{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST001301","ANALYSIS_ID":"AN002167","VERSION":"1","CREATED_ON":"January 8, 2020, 11:32 am"},

"PROJECT":{"PROJECT_TITLE":"Luminal metabolome profiles of human microbiota-associated (HMA) mice treated with anti-IL-22 antibody or control antibody","PROJECT_SUMMARY":"We found that healthy (HC)-HMA mice, GF mice were colonized with gut microbiota derived from human HC, were protected from Clostridioides difficile (C. difficile) infection. However, the colonization resistance of HC-HMA mice was abolished by treatment of anti-IL-22 antibody, unlike control antibody-treated HC-HMA mice. Additionally, the gut microbial composition of anti-IL22 antibody-treated HC-HMA mice, C. difficile-susceptible mice, were differ from that of control antibody, thereby it appears that luminal metabolome is changed between 2 groups. To examine the change in the luminal metabolites, fecal samples were collected from anti-IL-22 /control -antibody treated HC-HMA mice, and metabolite profiles of them were analyzed.","INSTITUTE":"University of Michigan","DEPARTMENT":"Internal Medicine","LAST_NAME":"Kamada","FIRST_NAME":"Nobuhiko","ADDRESS":"1150 W Medical center Dr, Ann Arbor, MI 48109, USA","EMAIL":"nkamada@umich.edu","PHONE":"+1-734-763-2142"},

"STUDY":{"STUDY_TITLE":"Luminal metabolome profiles of human microbiota-associated (HMA) mice treated with anti-IL-22 antibody or control antibody","STUDY_SUMMARY":"Luminal (fecal) metabolome of anti-IL-22 antibody-treated HMA mice and control antibody-treated HMA mice were compared.","INSTITUTE":"University of Michigan","DEPARTMENT":"Internal Medicine","LAST_NAME":"Kamada","FIRST_NAME":"Nobuhiko","ADDRESS":"1150 W Medical center Dr, Ann Arbor, MI 48109, USA","EMAIL":"nkamada@umich.edu","PHONE":"+1-734-763-2142"},

"SUBJECT":{"SUBJECT_TYPE":"Mammal","SUBJECT_SPECIES":"Mus musculus","TAXONOMY_ID":"10090"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"Ab1",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"Ab1.d"}
},
{
"Subject ID":"-",
"Sample ID":"Ab2",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"Ab2.d"}
},
{
"Subject ID":"-",
"Sample ID":"Ab3",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"Ab3.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+Ctrl Ab #6",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+Ctrl Ab #6.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+Ctrl Ab #7",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+Ctrl Ab #7.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+Ctrl Ab #8",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+Ctrl Ab #8.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+Ctrl Ab #9",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+Ctrl Ab #9.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+Ctrl Ab #10",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+Ctrl Ab #10.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+Ctrl Ab #6",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+Ctrl Ab #6.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+Ctrl Ab #7",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+Ctrl Ab #7.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+Ctrl Ab #8",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+Ctrl Ab #8.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+Ctrl Ab #9",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+Ctrl Ab #9.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+Ctrl Ab #10",
"Factors":{"Factor":"Control antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+Ctrl Ab #10.d"}
},
{
"Subject ID":"-",
"Sample ID":"Ab4",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"Ab4.d"}
},
{
"Subject ID":"-",
"Sample ID":"Ab5",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"Ab5.d"}
},
{
"Subject ID":"-",
"Sample ID":"Ab6",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"Ab6.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+aIL-22 Ab #11",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+aIL-22 Ab #11.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+aIL-22 Ab #12",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+aIL-22 Ab #12.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+aIL-22 Ab #13",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+aIL-22 Ab #13.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+aIL-22 Ab #14",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+aIL-22 Ab #14.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-HMA-Rag1KO+aIL-22 Ab #15",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-HMA-Rag1KO+aIL-22 Ab #15.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+aIL-22l Ab #11",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+aIL-22l Ab #11.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+aIL-22l Ab #12",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+aIL-22l Ab #12.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+aIL-22l Ab #13",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+aIL-22l Ab #13.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+aIL-22l Ab #14",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+aIL-22l Ab #14.d"}
},
{
"Subject ID":"-",
"Sample ID":"HC-Rag1KO+aIL-22l Ab #15",
"Factors":{"Factor":"Anti-IL-22 antibody"},
"Additional sample data":{"RAW_FILE_NAME":"HC-Rag1KO+aIL-22l Ab #15.d"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Feces of anti-IL-22 antibody/control antibody-treated HC-HMA mice were harvested.","SAMPLE_TYPE":"Feces"},

"TREATMENT":{"TREATMENT_SUMMARY":"GF C57BL/6 mice were colonized with HC microbiotas for 2 weeks. After colonization of HC microbiota, the mice were treated with control or anti-IL-22 antibody twice (day -5 and day -3) before collecting fecal samples."},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"Fecal samples were lyophilized using a VD-800R lyophilizer (TAITEC) for 24 hours. Freeze-dried feces were disrupted with 3.0-mm Zirconia Beads (Biomedical Science) by vigorous shaking (1,500 rpm for 10 min) using Shake Master (Biomedical Science). Fecal metabolites were extracted using the methanol:chloroform:water extraction protocol."},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_TYPE":"Other","INSTRUMENT_NAME":"Agilent 7100 CE","COLUMN_NAME":"COSMO(+), i.d.50 µm(anion","INTERNAL_STANDARD":"20 μM of D-camphor-10-sulfonic acid (CSA)"},

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

"MS":{"INSTRUMENT_NAME":"Agilent G3250AA LC/MSD TOF system","INSTRUMENT_TYPE":"Other","MS_TYPE":"ESI","ION_MODE":"NEGATIVE","MS_COMMENTS":"In-house software (MasterHands) was used for peak area integration and annotation."},

"MS_METABOLITE_DATA":{
"Units":"nmol/g",

"Data":[{"Metabolite":"Acetyl CoA","Ab1":"44","Ab2":"23","Ab3":"30","HC-HMA-Rag1KO+Ctrl Ab #6":"31","HC-HMA-Rag1KO+Ctrl Ab #7":"60","HC-HMA-Rag1KO+Ctrl Ab #8":"43","HC-HMA-Rag1KO+Ctrl Ab #9":"48","HC-HMA-Rag1KO+Ctrl Ab #10":"34","HC-Rag1KO+Ctrl Ab #6":"12","HC-Rag1KO+Ctrl Ab #7":"15","HC-Rag1KO+Ctrl Ab #8":"21","HC-Rag1KO+Ctrl Ab #9":"10","HC-Rag1KO+Ctrl Ab #10":"34","Ab4":"21","Ab5":"16","Ab6":"18","HC-HMA-Rag1KO+aIL-22 Ab #11":"18","HC-HMA-Rag1KO+aIL-22 Ab #12":"35","HC-HMA-Rag1KO+aIL-22 Ab #13":"34","HC-HMA-Rag1KO+aIL-22 Ab #14":"49","HC-HMA-Rag1KO+aIL-22 Ab #15":"48","HC-Rag1KO+aIL-22l Ab #11":"3.3","HC-Rag1KO+aIL-22l Ab #12":"38","HC-Rag1KO+aIL-22l Ab #13":"49","HC-Rag1KO+aIL-22l Ab #14":"50","HC-Rag1KO+aIL-22l Ab #15":"72"},{"Metabolite":"Adipate","Ab1":"0","Ab2":"0","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"22","HC-HMA-Rag1KO+Ctrl Ab #7":"18","HC-HMA-Rag1KO+Ctrl Ab #8":"19","HC-HMA-Rag1KO+Ctrl Ab #9":"17","HC-HMA-Rag1KO+Ctrl Ab #10":"49","HC-Rag1KO+Ctrl Ab #6":"0","HC-Rag1KO+Ctrl Ab #7":"0","HC-Rag1KO+Ctrl Ab #8":"28","HC-Rag1KO+Ctrl Ab #9":"0","HC-Rag1KO+Ctrl Ab #10":"0","Ab4":"0","Ab5":"0","Ab6":"0","HC-HMA-Rag1KO+aIL-22 Ab #11":"33","HC-HMA-Rag1KO+aIL-22 Ab #12":"24","HC-HMA-Rag1KO+aIL-22 Ab #13":"15","HC-HMA-Rag1KO+aIL-22 Ab #14":"48","HC-HMA-Rag1KO+aIL-22 Ab #15":"20","HC-Rag1KO+aIL-22l Ab #11":"45","HC-Rag1KO+aIL-22l Ab #12":"0","HC-Rag1KO+aIL-22l Ab #13":"48","HC-Rag1KO+aIL-22l Ab #14":"0","HC-Rag1KO+aIL-22l Ab #15":"0"},{"Metabolite":"ADP-ribose","Ab1":"0","Ab2":"0","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"20","HC-HMA-Rag1KO+Ctrl Ab #7":"20","HC-HMA-Rag1KO+Ctrl Ab #8":"28","HC-HMA-Rag1KO+Ctrl Ab #9":"24","HC-HMA-Rag1KO+Ctrl Ab #10":"19","HC-Rag1KO+Ctrl Ab #6":"12","HC-Rag1KO+Ctrl Ab #7":"11","HC-Rag1KO+Ctrl Ab #8":"10","HC-Rag1KO+Ctrl Ab #9":"11","HC-Rag1KO+Ctrl Ab #10":"14","Ab4":"0","Ab5":"0","Ab6":"0","HC-HMA-Rag1KO+aIL-22 Ab #11":"22","HC-HMA-Rag1KO+aIL-22 Ab #12":"27","HC-HMA-Rag1KO+aIL-22 Ab #13":"20","HC-HMA-Rag1KO+aIL-22 Ab #14":"31","HC-HMA-Rag1KO+aIL-22 Ab #15":"29","HC-Rag1KO+aIL-22l Ab #11":"0","HC-Rag1KO+aIL-22l Ab #12":"0","HC-Rag1KO+aIL-22l Ab #13":"11","HC-Rag1KO+aIL-22l Ab #14":"9.2","HC-Rag1KO+aIL-22l Ab #15":"13"},{"Metabolite":"AMP","Ab1":"82","Ab2":"57","Ab3":"56","HC-HMA-Rag1KO+Ctrl Ab #6":"75","HC-HMA-Rag1KO+Ctrl Ab #7":"89","HC-HMA-Rag1KO+Ctrl Ab #8":"76","HC-HMA-Rag1KO+Ctrl Ab #9":"69","HC-HMA-Rag1KO+Ctrl Ab #10":"60","HC-Rag1KO+Ctrl Ab #6":"46","HC-Rag1KO+Ctrl Ab #7":"62","HC-Rag1KO+Ctrl Ab #8":"62","HC-Rag1KO+Ctrl Ab #9":"60","HC-Rag1KO+Ctrl Ab #10":"67","Ab4":"56","Ab5":"72","Ab6":"55","HC-HMA-Rag1KO+aIL-22 Ab #11":"83","HC-HMA-Rag1KO+aIL-22 Ab #12":"73","HC-HMA-Rag1KO+aIL-22 Ab #13":"100","HC-HMA-Rag1KO+aIL-22 Ab #14":"102","HC-HMA-Rag1KO+aIL-22 Ab #15":"78","HC-Rag1KO+aIL-22l Ab #11":"82","HC-Rag1KO+aIL-22l Ab #12":"62","HC-Rag1KO+aIL-22l Ab #13":"65","HC-Rag1KO+aIL-22l Ab #14":"63","HC-Rag1KO+aIL-22l Ab #15":"76"},{"Metabolite":"Argininosuccinate","Ab1":"0","Ab2":"0","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"6.7","HC-HMA-Rag1KO+Ctrl Ab #7":"0","HC-HMA-Rag1KO+Ctrl Ab #8":"0","HC-HMA-Rag1KO+Ctrl Ab #9":"0","HC-HMA-Rag1KO+Ctrl Ab #10":"11","HC-Rag1KO+Ctrl Ab #6":"5.5","HC-Rag1KO+Ctrl Ab #7":"10","HC-Rag1KO+Ctrl Ab #8":"10","HC-Rag1KO+Ctrl Ab #9":"7.1","HC-Rag1KO+Ctrl Ab #10":"11","Ab4":"0","Ab5":"0","Ab6":"0","HC-HMA-Rag1KO+aIL-22 Ab #11":"16","HC-HMA-Rag1KO+aIL-22 Ab #12":"0","HC-HMA-Rag1KO+aIL-22 Ab #13":"0","HC-HMA-Rag1KO+aIL-22 Ab #14":"9.4","HC-HMA-Rag1KO+aIL-22 Ab #15":"0","HC-Rag1KO+aIL-22l Ab #11":"23","HC-Rag1KO+aIL-22l Ab #12":"8.4","HC-Rag1KO+aIL-22l Ab #13":"8.5","HC-Rag1KO+aIL-22l Ab #14":"7.0","HC-Rag1KO+aIL-22l Ab #15":"11"},{"Metabolite":"Azelate","Ab1":"63","Ab2":"77","Ab3":"51","HC-HMA-Rag1KO+Ctrl Ab #6":"70","HC-HMA-Rag1KO+Ctrl Ab #7":"83","HC-HMA-Rag1KO+Ctrl Ab #8":"75","HC-HMA-Rag1KO+Ctrl Ab #9":"86","HC-HMA-Rag1KO+Ctrl Ab #10":"78","HC-Rag1KO+Ctrl Ab #6":"64","HC-Rag1KO+Ctrl Ab #7":"90","HC-Rag1KO+Ctrl Ab #8":"81","HC-Rag1KO+Ctrl Ab #9":"84","HC-Rag1KO+Ctrl Ab #10":"57","Ab4":"72","Ab5":"58","Ab6":"65","HC-HMA-Rag1KO+aIL-22 Ab #11":"62","HC-HMA-Rag1KO+aIL-22 Ab #12":"74","HC-HMA-Rag1KO+aIL-22 Ab #13":"38","HC-HMA-Rag1KO+aIL-22 Ab #14":"89","HC-HMA-Rag1KO+aIL-22 Ab #15":"40","HC-Rag1KO+aIL-22l Ab #11":"89","HC-Rag1KO+aIL-22l Ab #12":"136","HC-Rag1KO+aIL-22l Ab #13":"140","HC-Rag1KO+aIL-22l Ab #14":"98","HC-Rag1KO+aIL-22l Ab #15":"150"},{"Metabolite":"Butyrate","Ab1":"925","Ab2":"969","Ab3":"169","HC-HMA-Rag1KO+Ctrl Ab #6":"3068","HC-HMA-Rag1KO+Ctrl Ab #7":"4604","HC-HMA-Rag1KO+Ctrl Ab #8":"4693","HC-HMA-Rag1KO+Ctrl Ab #9":"2311","HC-HMA-Rag1KO+Ctrl Ab #10":"1679","HC-Rag1KO+Ctrl Ab #6":"1735","HC-Rag1KO+Ctrl Ab #7":"2081","HC-Rag1KO+Ctrl Ab #8":"3252","HC-Rag1KO+Ctrl Ab #9":"2317","HC-Rag1KO+Ctrl Ab #10":"2263","Ab4":"1433","Ab5":"1888","Ab6":"1414","HC-HMA-Rag1KO+aIL-22 Ab #11":"5014","HC-HMA-Rag1KO+aIL-22 Ab #12":"2609","HC-HMA-Rag1KO+aIL-22 Ab #13":"2651","HC-HMA-Rag1KO+aIL-22 Ab #14":"6168","HC-HMA-Rag1KO+aIL-22 Ab #15":"4522","HC-Rag1KO+aIL-22l Ab #11":"9821","HC-Rag1KO+aIL-22l Ab #12":"4246","HC-Rag1KO+aIL-22l Ab #13":"5301","HC-Rag1KO+aIL-22l Ab #14":"6536","HC-Rag1KO+aIL-22l Ab #15":"6932"},{"Metabolite":"Cholate","Ab1":"259","Ab2":"223","Ab3":"144","HC-HMA-Rag1KO+Ctrl Ab #6":"135","HC-HMA-Rag1KO+Ctrl Ab #7":"58","HC-HMA-Rag1KO+Ctrl Ab #8":"133","HC-HMA-Rag1KO+Ctrl Ab #9":"98","HC-HMA-Rag1KO+Ctrl Ab #10":"70","HC-Rag1KO+Ctrl Ab #6":"717","HC-Rag1KO+Ctrl Ab #7":"494","HC-Rag1KO+Ctrl Ab #8":"2026","HC-Rag1KO+Ctrl Ab #9":"594","HC-Rag1KO+Ctrl Ab #10":"403","Ab4":"63","Ab5":"87","Ab6":"154","HC-HMA-Rag1KO+aIL-22 Ab #11":"119","HC-HMA-Rag1KO+aIL-22 Ab #12":"51","HC-HMA-Rag1KO+aIL-22 Ab #13":"646","HC-HMA-Rag1KO+aIL-22 Ab #14":"221","HC-HMA-Rag1KO+aIL-22 Ab #15":"92","HC-Rag1KO+aIL-22l Ab #11":"485","HC-Rag1KO+aIL-22l Ab #12":"214","HC-Rag1KO+aIL-22l Ab #13":"285","HC-Rag1KO+aIL-22l Ab #14":"242","HC-Rag1KO+aIL-22l Ab #15":"407"},{"Metabolite":"cis-Aconitate","Ab1":"0","Ab2":"0","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"2.0","HC-HMA-Rag1KO+Ctrl Ab #7":"3.3","HC-HMA-Rag1KO+Ctrl Ab #8":"2.9","HC-HMA-Rag1KO+Ctrl Ab #9":"0","HC-HMA-Rag1KO+Ctrl Ab #10":"4.8","HC-Rag1KO+Ctrl Ab #6":"0","HC-Rag1KO+Ctrl Ab #7":"46","HC-Rag1KO+Ctrl Ab #8":"60","HC-Rag1KO+Ctrl Ab #9":"7.7","HC-Rag1KO+Ctrl Ab #10":"8.9","Ab4":"0","Ab5":"0","Ab6":"0","HC-HMA-Rag1KO+aIL-22 Ab #11":"38","HC-HMA-Rag1KO+aIL-22 Ab #12":"2.3","HC-HMA-Rag1KO+aIL-22 Ab #13":"2.2","HC-HMA-Rag1KO+aIL-22 Ab #14":"2.6","HC-HMA-Rag1KO+aIL-22 Ab #15":"6.1","HC-Rag1KO+aIL-22l Ab #11":"198","HC-Rag1KO+aIL-22l Ab #12":"0","HC-Rag1KO+aIL-22l Ab #13":"0","HC-Rag1KO+aIL-22l Ab #14":"0","HC-Rag1KO+aIL-22l Ab #15":"0"},{"Metabolite":"Citraconate","Ab1":"4.5","Ab2":"3.9","Ab3":"6.0","HC-HMA-Rag1KO+Ctrl Ab #6":"3.5","HC-HMA-Rag1KO+Ctrl Ab #7":"3.7","HC-HMA-Rag1KO+Ctrl Ab #8":"4.2","HC-HMA-Rag1KO+Ctrl Ab #9":"5.1","HC-HMA-Rag1KO+Ctrl Ab #10":"9.6","HC-Rag1KO+Ctrl Ab #6":"3.7","HC-Rag1KO+Ctrl Ab #7":"8.3","HC-Rag1KO+Ctrl Ab #8":"5.5","HC-Rag1KO+Ctrl Ab #9":"7.7","HC-Rag1KO+Ctrl Ab #10":"3.3","Ab4":"6.9","Ab5":"3.8","Ab6":"5.2","HC-HMA-Rag1KO+aIL-22 Ab #11":"6.3","HC-HMA-Rag1KO+aIL-22 Ab #12":"3.7","HC-HMA-Rag1KO+aIL-22 Ab #13":"3.2","HC-HMA-Rag1KO+aIL-22 Ab #14":"7.0","HC-HMA-Rag1KO+aIL-22 Ab #15":"4.8","HC-Rag1KO+aIL-22l Ab #11":"21","HC-Rag1KO+aIL-22l Ab #12":"4.7","HC-Rag1KO+aIL-22l Ab #13":"3.7","HC-Rag1KO+aIL-22l Ab #14":"1.8","HC-Rag1KO+aIL-22l Ab #15":"3.6"},{"Metabolite":"Citramalate","Ab1":"14","Ab2":"12","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"14","HC-HMA-Rag1KO+Ctrl Ab #7":"14","HC-HMA-Rag1KO+Ctrl Ab #8":"13","HC-HMA-Rag1KO+Ctrl Ab #9":"23","HC-HMA-Rag1KO+Ctrl Ab #10":"23","HC-Rag1KO+Ctrl Ab #6":"36","HC-Rag1KO+Ctrl Ab #7":"63","HC-Rag1KO+Ctrl Ab #8":"53","HC-Rag1KO+Ctrl Ab #9":"57","HC-Rag1KO+Ctrl Ab #10":"16","Ab4":"20","Ab5":"14","Ab6":"23","HC-HMA-Rag1KO+aIL-22 Ab #11":"19","HC-HMA-Rag1KO+aIL-22 Ab 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#7":"101","HC-Rag1KO+Ctrl Ab #8":"57","HC-Rag1KO+Ctrl Ab #9":"50","HC-Rag1KO+Ctrl Ab #10":"48","Ab4":"22","Ab5":"32","Ab6":"36","HC-HMA-Rag1KO+aIL-22 Ab #11":"49","HC-HMA-Rag1KO+aIL-22 Ab #12":"30","HC-HMA-Rag1KO+aIL-22 Ab #13":"30","HC-HMA-Rag1KO+aIL-22 Ab #14":"38","HC-HMA-Rag1KO+aIL-22 Ab #15":"33","HC-Rag1KO+aIL-22l Ab #11":"23","HC-Rag1KO+aIL-22l Ab #12":"82","HC-Rag1KO+aIL-22l Ab #13":"26","HC-Rag1KO+aIL-22l Ab #14":"32","HC-Rag1KO+aIL-22l Ab #15":"32"},{"Metabolite":"2,5-Dihydroxybenzoate","Ab1":"15","Ab2":"34","Ab3":"17","HC-HMA-Rag1KO+Ctrl Ab #6":"28","HC-HMA-Rag1KO+Ctrl Ab #7":"30","HC-HMA-Rag1KO+Ctrl Ab #8":"29","HC-HMA-Rag1KO+Ctrl Ab #9":"32","HC-HMA-Rag1KO+Ctrl Ab #10":"23","HC-Rag1KO+Ctrl Ab #6":"18","HC-Rag1KO+Ctrl Ab #7":"40","HC-Rag1KO+Ctrl Ab #8":"29","HC-Rag1KO+Ctrl Ab #9":"22","HC-Rag1KO+Ctrl Ab #10":"19","Ab4":"0","Ab5":"14","Ab6":"31","HC-HMA-Rag1KO+aIL-22 Ab #11":"22","HC-HMA-Rag1KO+aIL-22 Ab #12":"19","HC-HMA-Rag1KO+aIL-22 Ab #13":"15","HC-HMA-Rag1KO+aIL-22 Ab #14":"38","HC-HMA-Rag1KO+aIL-22 Ab #15":"24","HC-Rag1KO+aIL-22l Ab #11":"53","HC-Rag1KO+aIL-22l Ab #12":"48","HC-Rag1KO+aIL-22l Ab #13":"26","HC-Rag1KO+aIL-22l Ab #14":"33","HC-Rag1KO+aIL-22l Ab #15":"52"},{"Metabolite":"2-Hydroxybutyrate","Ab1":"0","Ab2":"0","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"11","HC-HMA-Rag1KO+Ctrl Ab #7":"0","HC-HMA-Rag1KO+Ctrl Ab #8":"0","HC-HMA-Rag1KO+Ctrl Ab #9":"0","HC-HMA-Rag1KO+Ctrl Ab #10":"23","HC-Rag1KO+Ctrl Ab #6":"0","HC-Rag1KO+Ctrl Ab #7":"12","HC-Rag1KO+Ctrl Ab #8":"0","HC-Rag1KO+Ctrl Ab #9":"35","HC-Rag1KO+Ctrl Ab #10":"0","Ab4":"0","Ab5":"0","Ab6":"0","HC-HMA-Rag1KO+aIL-22 Ab #11":"13","HC-HMA-Rag1KO+aIL-22 Ab #12":"7.8","HC-HMA-Rag1KO+aIL-22 Ab #13":"12","HC-HMA-Rag1KO+aIL-22 Ab #14":"28","HC-HMA-Rag1KO+aIL-22 Ab #15":"16","HC-Rag1KO+aIL-22l Ab #11":"35","HC-Rag1KO+aIL-22l Ab #12":"34","HC-Rag1KO+aIL-22l Ab #13":"29","HC-Rag1KO+aIL-22l Ab #14":"0","HC-Rag1KO+aIL-22l Ab #15":"28"},{"Metabolite":"2-Hydroxyglutarate","Ab1":"207","Ab2":"167","Ab3":"239","HC-HMA-Rag1KO+Ctrl Ab #6":"111","HC-HMA-Rag1KO+Ctrl Ab #7":"151","HC-HMA-Rag1KO+Ctrl Ab #8":"122","HC-HMA-Rag1KO+Ctrl Ab #9":"128","HC-HMA-Rag1KO+Ctrl Ab #10":"152","HC-Rag1KO+Ctrl Ab #6":"200","HC-Rag1KO+Ctrl Ab #7":"396","HC-Rag1KO+Ctrl Ab #8":"569","HC-Rag1KO+Ctrl Ab #9":"128","HC-Rag1KO+Ctrl Ab #10":"241","Ab4":"142","Ab5":"122","Ab6":"165","HC-HMA-Rag1KO+aIL-22 Ab #11":"247","HC-HMA-Rag1KO+aIL-22 Ab #12":"82","HC-HMA-Rag1KO+aIL-22 Ab #13":"68","HC-HMA-Rag1KO+aIL-22 Ab #14":"104","HC-HMA-Rag1KO+aIL-22 Ab #15":"62","HC-Rag1KO+aIL-22l Ab #11":"1461","HC-Rag1KO+aIL-22l Ab #12":"291","HC-Rag1KO+aIL-22l Ab #13":"176","HC-Rag1KO+aIL-22l Ab #14":"209","HC-Rag1KO+aIL-22l Ab #15":"176"},{"Metabolite":"2-Isopropylmalate","Ab1":"0","Ab2":"0","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"3.6","HC-HMA-Rag1KO+Ctrl Ab #7":"2.5","HC-HMA-Rag1KO+Ctrl Ab #8":"4.8","HC-HMA-Rag1KO+Ctrl Ab #9":"3.3","HC-HMA-Rag1KO+Ctrl Ab 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#14":"1384","HC-Rag1KO+aIL-22l Ab #15":"2235"},{"Metabolite":"3-Methylbutanoate","Ab1":"176","Ab2":"168","Ab3":"38","HC-HMA-Rag1KO+Ctrl Ab #6":"151","HC-HMA-Rag1KO+Ctrl Ab #7":"281","HC-HMA-Rag1KO+Ctrl Ab #8":"178","HC-HMA-Rag1KO+Ctrl Ab #9":"84","HC-HMA-Rag1KO+Ctrl Ab #10":"78","HC-Rag1KO+Ctrl Ab #6":"116","HC-Rag1KO+Ctrl Ab #7":"139","HC-Rag1KO+Ctrl Ab #8":"210","HC-Rag1KO+Ctrl Ab #9":"135","HC-Rag1KO+Ctrl Ab #10":"196","Ab4":"185","Ab5":"306","Ab6":"86","HC-HMA-Rag1KO+aIL-22 Ab #11":"208","HC-HMA-Rag1KO+aIL-22 Ab #12":"235","HC-HMA-Rag1KO+aIL-22 Ab #13":"111","HC-HMA-Rag1KO+aIL-22 Ab #14":"185","HC-HMA-Rag1KO+aIL-22 Ab #15":"101","HC-Rag1KO+aIL-22l Ab #11":"284","HC-Rag1KO+aIL-22l Ab #12":"174","HC-Rag1KO+aIL-22l Ab #13":"161","HC-Rag1KO+aIL-22l Ab #14":"158","HC-Rag1KO+aIL-22l Ab #15":"129"},{"Metabolite":"3PG","Ab1":"78","Ab2":"83","Ab3":"155","HC-HMA-Rag1KO+Ctrl Ab #6":"18","HC-HMA-Rag1KO+Ctrl Ab #7":"19","HC-HMA-Rag1KO+Ctrl Ab #8":"18","HC-HMA-Rag1KO+Ctrl Ab #9":"13","HC-HMA-Rag1KO+Ctrl Ab #10":"27","HC-Rag1KO+Ctrl Ab #6":"18","HC-Rag1KO+Ctrl Ab #7":"45","HC-Rag1KO+Ctrl Ab #8":"18","HC-Rag1KO+Ctrl Ab #9":"12","HC-Rag1KO+Ctrl Ab #10":"27","Ab4":"45","Ab5":"48","Ab6":"42","HC-HMA-Rag1KO+aIL-22 Ab #11":"13","HC-HMA-Rag1KO+aIL-22 Ab #12":"12","HC-HMA-Rag1KO+aIL-22 Ab #13":"8.0","HC-HMA-Rag1KO+aIL-22 Ab #14":"24","HC-HMA-Rag1KO+aIL-22 Ab #15":"19","HC-Rag1KO+aIL-22l Ab #11":"26","HC-Rag1KO+aIL-22l Ab #12":"57","HC-Rag1KO+aIL-22l Ab #13":"34","HC-Rag1KO+aIL-22l Ab #14":"41","HC-Rag1KO+aIL-22l Ab #15":"33"},{"Metabolite":"3-Ureidopropionate","Ab1":"0","Ab2":"0","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"0","HC-HMA-Rag1KO+Ctrl Ab #7":"0","HC-HMA-Rag1KO+Ctrl Ab #8":"0","HC-HMA-Rag1KO+Ctrl Ab #9":"0","HC-HMA-Rag1KO+Ctrl Ab #10":"0","HC-Rag1KO+Ctrl Ab #6":"0","HC-Rag1KO+Ctrl Ab #7":"177","HC-Rag1KO+Ctrl Ab #8":"147","HC-Rag1KO+Ctrl Ab #9":"0","HC-Rag1KO+Ctrl Ab #10":"0","Ab4":"0","Ab5":"0","Ab6":"0","HC-HMA-Rag1KO+aIL-22 Ab #11":"39","HC-HMA-Rag1KO+aIL-22 Ab #12":"0","HC-HMA-Rag1KO+aIL-22 Ab #13":"0","HC-HMA-Rag1KO+aIL-22 Ab #14":"0","HC-HMA-Rag1KO+aIL-22 Ab #15":"0","HC-Rag1KO+aIL-22l Ab #11":"408","HC-Rag1KO+aIL-22l Ab #12":"0","HC-Rag1KO+aIL-22l Ab #13":"0","HC-Rag1KO+aIL-22l Ab #14":"0","HC-Rag1KO+aIL-22l Ab #15":"0"},{"Metabolite":"4-Acetylbutyrate","Ab1":"0","Ab2":"0","Ab3":"0","HC-HMA-Rag1KO+Ctrl Ab #6":"9.5","HC-HMA-Rag1KO+Ctrl Ab #7":"8.7","HC-HMA-Rag1KO+Ctrl Ab #8":"9.7","HC-HMA-Rag1KO+Ctrl Ab #9":"7.9","HC-HMA-Rag1KO+Ctrl Ab #10":"7.7","HC-Rag1KO+Ctrl Ab #6":"19","HC-Rag1KO+Ctrl Ab #7":"13","HC-Rag1KO+Ctrl Ab #8":"14","HC-Rag1KO+Ctrl Ab #9":"0","HC-Rag1KO+Ctrl Ab #10":"17","Ab4":"0","Ab5":"0","Ab6":"0","HC-HMA-Rag1KO+aIL-22 Ab #11":"8.5","HC-HMA-Rag1KO+aIL-22 Ab #12":"8.6","HC-HMA-Rag1KO+aIL-22 Ab #13":"7.7","HC-HMA-Rag1KO+aIL-22 Ab #14":"13","HC-HMA-Rag1KO+aIL-22 Ab #15":"8.1","HC-Rag1KO+aIL-22l Ab #11":"17","HC-Rag1KO+aIL-22l Ab #12":"0","HC-Rag1KO+aIL-22l Ab #13":"14","HC-Rag1KO+aIL-22l Ab #14":"9.5","HC-Rag1KO+aIL-22l Ab #15":"0"},{"Metabolite":"5-Oxoproline","Ab1":"80","Ab2":"98","Ab3":"73","HC-HMA-Rag1KO+Ctrl Ab #6":"64","HC-HMA-Rag1KO+Ctrl Ab #7":"76","HC-HMA-Rag1KO+Ctrl Ab #8":"60","HC-HMA-Rag1KO+Ctrl Ab #9":"59","HC-HMA-Rag1KO+Ctrl Ab #10":"59","HC-Rag1KO+Ctrl Ab #6":"31","HC-Rag1KO+Ctrl Ab #7":"45","HC-Rag1KO+Ctrl Ab #8":"41","HC-Rag1KO+Ctrl Ab #9":"63","HC-Rag1KO+Ctrl Ab #10":"159","Ab4":"82","Ab5":"80","Ab6":"65","HC-HMA-Rag1KO+aIL-22 Ab #11":"66","HC-HMA-Rag1KO+aIL-22 Ab #12":"55","HC-HMA-Rag1KO+aIL-22 Ab #13":"63","HC-HMA-Rag1KO+aIL-22 Ab #14":"57","HC-HMA-Rag1KO+aIL-22 Ab #15":"53","HC-Rag1KO+aIL-22l Ab #11":"100","HC-Rag1KO+aIL-22l Ab #12":"56","HC-Rag1KO+aIL-22l Ab #13":"44","HC-Rag1KO+aIL-22l Ab #14":"64","HC-Rag1KO+aIL-22l Ab #15":"48"}],

"Metabolites":[{"Metabolite":"Acetyl CoA","RefMet name":"Acetyl-CoA","Formula":"C23H38N7O17P3S","Mass":"809.1258","REGNO":"50043","KEGG ID":"C00024","quantitated m/z":"403.5573678","retention times":"13.87707687"},{"Metabolite":"Adipate","RefMet name":"Adipic acid","Formula":"C6H10O4","Mass":"146.0579","REGNO":"1970","KEGG ID":"C06104","quantitated m/z":"145.0520342","retention times":"11.36085954"},{"Metabolite":"ADP-ribose","RefMet name":"ADP-ribose","Formula":"C15H23N5O14P2","Mass":"559.0717","REGNO":"50719","KEGG ID":"C00301","quantitated m/z":"558.0648944","retention times":"16.35694961"},{"Metabolite":"AMP","RefMet name":"AMP","Formula":"C10H14N5O7P","Mass":"347.0631","REGNO":"37043","KEGG ID":"C00020","quantitated m/z":"346.056478","retention times":"15.01315423"},{"Metabolite":"Argininosuccinate","RefMet name":"Argininosuccinic acid","Formula":"C10H18N4O6","Mass":"290.1226","REGNO":"37046","KEGG ID":"C03406","quantitated m/z":"291.1303056","retention times":"13.58560369"},{"Metabolite":"Azelate","RefMet name":"Azelaic acid","Formula":"C9H16O4","Mass":"188.1049","REGNO":"1976","KEGG ID":"C08261","quantitated m/z":"187.0984972","retention times":"12.53259786"},{"Metabolite":"Butyrate","RefMet name":"Butyric acid","Formula":"C4H8O2","Mass":"88.0524","REGNO":"26","KEGG ID":"C00246","quantitated m/z":"87.0469993","retention times":"14.32069685"},{"Metabolite":"Cholate","RefMet name":"Cholic acid","Formula":"C24H40O5","Mass":"408.2876","REGNO":"36243","KEGG ID":"C00695","quantitated m/z":"407.2812254","retention times":"22.54752285"},{"Metabolite":"cis-Aconitate","RefMet name":"cis-Aconitic acid","Formula":"C6H6O6","Mass":"174.0164","REGNO":"37059","KEGG ID":"C00417","quantitated m/z":"173.0100147","retention times":"9.537733373"},{"Metabolite":"Citraconate","RefMet name":"Citraconic acid","Formula":"C5H6O4","Mass":"130.0266","REGNO":"2018","KEGG ID":"C02226","quantitated m/z":"129.0203792","retention times":"10.76587109"},{"Metabolite":"Citramalate","RefMet name":"Citramalic acid","Formula":"C5H8O5","Mass":"148.0372","REGNO":"51926","KEGG ID":"C02614","quantitated m/z":"147.0310314","retention times":"10.70301385"},{"Metabolite":"Citrate","RefMet name":"Citric acid","Formula":"C6H8O7","Mass":"192.027","REGNO":"37071","KEGG ID":"C00158","quantitated m/z":"191.0206168","retention times":"9.694615102"},{"Metabolite":"CMP","RefMet name":"CMP","Formula":"C9H14N3O8P","Mass":"323.0519","REGNO":"37072","KEGG ID":"C00055","quantitated m/z":"322.0459069","retention times":"14.60144333"},{"Metabolite":"Cysteate","RefMet name":"Cysteic acid","Formula":"C3H7NO5S","Mass":"169.0045","REGNO":"49870","KEGG ID":"C00506","quantitated m/z":"167.9981728","retention times":"12.91908212"},{"Metabolite":"DCA","RefMet name":"Deoxycholic acid","Formula":"C24H40O4","Mass":"392.2927","REGNO":"36282","KEGG ID":"C04483","quantitated m/z":"391.2865339","retention times":"24.10437947"},{"Metabolite":"Dodecanedioate","RefMet name":"Dodecanedioic acid","Formula":"C12H22O4","Mass":"230.1518","REGNO":"1933","KEGG ID":"C02678","quantitated m/z":"229.1456585","retention times":"13.54712723"},{"Metabolite":"dTMP","RefMet name":"dTMP","Formula":"C10H15N2O8P","Mass":"322.0566","REGNO":"37671","KEGG ID":"C00364","quantitated m/z":"321.0496451","retention times":"14.63410888"},{"Metabolite":"F6P","RefMet name":"Fructose 6-phosphate","Formula":"C6H13O9P","Mass":"260.029719","REGNO":"38436","KEGG ID":"C00085","quantitated m/z":"259.0230457","retention times":"14.16853552"},{"Metabolite":"Fumarate","RefMet name":"Fumaric acid","Formula":"C4H4O4","Mass":"116.011","REGNO":"37095","KEGG ID":"C00122","quantitated m/z":"115.0051686","retention times":"9.720723364"},{"Metabolite":"G1P","RefMet name":"Glucose 1-phosphate","Formula":"C6H13O9P","Mass":"260.0297","REGNO":"49864","KEGG ID":"C00103","quantitated m/z":"259.0226418","retention times":"13.99673009"},{"Metabolite":"G6P","RefMet name":"Glucose 6-phosphate","Formula":"C6H13O9P","Mass":"260.0297","REGNO":"37776","KEGG ID":"C00092","quantitated m/z":"259.0232401","retention times":"14.28433351"},{"Metabolite":"Glutarate","RefMet name":"Glutaric acid","Formula":"C5H8O4","Mass":"132.0423","REGNO":"37356","KEGG ID":"C00489","quantitated m/z":"131.0361122","retention times":"10.80346491"},{"Metabolite":"Glycerate","RefMet name":"Glyceric acid","Formula":"C3H6O4","Mass":"106.0266","REGNO":"37097","KEGG ID":"C00258","quantitated m/z":"105.0202164","retention times":"13.76586422"},{"Metabolite":"Glycolate","RefMet name":"Glycolic acid","Formula":"C2H4O3","Mass":"76.016","REGNO":"37080","KEGG ID":"C00160","quantitated m/z":"75.01102306","retention times":"12.20242449"},{"Metabolite":"Isethionate","RefMet name":"2-Hydroxyethanesulfonate","Formula":"C2H6O4S","Mass":"125.9987","REGNO":"38409","KEGG ID":"C05123","quantitated m/z":"124.9930287","retention times":"12.75468103"},{"Metabolite":"Isocitrate","RefMet name":"Isocitric acid","Formula":"C6H8O7","Mass":"192.027","REGNO":"37902","KEGG ID":"C00311","quantitated m/z":"191.0203597","retention times":"9.496975539"},{"Metabolite":"Lactate","RefMet name":"Lactic acid","Formula":"C3H6O3","Mass":"90.0317","REGNO":"37125","KEGG ID":"C00186","quantitated m/z":"89.02599458","retention times":"13.44158088"},{"Metabolite":"Malate","RefMet name":"Malic acid","Formula":"C4H6O5","Mass":"134.0215","REGNO":"37105","KEGG ID":"C00711","quantitated m/z":"133.0155257","retention times":"10.09239897"},{"Metabolite":"Malonate","RefMet name":"Malonic acid","Formula":"C3H4O4","Mass":"104.011","REGNO":"1964","KEGG ID":"C00383","quantitated m/z":"103.0049726","retention times":"9.32385843"},{"Metabolite":"N-Acetylaspartate","RefMet name":"N-Acetylaspartic acid","Formula":"C6H9NO5","Mass":"175.0481","REGNO":"37441","KEGG ID":"C01042","quantitated m/z":"174.0419153","retention times":"11.4276219"},{"Metabolite":"N-Acetylglucosamine 1-phosphate","RefMet name":"N-Acetyl-D-glucosamine-1-phosphate","Formula":"C8H16NO9P","Mass":"301.0563","REGNO":"37754","KEGG ID":"C04501","quantitated m/z":"300.0496328","retention times":"14.66588763"},{"Metabolite":"N-Acetylglucosamine 6-phosphate","RefMet name":"N-Acetylglucosamine 6-phosphate","Formula":"C8H16NO9P","Mass":"301.0563","REGNO":"38205","KEGG ID":"C00357","quantitated m/z":"300.0497025","retention times":"15.18363215"},{"Metabolite":"N-Acetylglutamate","RefMet name":"N-Acetylglutamic acid","Formula":"C7H11NO5","Mass":"189.0637","REGNO":"49869","KEGG ID":"C00624","quantitated m/z":"188.0573847","retention times":"11.96163698"},{"Metabolite":"NAD+","RefMet name":"NAD+","Formula":"C21H28N7O14P2","Mass":"664.117","REGNO":"71883","KEGG ID":"C00003","quantitated m/z":"662.1034901","retention times":"23.95930382"},{"Metabolite":"NADP+","RefMet name":"NADP+","Formula":"C21H29N7O17P3","Mass":"744.0833","REGNO":"67508","KEGG ID":"C00006","quantitated m/z":"742.0709082","retention times":"14.84386311"},{"Metabolite":"Nicotinate","RefMet name":"Nicotinic acid","Formula":"C6H5NO2","Mass":"123.032","REGNO":"37821","KEGG ID":"C00253","quantitated m/z":"122.0259198","retention times":"14.28713464"},{"Metabolite":"O-Phosphoserine","RefMet name":"Phosphoserine","Formula":"C3H8NO6P","Mass":"185.0089","REGNO":"37174","KEGG ID":"C01005","quantitated m/z":"184.0034299","retention times":"12.39345642"},{"Metabolite":"Pentanoate","RefMet name":"Valeric acid","Formula":"C5H10O2","Mass":"102.0681","REGNO":"27","KEGG ID":"C00803","quantitated m/z":"101.06225","retention times":"15.07339055"},{"Metabolite":"Phenaceturate","RefMet name":"","Formula":"","Mass":"","REGNO":"","KEGG ID":"C05598","quantitated m/z":"192.0664673","retention times":"17.04654216"},{"Metabolite":"Phthalate","RefMet name":"Phthalic acid","Formula":"C8H6O4","Mass":"166.0266","REGNO":"38024","KEGG ID":"C01606","quantitated m/z":"165.0204059","retention times":"11.22107407"},{"Metabolite":"Pimelate","RefMet name":"Pimelic acid","Formula":"C7H12O4","Mass":"160.0736","REGNO":"1973","KEGG ID":"C02656","quantitated m/z":"159.0670603","retention times":"11.78089078"},{"Metabolite":"Proline betaine","RefMet name":"Proline betaine","Formula":"C7H13NO2","Mass":"143.0946","REGNO":"38560","KEGG ID":"C10172","quantitated m/z":"144.1016974","retention times":"16.51927334"},{"Metabolite":"Propionate","RefMet name":"Propionic acid","Formula":"C3H6O2","Mass":"74.0368","REGNO":"25","KEGG ID":"C00163","quantitated m/z":"73.03149049","retention times":"13.29949225"},{"Metabolite":"Ru5P","RefMet name":"","Formula":"","Mass":"","REGNO":"","KEGG ID":"C00199","quantitated m/z":"229.0119685","retention times":"13.23072262"},{"Metabolite":"S7P","RefMet name":"Sedoheptulose 7-phosphate","Formula":"C7H15O10P","Mass":"290.0403","REGNO":"50236","KEGG ID":"C05382","quantitated m/z":"289.0330251","retention times":"14.56027953"},{"Metabolite":"Sebacate","RefMet name":"Sebacic acid","Formula":"C10H18O4","Mass":"202.1205","REGNO":"1930","KEGG ID":"C08277","quantitated m/z":"201.1143264","retention times":"12.86792141"},{"Metabolite":"Succinate","RefMet name":"Succinic acid","Formula":"C4H6O4","Mass":"118.0266","REGNO":"1966","KEGG ID":"C00042","quantitated m/z":"117.0209658","retention times":"10.14818667"},{"Metabolite":"Taurocholate","RefMet name":"Taurocholic acid","Formula":"C26H45NO7S","Mass":"515.2917","REGNO":"36987","KEGG ID":"C05122","quantitated m/z":"514.2856725","retention times":"23.35428038"},{"Metabolite":"UDP","RefMet name":"UDP","Formula":"C9H14N2O12P2","Mass":"404.0022","REGNO":"37189","KEGG ID":"C00015","quantitated m/z":"402.9958618","retention times":"12.7430185"},{"Metabolite":"UMP","RefMet name":"UMP","Formula":"C9H13N2O9P","Mass":"324.0359","REGNO":"37182","KEGG ID":"C00105","quantitated m/z":"323.0293251","retention times":"14.31016999"},{"Metabolite":"Urate","RefMet name":"Uric acid","Formula":"C5H4N4O3","Mass":"168.0283","REGNO":"37183","KEGG ID":"C00366","quantitated m/z":"167.0232932","retention times":"15.59530285"},{"Metabolite":"2,5-Dihydroxybenzoate","RefMet name":"Gentisic acid","Formula":"C7H6O4","Mass":"154.0266","REGNO":"37104","KEGG ID":"C00628","quantitated m/z":"153.0214093","retention times":"14.72108276"},{"Metabolite":"2-Hydroxybutyrate","RefMet name":"2-Hydroxybutyric acid","Formula":"C4H8O3","Mass":"104.0473","REGNO":"1281","KEGG ID":"C05984","quantitated m/z":"103.0411171","retention times":"14.43055988"},{"Metabolite":"2-Hydroxyglutarate","RefMet name":"2-Hydroxyglutaric acid","Formula":"C5H8O5","Mass":"148.0372","REGNO":"37369","KEGG ID":"C02630","quantitated m/z":"147.0310518","retention times":"10.78880146"},{"Metabolite":"2-Isopropylmalate","RefMet name":"2-Isopropylmalic acid","Formula":"C7H12O5","Mass":"176.0685","REGNO":"2004","KEGG ID":"C02504","quantitated m/z":"175.0622608","retention times":"11.74313043"},{"Metabolite":"2-Oxoglutarate","RefMet name":"Oxoglutaric acid","Formula":"C5H6O5","Mass":"146.0215","REGNO":"37135","KEGG ID":"C00026","quantitated m/z":"145.0147602","retention times":"10.06297298"},{"Metabolite":"3-(4-Hydroxyphenyl)propionate","RefMet name":"","Formula":"","Mass":"","REGNO":"","KEGG ID":"C01744","quantitated m/z":"165.0570416","retention times":"16.66050822"},{"Metabolite":"3-Methylbutanoate","RefMet name":"Isovaleric acid","Formula":"C5H10O2","Mass":"102.0681","REGNO":"246","KEGG ID":"C08262","quantitated m/z":"101.0622534","retention times":"15.20819689"},{"Metabolite":"3PG","RefMet name":"3-Phosphoglyceric acid","Formula":"C3H7O7P","Mass":"185.9929","REGNO":"51044","KEGG ID":"C00197","quantitated m/z":"184.9865865","retention times":"10.30173029"},{"Metabolite":"3-Ureidopropionate","RefMet name":"Ureidopropionic acid","Formula":"C4H8N2O3","Mass":"132.0535","REGNO":"37033","KEGG ID":"C02642","quantitated m/z":"131.0470753","retention times":"15.07533894"},{"Metabolite":"4-Acetylbutyrate","RefMet name":"","Formula":"","Mass":"","REGNO":"","KEGG ID":"C02129","quantitated m/z":"129.0561873","retention times":"15.34222733"},{"Metabolite":"5-Oxoproline","RefMet name":"Pyroglutamic acid","Formula":"C5H7NO3","Mass":"129.0426","REGNO":"37171","KEGG ID":"C01879","quantitated m/z":"128.0363403","retention times":"14.75489031"}]
}

}