.2895","P4B":"","P4T":""},{"Metabolite":"2-hydroxy-3-methylvalerate","P1B":"0.2864","P1T":"","P2B":"0.3806","P2T":"","P3B":"0.2000","P3T":"","P4B":"","P4T":"0.2810"},{"Metabolite":"2-hydroxybutyrate","P1B":"","P1T":"","P2B":"0.1065","P2T":"","P3B":"0.4548","P3T":"","P4B":"","P4T":""},{"Metabolite":"2-hydroxyisocaproate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.2452","P3T":"","P4B":"","P4T":"0.1524"},{"Metabolite":"2-hydroxyphenylacetate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.0774","P3T":"","P4B":"","P4T":""},{"Metabolite":"2-Octenoate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.6810"},{"Metabolite":"2-oxocaproate","P1B":"","P1T":"","P2B":"0.1032","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"2-oxoglutarate","P1B":"","P1T":"","P2B":"3.7742","P2T":"0.0818","P3B":"0.1903","P3T":"","P4B":"","P4T":""},{"Metabolite":"2-phosphoglycerate","P1B":"1.4682","P1T":"12.1444","P2B":"","P2T":"","P3B":"2.9613","P3T":"","P4B":"","P4T":"1.3333"},{"Metabolite":"3_5-dibromotyrosine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1387","P3T":"","P4B":"","P4T":""},{"Metabolite":"3-chlorotyrosine","P1B":"0.1864","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"3-hydroxyisovalerate","P1B":"0.2182","P1T":"0.9667","P2B":"0.1452","P2T":"0.1636","P3B":"0.2710","P3T":"0.4526","P4B":"","P4T":"0.1381"},{"Metabolite":"3-methyl-2-oxovalerate","P1B":"","P1T":"","P2B":"0.0839","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"3-methyladipate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.3000","P3T":"","P4B":"","P4T":""},{"Metabolite":"3-methylxanthine","P1B":"","P1T":"","P2B":"0.1516","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"4-pyridoxate","P1B":"","P1T":"1.0333","P2B":"0.2032","P2T":"0.1136","P3B":"","P3T":"","P4B":"","P4T":"0.3286"},{"Metabolite":"5-aminolevulinate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.3476"},{"Metabolite":"6-hydroxynicotinate","P1B":"","P1T":"","P2B":"0.1935","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.3381"},{"Metabolite":"Acetamide","P1B":"0.0909","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Acetate","P1B":"1.5955","P1T":"1.6778","P2B":"1.5419","P2T":"1.7727","P3B":"1.4806","P3T":"2.2316","P4B":"","P4T":"1.7048"},{"Metabolite":"Acetoacetate","P1B":"","P1T":"","P2B":"0.0935","P2T":"0.1000","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Acetone","P1B":"","P1T":"0.2667","P2B":"","P2T":"0.0591","P3B":"","P3T":"","P4B":"","P4T":"0.0810"},{"Metabolite":"Adenine","P1B":"0.6091","P1T":"","P2B":"","P2T":"0.6545","P3B":"1.0645","P3T":"1.0368","P4B":"","P4T":"0.4619"},{"Metabolite":"Adenosine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1355","P3T":"","P4B":"","P4T":""},{"Metabolite":"Alanine","P1B":"1.1636","P1T":"2.1444","P2B":"1.1065","P2T":"0.8818","P3B":"2.0484","P3T":"2.7263","P4B":"","P4T":"0.4762"},{"Metabolite":"Allantoin","P1B":"","P1T":"4.5333","P2B":"0.7484","P2T":"","P3B":"0.7161","P3T":"2.0053","P4B":"","P4T":"1.1857"},{"Metabolite":"Alloisoleucine","P1B":"0.3182","P1T":"0.8111","P2B":"","P2T":"0.3909","P3B":"0.2161","P3T":"0.9211","P4B":"","P4T":""},{"Metabolite":"Anserine","P1B":"0.1864","P1T":"","P2B":"","P2T":"","P3B":"0.3129","P3T":"","P4B":"","P4T":"0.6048"},{"Metabolite":"Arabinitol","P1B":"","P1T":"","P2B":"0.3194","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Arginine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.3839","P3T":"","P4B":"","P4T":""},{"Metabolite":"Ascorbate","P1B":"","P1T":"","P2B":"0.9000","P2T":"0.6682","P3B":"","P3T":"","P4B":"0.3590","P4T":"0.8429"},{"Metabolite":"Aspartate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.8548","P3T":"","P4B":"","P4T":""},{"Metabolite":"Betaine","P1B":"0.1091","P1T":"0.7333","P2B":"0.0742","P2T":"0.0955","P3B":"","P3T":"0.2632","P4B":"","P4T":""},{"Metabolite":"Butanone","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1355","P3T":"","P4B":"","P4T":""},{"Metabolite":"Butyrate","P1B":"","P1T":"","P2B":"0.1258","P2T":"","P3B":"0.1935","P3T":"","P4B":"","P4T":""},{"Metabolite":"Choline","P1B":"","P1T":"0.7222","P2B":"0.2710","P2T":"0.1364","P3B":"0.6613","P3T":"0.8684","P4B":"","P4T":"0.2143"},{"Metabolite":"cis-Aconitate","P1B":"0.7136","P1T":"","P2B":"","P2T":"","P3B":"0.2484","P3T":"","P4B":"","P4T":""},{"Metabolite":"Citrate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1452","P3T":"","P4B":"","P4T":""},{"Metabolite":"Creatine","P1B":"0.4955","P1T":"0.5889","P2B":"0.2645","P2T":"0.1500","P3B":"0.3742","P3T":"0.2316","P4B":"","P4T":"0.1667"},{"Metabolite":"Creatine phosphate","P1B":"","P1T":"0.6222","P2B":"0.2516","P2T":"0.2000","P3B":"","P3T":"0.3632","P4B":"","P4T":"0.1476"},{"Metabolite":"Creatinine","P1B":"","P1T":"","P2B":"0.2742","P2T":"0.1909","P3B":"0.3548","P3T":"0.3316","P4B":"","P4T":""},{"Metabolite":"Cysteine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.7097","P3T":"","P4B":"","P4T":""},{"Metabolite":"Dimethyl sulfone","P1B":"","P1T":"","P2B":"","P2T":"0.0545","P3B":"0.0419","P3T":"","P4B":"","P4T":""},{"Metabolite":"Ethanol","P1B":"3.6864","P1T":"8.7111","P2B":"2.5806","P2T":"3.0182","P3B":"2.8774","P3T":"4.8842","P4B":"3.1897","P4T":"3.3857"},{"Metabolite":"Ethanolamine","P1B":"0.6000","P1T":"","P2B":"","P2T":"","P3B":"0.7484","P3T":"","P4B":"","P4T":""},{"Metabolite":"Ethylene glycol","P1B":"0.1364","P1T":"","P2B":"0.1839","P2T":"","P3B":"0.1452","P3T":"","P4B":"","P4T":"0.2048"},{"Metabolite":"Ethylmalonate","P1B":"0.2409","P1T":"0.5000","P2B":"","P2T":"0.4864","P3B":"","P3T":"0.6211","P4B":"","P4T":"0.1762"},{"Metabolite":"Formate","P1B":"1.8591","P1T":"5.4778","P2B":"2.8129","P2T":"2.2091","P3B":"2.3000","P3T":"3.3526","P4B":"","P4T":"2.3286"},{"Metabolite":"Fucose","P1B":"","P1T":"","P2B":"0.1290","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Galactarate","P1B":"","P1T":"","P2B":"0.5258","P2T":"","P3B":"","P3T":"0.6421","P4B":"","P4T":""},{"Metabolite":"Galactose","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"1.3387","P3T":"","P4B":"0.8179","P4T":""},{"Metabolite":"Glucarate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"1.6158","P4B":"","P4T":""},{"Metabolite":"Glucose","P1B":"3.4182","P1T":"7.3222","P2B":"0.7677","P2T":"1.4682","P3B":"2.5484","P3T":"2.3263","P4B":"2.0308","P4T":"2.6619"},{"Metabolite":"Glutamate","P1B":"2.0955","P1T":"","P2B":"","P2T":"0.4545","P3B":"1.7839","P3T":"2.4895","P4B":"","P4T":"0.7571"},{"Metabolite":"Glutamine","P1B":"0.8682","P1T":"","P2B":"","P2T":"","P3B":"0.8032","P3T":"","P4B":"","P4T":""},{"Metabolite":"Glutarate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.1571"},{"Metabolite":"Glycerate","P1B":"1.5318","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Glycine","P1B":"1.3727","P1T":"","P2B":"0.7742","P2T":"0.6318","P3B":"1.1677","P3T":"1.2105","P4B":"","P4T":"0.6429"},{"Metabolite":"Glycolate","P1B":"0.2864","P1T":"0.8778","P2B":"0.3387","P2T":"0.4909","P3B":"0.1226","P3T":"0.7053","P4B":"","P4T":"0.2619"},{"Metabolite":"GTP","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.2129","P3T":"","P4B":"","P4T":""},{"Metabolite":"Guanidoacetate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.2619"},{"Metabolite":"Homocysteine","P1B":"0.2500","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Homoserine","P1B":"0.9682","P1T":"","P2B":"","P2T":"0.7091","P3B":"0.5129","P3T":"","P4B":"","P4T":"0.8286"},{"Metabolite":"Hypoxanthine","P1B":"0.4409","P1T":"","P2B":"0.1710","P2T":"0.5273","P3B":"0.8097","P3T":"0.7842","P4B":"","P4T":"0.3476"},{"Metabolite":"Inosine","P1B":"0.2864","P1T":"","P2B":"","P2T":"","P3B":"0.2226","P3T":"","P4B":"","P4T":""},{"Metabolite":"Isobutyrate","P1B":"","P1T":"","P2B":"0.0516","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Isocaproate","P1B":"0.1136","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"0.1579","P4B":"","P4T":""},{"Metabolite":"Isocitrate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.8323","P3T":"","P4B":"","P4T":"0.4714"},{"Metabolite":"Isoleucine","P1B":"0.2545","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Isovalerate","P1B":"0.0818","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Lactate","P1B":"3.8000","P1T":"8.1222","P2B":"16.0419","P2T":"7.5227","P3B":"7.9129","P3T":"12.7316","P4B":"2.1590","P4T":"2.2667"},{"Metabolite":"Leucine","P1B":"0.1727","P1T":"0.8000","P2B":"0.0968","P2T":"","P3B":"0.8194","P3T":"0.5737","P4B":"","P4T":"0.1429"},{"Metabolite":"Lysine","P1B":"","P1T":"","P2B":"0.2839","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Malate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.4548","P3T":"","P4B":"","P4T":""},{"Metabolite":"Maleate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1258","P3T":"","P4B":"","P4T":""},{"Metabolite":"Malonate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1645","P3T":"","P4B":"","P4T":""},{"Metabolite":"Methanol","P1B":"5.2727","P1T":"10.0111","P2B":"3.8032","P2T":"4.6091","P3B":"7.1452","P3T":"7.0000","P4B":"2.7333","P4T":"4.4905"},{"Metabolite":"Methionine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.1048"},{"Metabolite":"Methylamine","P1B":"","P1T":"","P2B":"0.1129","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.2000"},{"Metabolite":"Methylguanidine","P1B":"0.1591","P1T":"","P2B":"0.0806","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.1095"},{"Metabolite":"Methylmalonate","P1B":"0.1591","P1T":"","P2B":"","P2T":"","P3B":"0.1355","P3T":"","P4B":"","P4T":"0.3524"},{"Metabolite":"myo-inositol","P1B":"0.8818","P1T":"","P2B":"0.4387","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"N-acetylcysteine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1419","P3T":"","P4B":"","P4T":"0.1524"},{"Metabolite":"N-acetylglutamate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.0903","P3T":"","P4B":"","P4T":""},{"Metabolite":"N-acetylglutamine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.0871","P3T":"","P4B":"","P4T":""},{"Metabolite":"N-acetylglycine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1258","P3T":"","P4B":"","P4T":"0.1048"},{"Metabolite":"N-acetylornithine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1161","P3T":"","P4B":"","P4T":""},{"Metabolite":"N_N-dimethylformamide","P1B":"0.0818","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"0.1789","P4B":"","P4T":""},{"Metabolite":"O-acetylcarnitine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1581","P3T":"","P4B":"","P4T":""},{"Metabolite":"O-acetylcholine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1387","P3T":"","P4B":"","P4T":""},{"Metabolite":"O-phosphocholine","P1B":"0.5636","P1T":"0.4778","P2B":"","P2T":"","P3B":"0.1871","P3T":"0.8211","P4B":"","P4T":""},{"Metabolite":"O-phosphoethanolamine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.8613","P3T":"1.2789","P4B":"","P4T":""},{"Metabolite":"O-phosphoserine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"0.9077","P4T":""},{"Metabolite":"Oxypurinol","P1B":"4.4182","P1T":"","P2B":"","P2T":"","P3B":"3.9065","P3T":"","P4B":"3.0692","P4T":""},{"Metabolite":"Proline","P1B":"0.8955","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.3762"},{"Metabolite":"Propionate","P1B":"","P1T":"","P2B":"","P2T":"0.1682","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Protocatechuate","P1B":"","P1T":"","P2B":"0.2548","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Pyridoxine","P1B":"","P1T":"","P2B":"0.0548","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Pyruvate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.2581","P3T":"0.1895","P4B":"","P4T":"0.1571"},{"Metabolite":"Serine","P1B":"1.0136","P1T":"","P2B":"","P2T":"","P3B":"1.1452","P3T":"","P4B":"","P4T":"0.9524"},{"Metabolite":"Succinate","P1B":"0.1682","P1T":"0.4111","P2B":"0.0806","P2T":"0.0636","P3B":"0.1032","P3T":"","P4B":"","P4T":""},{"Metabolite":"Succinylacetone","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.2381"},{"Metabolite":"Tartrate","P1B":"1.6318","P1T":"","P2B":"0.8387","P2T":"","P3B":"1.0387","P3T":"1.6421","P4B":"1.0744","P4T":""},{"Metabolite":"Taurine","P1B":"1.6955","P1T":"","P2B":"0.6806","P2T":"0.5000","P3B":"3.4935","P3T":"4.2158","P4B":"","P4T":"0.6048"},{"Metabolite":"Threonine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.9452","P3T":"","P4B":"","P4T":""},{"Metabolite":"Threophylline","P1B":"0.1136","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"trans-4-hydroxy-L-proline","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"0.8667"},{"Metabolite":"trans-aconitate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1871","P3T":"","P4B":"","P4T":""},{"Metabolite":"Treonate","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":"1.1333"},{"Metabolite":"Trimethylamine N-oxide","P1B":"0.0727","P1T":"0.6333","P2B":"0.0387","P2T":"0.1545","P3B":"","P3T":"","P4B":"","P4T":"0.0571"},{"Metabolite":"Tyramine","P1B":"","P1T":"","P2B":"","P2T":"","P3B":"0.1452","P3T":"","P4B":"","P4T":""},{"Metabolite":"Tyrosine","P1B":"0.3818","P1T":"","P2B":"","P2T":"","P3B":"0.0968","P3T":"","P4B":"","P4T":""},{"Metabolite":"Uridine","P1B":"0.5409","P1T":"","P2B":"","P2T":"","P3B":"0.2452","P3T":"","P4B":"","P4T":""},{"Metabolite":"Valerate","P1B":"","P1T":"","P2B":"0.0742","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Valine","P1B":"0.3545","P1T":"0.6000","P2B":"0.5323","P2T":"0.4636","P3B":"0.7032","P3T":"1.3053","P4B":"","P4T":"0.2095"},{"Metabolite":"Valproate","P1B":"","P1T":"","P2B":"0.0613","P2T":"0.1591","P3B":"0.2548","P3T":"0.2474","P4B":"","P4T":""},{"Metabolite":"Xanthosine","P1B":"","P1T":"0.6111","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""},{"Metabolite":"Xylose","P1B":"0.6864","P1T":"","P2B":"","P2T":"","P3B":"","P3T":"","P4B":"","P4T":""}],

"Metabolites":[{"Metabolite":"1,3-dihydroxyacetone","pubchem_id":"670","inchi_key":"","kegg_id":"C00184","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"1,3-dimethylurate","pubchem_id":"70346","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-aminobutyrate","pubchem_id":"6657","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-ethylacrylate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-hydroxy-3-methylvalerate","pubchem_id":"10796774","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-hydroxybutyrate","pubchem_id":"11266","inchi_key":"","kegg_id":"C05984","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-hydroxyisocaproate","pubchem_id":"92779","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-hydroxyphenylacetate","pubchem_id":"11914","inchi_key":"","kegg_id":"C01983","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-Octenoate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-oxocaproate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-oxoglutarate","pubchem_id":"51","inchi_key":"","kegg_id":"C00026","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"2-phosphoglycerate","pubchem_id":"59","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"3,5-dibromotyrosine","pubchem_id":"67532","inchi_key":"","kegg_id":"C03224","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"3-chlorotyrosine","pubchem_id":"119226","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"3-hydroxyisovalerate","pubchem_id":"69362","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"3-methyl-2-oxovalerate","pubchem_id":"47","inchi_key":"","kegg_id":"C03465","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"3-methyladipate","pubchem_id":"6999745","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"3-methylxanthine","pubchem_id":"70639","inchi_key":"","kegg_id":"C16357","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"4-pyridoxate","pubchem_id":"6723","inchi_key":"","kegg_id":"C00847","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"5-aminolevulinate","pubchem_id":"137","inchi_key":"","kegg_id":"C00430","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"6-hydroxynicotinate","pubchem_id":"72924","inchi_key":"","kegg_id":"C01020","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Acetamide","pubchem_id":"178","inchi_key":"","kegg_id":"C06244","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Acetate","pubchem_id":"176","inchi_key":"","kegg_id":"C00033","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Acetoacetate","pubchem_id":"96","inchi_key":"","kegg_id":"C00164","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Acetone","pubchem_id":"180","inchi_key":"","kegg_id":"C00207","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Adenine","pubchem_id":"190","inchi_key":"","kegg_id":"C00147","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Adenosine","pubchem_id":"60961","inchi_key":"","kegg_id":"C00212","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Alanine","pubchem_id":"5950","inchi_key":"","kegg_id":"C00041","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Allantoin","pubchem_id":"204","inchi_key":"","kegg_id":"C01551","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Alloisoleucine","pubchem_id":"99288","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Anserine","pubchem_id":"112072","inchi_key":"","kegg_id":"C01262","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Arabinitol","pubchem_id":"827","inchi_key":"","kegg_id":"C01904","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Arginine","pubchem_id":"6322","inchi_key":"","kegg_id":"C00062","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Ascorbate","pubchem_id":"54670067","inchi_key":"","kegg_id":"C00072","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Aspartate","pubchem_id":"5960","inchi_key":"","kegg_id":"C00049","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Betaine","pubchem_id":"247","inchi_key":"","kegg_id":"C00719","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Butanone","pubchem_id":"6569","inchi_key":"","kegg_id":"C02845","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Butyrate","pubchem_id":"20975673","inchi_key":"","kegg_id":"C00246","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Choline","pubchem_id":"305","inchi_key":"","kegg_id":"C00114","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"cis-Aconitate","pubchem_id":"643757","inchi_key":"","kegg_id":"C00417","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Citrate","pubchem_id":"311","inchi_key":"","kegg_id":"C00158","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Creatine","pubchem_id":"586","inchi_key":"","kegg_id":"C00300","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Creatine phosphate","pubchem_id":"587","inchi_key":"","kegg_id":"C02305","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Creatinine","pubchem_id":"588","inchi_key":"","kegg_id":"C00791","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Cysteine","pubchem_id":"594","inchi_key":"","kegg_id":"C00097","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Dimethyl sulfone","pubchem_id":"6213","inchi_key":"","kegg_id":"C11142","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Ethanol","pubchem_id":"702","inchi_key":"","kegg_id":"C00469","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Ethanolamine","pubchem_id":"700","inchi_key":"","kegg_id":"C00189","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Ethylene glycol","pubchem_id":"174","inchi_key":"","kegg_id":"C01380","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Ethylmalonate","pubchem_id":"70615","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Formate","pubchem_id":"284","inchi_key":"","kegg_id":"C00058","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Fucose","pubchem_id":"19466","inchi_key":"","kegg_id":"C01019","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Galactarate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Galactose","pubchem_id":"6036","inchi_key":"","kegg_id":"C00124","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Glucarate","pubchem_id":"33037","inchi_key":"","kegg_id":"C00818","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Glucose","pubchem_id":"5793","inchi_key":"","kegg_id":"C00031","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Glutamate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Glutamine","pubchem_id":"5961","inchi_key":"","kegg_id":"C00064","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Glutarate","pubchem_id":"743","inchi_key":"","kegg_id":"C00489","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Glycerate","pubchem_id":"439194","inchi_key":"","kegg_id":"C00258","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Glycine","pubchem_id":"750","inchi_key":"","kegg_id":"C00037","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Glycolate","pubchem_id":"757","inchi_key":"","kegg_id":"C00160","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"GTP","pubchem_id":"6830","inchi_key":"","kegg_id":"C00044","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Guanidoacetate","pubchem_id":"763","inchi_key":"","kegg_id":"C00581","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Homocysteine","pubchem_id":"778","inchi_key":"","kegg_id":"C05330","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Homoserine","pubchem_id":"12647","inchi_key":"","kegg_id":"C00263","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Hypoxanthine","pubchem_id":"790","inchi_key":"","kegg_id":"C00262","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Inosine","pubchem_id":"6021","inchi_key":"","kegg_id":"C00294","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Isobutyrate","pubchem_id":"6590","inchi_key":"","kegg_id":"C02632","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Isocaproate","pubchem_id":"12587","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Isocitrate","pubchem_id":"1198","inchi_key":"","kegg_id":"C00311","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Isoleucine","pubchem_id":"6306","inchi_key":"","kegg_id":"C00407","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Isovalerate","pubchem_id":"10430","inchi_key":"","kegg_id":"C08262","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Lactate","pubchem_id":"107689","inchi_key":"","kegg_id":"C00186","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Leucine","pubchem_id":"6106","inchi_key":"","kegg_id":"C00123","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Lysine","pubchem_id":"5962","inchi_key":"","kegg_id":"C00047","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Malate","pubchem_id":"222656","inchi_key":"","kegg_id":"C00149","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Maleate","pubchem_id":"444266","inchi_key":"","kegg_id":"C01384","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Malonate","pubchem_id":"867","inchi_key":"","kegg_id":"C00383","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Methanol","pubchem_id":"887","inchi_key":"","kegg_id":"C00132","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Methionine","pubchem_id":"6137","inchi_key":"","kegg_id":"C00073","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Methylamine","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Methylguanidine","pubchem_id":"10111","inchi_key":"","kegg_id":"C02294","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Methylmalonate","pubchem_id":"487","inchi_key":"","kegg_id":"C02170","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"myo-inositol","pubchem_id":"892","inchi_key":"","kegg_id":"C00137","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"N-acetylcysteine","pubchem_id":"12035","inchi_key":"","kegg_id":"C06809","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"N-acetylglutamate","pubchem_id":"70914","inchi_key":"","kegg_id":"C00624","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"N-acetylglutamine","pubchem_id":"25561","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"N-acetylglycine","pubchem_id":"10972","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"N-acetylornithine","pubchem_id":"439232","inchi_key":"","kegg_id":"C00437","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"N,N-dimethylformamide","pubchem_id":"6228","inchi_key":"","kegg_id":"C03134","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"O-acetylcarnitine","pubchem_id":"1","inchi_key":"","kegg_id":"C02571","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"O-acetylcholine","pubchem_id":"187","inchi_key":"","kegg_id":"C01996","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"O-phosphocholine","pubchem_id":"135437","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"O-phosphoethanolamine","pubchem_id":"1015","inchi_key":"","kegg_id":"C00346","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"O-phosphoserine","pubchem_id":"68841","inchi_key":"","kegg_id":"C01005","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Oxypurinol","pubchem_id":"4644","inchi_key":"","kegg_id":"C07599","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Proline","pubchem_id":"145742","inchi_key":"","kegg_id":"C00148","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Propionate","pubchem_id":"1032","inchi_key":"","kegg_id":"C00163","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Protocatechuate","pubchem_id":"72","inchi_key":"","kegg_id":"C00230","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Pyridoxine","pubchem_id":"1054","inchi_key":"","kegg_id":"C00314","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Pyruvate","pubchem_id":"1060","inchi_key":"","kegg_id":"C00022","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Serine","pubchem_id":"5951","inchi_key":"","kegg_id":"C00065","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Succinate","pubchem_id":"1110","inchi_key":"","kegg_id":"C00042","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Succinylacetone","pubchem_id":"5312","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Tartrate","pubchem_id":"444305","inchi_key":"","kegg_id":"C00898","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Taurine","pubchem_id":"1123","inchi_key":"","kegg_id":"C00245","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Threonine","pubchem_id":"6288","inchi_key":"","kegg_id":"C00188","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Threophylline","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"trans-4-hydroxy-L-proline","pubchem_id":"11137200","inchi_key":"","kegg_id":"C04397","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"trans-aconitate","pubchem_id":"444212","inchi_key":"","kegg_id":"C02341","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Treonate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Trimethylamine N-oxide","pubchem_id":"1145","inchi_key":"","kegg_id":"C01104","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Tyramine","pubchem_id":"5610","inchi_key":"","kegg_id":"C00483","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Tyrosine","pubchem_id":"6057","inchi_key":"","kegg_id":"C00082","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Uridine","pubchem_id":"6029","inchi_key":"","kegg_id":"C00299","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Valerate","pubchem_id":"7991","inchi_key":"","kegg_id":"C00803","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Valine","pubchem_id":"6287","inchi_key":"","kegg_id":"C00183","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Valproate","pubchem_id":"","inchi_key":"","kegg_id":"","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Xanthosine","pubchem_id":"64959","inchi_key":"","kegg_id":"C01762","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""},{"Metabolite":"Xylose","pubchem_id":"135191","inchi_key":"","kegg_id":"C00181","other_id":"","other_id_type":"UMontana_Ammons_Lab_ID","ri":"","ri_type":"","moverz_quant":"","":""}]
}

}