{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST002213","ANALYSIS_ID":"AN003620","VERSION":"1","CREATED_ON":"July 8, 2022, 5:01 pm"},

"PROJECT":{"PROJECT_TITLE":"Metabolic changes in Alzheimer patient-derived induced neurons and the effects of PKM2 modulation and hypoxia on their metabolic landscape","PROJECT_SUMMARY":"We have obtained fibroblast cultures from old adult human non-demented control donors and Alzheimer patients (AD). The fibroblasts were reprogrammed into directly induced neurons (iNs) to serve as an adult-like and age-equivalent model for aging and neurodegeneration. Metabolomic landscape and glucose flux in control versus AD were assessed. Additionally, their response to PKM2 modulation (shikonin 10 µM or PKM2 overexpression) and hypoxia (CoDo treatment) were assessed.","INSTITUTE":"University of Colorado Denver","LABORATORY":"Lab of Angelo D'Alessandro in collaboration with lab of Jerome Mertens (Univ of Innsbruck)","LAST_NAME":"Haines","FIRST_NAME":"Julie","ADDRESS":"12801 E 17th Ave, Room 1303, Aurora, Colorado, 80045, USA","EMAIL":"julie.haines@cuanschutz.edu","PHONE":"3037243339"},

"STUDY":{"STUDY_TITLE":"Metabolic changes in Alzheimer patient-derived induced neurons and the effects of PKM2 modulation and hypoxia on their metabolic landscape","STUDY_SUMMARY":"We have obtained fibroblast cultures from old adult human non-demented control donors and Alzheimer patients (AD). The fibroblasts were reprogrammed into directly induced neurons (iNs) to serve as an adult-like and age-equivalent model for aging and neurodegeneration. Metabolomic landscape and glucose flux in control versus AD were assessed. Additionally, their response to PKM2 modulation (shikonin 10 µM or PKM2 overexpression) and hypoxia (CoDo treatment) were assessed.","INSTITUTE":"University of Colorado Denver","LAST_NAME":"Haines","FIRST_NAME":"Julie","ADDRESS":"12801 E 17th Ave, Room 1303, Aurora, Colorado, 80045, USA","EMAIL":"julie.haines@cuanschutz.edu","PHONE":"3037243339"},

"SUBJECT":{"SUBJECT_TYPE":"Human","SUBJECT_SPECIES":"Homo sapiens","TAXONOMY_ID":"9606","AGE_OR_AGE_RANGE":"50-90 yrs"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"Control3",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"3"}
},
{
"Subject ID":"-",
"Sample ID":"AD6",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"6"}
},
{
"Subject ID":"-",
"Sample ID":"AD7",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"7"}
},
{
"Subject ID":"-",
"Sample ID":"Control9",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"9"}
},
{
"Subject ID":"-",
"Sample ID":"AD2",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"10"}
},
{
"Subject ID":"-",
"Sample ID":"Control2",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"11"}
},
{
"Subject ID":"-",
"Sample ID":"AD8",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"14"}
},
{
"Subject ID":"-",
"Sample ID":"Control10",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"15"}
},
{
"Subject ID":"-",
"Sample ID":"AD11",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"17"}
},
{
"Subject ID":"-",
"Sample ID":"Control11",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"18"}
},
{
"Subject ID":"-",
"Sample ID":"AD10",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"19"}
},
{
"Subject ID":"-",
"Sample ID":"AD1",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"20"}
},
{
"Subject ID":"-",
"Sample ID":"Control7",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"22"}
},
{
"Subject ID":"-",
"Sample ID":"AD3",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"23"}
},
{
"Subject ID":"-",
"Sample ID":"Control8",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"24"}
},
{
"Subject ID":"-",
"Sample ID":"AD5",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"25"}
},
{
"Subject ID":"-",
"Sample ID":"Control6",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"27"}
},
{
"Subject ID":"-",
"Sample ID":"Control4",
"Factors":{"Condition":"Non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"29"}
},
{
"Subject ID":"-",
"Sample ID":"Control8 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"31"}
},
{
"Subject ID":"-",
"Sample ID":"Control6 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"32"}
},
{
"Subject ID":"-",
"Sample ID":"AD6 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"33"}
},
{
"Subject ID":"-",
"Sample ID":"AD3 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"35"}
},
{
"Subject ID":"-",
"Sample ID":"AD7 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"36"}
},
{
"Subject ID":"-",
"Sample ID":"Control9 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"38"}
},
{
"Subject ID":"-",
"Sample ID":"AD2 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"39"}
},
{
"Subject ID":"-",
"Sample ID":"Control2 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"40"}
},
{
"Subject ID":"-",
"Sample ID":"Control10 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"44"}
},
{
"Subject ID":"-",
"Sample ID":"AD11 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"46"}
},
{
"Subject ID":"-",
"Sample ID":"Control11 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"47"}
},
{
"Subject ID":"-",
"Sample ID":"AD10 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"48"}
},
{
"Subject ID":"-",
"Sample ID":"AD1 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"49"}
},
{
"Subject ID":"-",
"Sample ID":"Control7 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"51"}
},
{
"Subject ID":"-",
"Sample ID":"AD5 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"52"}
},
{
"Subject ID":"-",
"Sample ID":"AD8 media",
"Factors":{"Condition":"Alzheimer patient"},
"Additional sample data":{"RAW_FILE_NAME":"53"}
},
{
"Subject ID":"-",
"Sample ID":"Control4 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"55"}
},
{
"Subject ID":"-",
"Sample ID":"Control3 media",
"Factors":{"Condition":"non-demented control"},
"Additional sample data":{"RAW_FILE_NAME":"56"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"For Metabolome, iNs were flow cytometry-isolated 21 days of conversion. iNs were sorted based on the expression of the PSA-NCAM surface markers using PSA-NCAM-PE (Miltenyi) and re-plated on Geltrex-coated wells. The following day, iNs were treated with 2.5 mM DGlucose-C13 for 6 hours and harvested using Tryple. Supernatant and cell pellets were shock frozen in liquid nitrogen.","SAMPLE_TYPE":"Biopsy"},

"TREATMENT":{"TREATMENT_SUMMARY":"After two weeks of conversion, cells were treated for 10 days with shikonin (10 µM, ChemCruz) before FACS sorting. Control iNs were FACS-sorted and plated on Geltrex-coated wells before transduction with pLVXTP-EGFP-PKM2 or pLVXTP-EGFP. Around 60 % of all neurons were successfully transduced. Five days after transduction, iNs were harvested for MS-analysis. Alternatively, cells were treated with CoDo for 6 hours before harvest."},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"Metabolites from frozen cell pellets were extracted at 1e6 cells/mL in cold 5:3:2 MeOH:acetonitrile:water. Metabolites from supernatant samples (10 uL) were extracted with 240 uL of the above extraction solution. Samples were vortexed 30 min at 4 degrees C then supernatants clarified by centrifugation (10 min, 10,000 g, 4 degrees C)."},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_SUMMARY":"Negative C18 media","CHROMATOGRAPHY_TYPE":"Reversed phase","INSTRUMENT_NAME":"Thermo Vanquish","COLUMN_NAME":"Phenomenex kinetex C18 2.1 x 150 mm, 1.7 um"},

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

"MS":{"INSTRUMENT_NAME":"Thermo Q Exactive Orbitrap","INSTRUMENT_TYPE":"Orbitrap","MS_TYPE":"ESI","ION_MODE":"NEGATIVE","MS_COMMENTS":"Resolution 70,000, scan range 65-900 m/z, maximum injection time 200 ms, microscans 2, automatic gain control (AGC) 3 x 10^6 ions, source voltage 4.0 kV, capillary temperature 320 C, and sheath gas 45, auxiliary gas 15, and sweep gas 0 (all nitrogen). Data converted to mzXML using RawConverter. Metabolites were annotated and integrated using Maven in conjunction with the KEGG database."},

"MS_METABOLITE_DATA":{
"Units":"peak area",

"Data":[{"Metabolite":"ATP","Control7":"4724.67","Control4":"86879.30","Control10":"2181532.00","Control2":"94712.52","Control3":"4707.84","Control6":"11600.91","Control8":"6686.72","Control9":"1413993.00","Control11":"859528.50","AD3":"9021.15","AD5":"500634.80","AD2":"633389.10","AD7":"50282.93","AD8":"8747168.00","AD1":"3802767.00","AD10":"765208.90","AD11":"2605640.00"},{"Metabolite":"ADP","Control7":"2877.61","Control4":"20400.57","Control10":"527749.40","Control2":"884504.00","Control3":"2169.75","Control6":"3289.00","Control8":"2425.85","Control9":"1461066.00","Control11":"1665730.00","AD3":"2680.63","AD5":"1015092.00","AD2":"845589.80","AD7":"75213.41","AD8":"3581236.00","AD1":"4136003.00","AD10":"1617848.00","AD11":"1560009.00"},{"Metabolite":"AMP","Control7":"32146.60","Control4":"276508.00","Control10":"71342.84","Control2":"821114.80","Control3":"2014.00","Control6":"1087.93","Control8":"24400.17","Control9":"470518.00","Control11":"2861932.00","AD3":"14215.85","AD5":"1789795.00","AD2":"510665.70","AD7":"86200.74","AD8":"706005.10","AD1":"1387938.00","AD10":"808720.20","AD11":"827794.20"},{"Metabolite":"Adenine","Control7":"4465604.00","Control4":"120195.20","Control10":"178379.70","Control2":"148893.40","Control3":"4470188.00","Control6":"4903620.00","Control8":"4395732.00","Control9":"177150.20","Control11":"164455.40","AD3":"4417254.00","AD5":"128955.10","AD2":"145778.70","AD7":"166784.60","AD8":"158563.60","AD1":"119075.90","AD10":"157372.40","AD11":"153709.70"},{"Metabolite":"GTP","Control7":"2213.92","Control4":"5141.90","Control10":"403155.60","Control2":"8826.38","Control3":"0.00","Control6":"847.75","Control8":"4520.49","Control9":"247662.10","Control11":"113459.90","AD3":"7634.95","AD5":"62200.53","AD2":"26555.81","AD7":"20572.49","AD8":"671238.70","AD1":"360998.90","AD10":"140719.60","AD11":"367208.50"},{"Metabolite":"GDP","Control7":"0.00","Control4":"330.07","Control10":"141959.90","Control2":"289427.40","Control3":"461.94","Control6":"0.00","Control8":"413.41","Control9":"355201.80","Control11":"385836.40","AD3":"4423.64","AD5":"262414.10","AD2":"180906.70","AD7":"36827.69","AD8":"395423.80","AD1":"604052.00","AD10":"366356.90","AD11":"284024.50"},{"Metabolite":"Guanosine","Control7":"3264.73","Control4":"201702.50","Control10":"225873.70","Control2":"326096.60","Control3":"3664.62","Control6":"3899.70","Control8":"5043.40","Control9":"143687.50","Control11":"68202.37","AD3":"3689.37","AD5":"1028699.00","AD2":"2686936.00","AD7":"191097.40","AD8":"192829.40","AD1":"112409.80","AD10":"7615.93","AD11":"715675.60"},{"Metabolite":"Guanine","Control7":"0.00","Control4":"80270.91","Control10":"173221.10","Control2":"147336.20","Control3":"35091.25","Control6":"0.00","Control8":"39090.05","Control9":"151406.90","Control11":"90776.60","AD3":"0.00","AD5":"488641.50","AD2":"487616.20","AD7":"170237.70","AD8":"116875.60","AD1":"151448.20","AD10":"39008.69","AD11":"244101.10"},{"Metabolite":"dCMP","Control7":"5989.68","Control4":"38977.28","Control10":"108108.20","Control2":"7441.53","Control3":"6301.57","Control6":"8656.90","Control8":"4798.39","Control9":"53308.38","Control11":"30917.79","AD3":"14629.27","AD5":"191191.90","AD2":"37890.05","AD7":"12486.58","AD8":"139552.00","AD1":"102458.10","AD10":"15761.27","AD11":"76701.79"},{"Metabolite":"Cytidine","Control7":"5234.14","Control4":"975546.60","Control10":"126712.60","Control2":"231680.20","Control3":"421.68","Control6":"8435.04","Control8":"7294.44","Control9":"178701.30","Control11":"339114.40","AD3":"7217.68","AD5":"1382990.00","AD2":"2172466.00","AD7":"54890.55","AD8":"716413.70","AD1":"498061.40","AD10":"80093.38","AD11":"1019658.00"},{"Metabolite":"UTP","Control7":"7721.17","Control4":"18494.35","Control10":"2995847.00","Control2":"241394.20","Control3":"18705.38","Control6":"11028.80","Control8":"12536.82","Control9":"1543917.00","Control11":"630710.20","AD3":"25567.46","AD5":"621600.40","AD2":"1284078.00","AD7":"1093146.00","AD8":"4716570.00","AD1":"1776092.00","AD10":"726352.50","AD11":"4351989.00"},{"Metabolite":"UDP","Control7":"26430.65","Control4":"102859.20","Control10":"822499.80","Control2":"2364006.00","Control3":"27538.31","Control6":"4023.90","Control8":"33448.87","Control9":"1566445.00","Control11":"1210276.00","AD3":"5360.82","AD5":"850030.00","AD2":"1511050.00","AD7":"718821.00","AD8":"2185427.00","AD1":"1885976.00","AD10":"1888122.00","AD11":"2435614.00"},{"Metabolite":"UMP","Control7":"0.00","Control4":"304171.80","Control10":"418670.20","Control2":"3898052.00","Control3":"0.00","Control6":"0.00","Control8":"0.00","Control9":"745102.00","Control11":"1200166.00","AD3":"0.00","AD5":"4060899.00","AD2":"2193598.00","AD7":"1213144.00","AD8":"491199.50","AD1":"818415.50","AD10":"537777.70","AD11":"1006839.00"},{"Metabolite":"Uracil","Control7":"40539.67","Control4":"4755740.00","Control10":"4104158.00","Control2":"647560.90","Control3":"37732.16","Control6":"42691.41","Control8":"41161.40","Control9":"2400021.00","Control11":"676646.40","AD3":"60282.61","AD5":"4997224.00","AD2":"6429284.00","AD7":"2977940.00","AD8":"493615.10","AD1":"938386.50","AD10":"325897.30","AD11":"4363270.00"},{"Metabolite":"IDP","Control7":"98331.23","Control4":"1981741.00","Control10":"5690550.00","Control2":"2047339.00","Control3":"282131.60","Control6":"278464.80","Control8":"190210.30","Control9":"6821012.00","Control11":"2669305.00","AD3":"66818.85","AD5":"2350071.00","AD2":"370417.20","AD7":"1818828.00","AD8":"4210808.00","AD1":"4708514.00","AD10":"3204081.00","AD11":"3440802.00"},{"Metabolite":"IMP","Control7":"2282.64","Control4":"16523.16","Control10":"28409.66","Control2":"73106.26","Control3":"826.95","Control6":"2760.71","Control8":"3069.29","Control9":"37768.58","Control11":"102400.30","AD3":"7468.01","AD5":"82662.71","AD2":"38866.34","AD7":"5630.49","AD8":"78366.59","AD1":"239147.20","AD10":"4808.63","AD11":"40201.44"},{"Metabolite":"Inosine","Control7":"0.00","Control4":"8235768.00","Control10":"2795627.00","Control2":"4529444.00","Control3":"20129.20","Control6":"8498.86","Control8":"20365.73","Control9":"2005184.00","Control11":"1239227.00","AD3":"22508.12","AD5":"10674030.00","AD2":"29497060.00","AD7":"1920394.00","AD8":"1911217.00","AD1":"1522955.00","AD10":"165334.20","AD11":"11103310.00"},{"Metabolite":"Xanthine","Control7":"68453.29","Control4":"10657900.00","Control10":"48794.86","Control2":"52819.34","Control3":"13063.81","Control6":"531.46","Control8":"29132.88","Control9":"64906.79","Control11":"149737.20","AD3":"13700.72","AD5":"40151.35","AD2":"474563.20","AD7":"52547.09","AD8":"194728.10","AD1":"39320.66","AD10":"17685.20","AD11":"173044.60"},{"Metabolite":"3',5'-Cyclic 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ID":"C01530","mz":"283.2638","r.t.":"3.41"},{"Metabolite":"Tetradecenoic acid","KEGG ID":"C08322","mz":"225.1854","r.t.":"2.35"},{"Metabolite":"Hexadecenoic acid","KEGG ID":"C08362","mz":"253.2169","r.t.":"2.58"},{"Metabolite":"Octadecenoic acid","KEGG ID":"C00712","mz":"281.2482","r.t.":"2.93"},{"Metabolite":"Linoleate","KEGG ID":"C01595","mz":"279.2326","r.t.":"2.63"},{"Metabolite":"Octadecatrienoic acid","KEGG ID":"C06427","mz":"277.2171","r.t.":"2.44"},{"Metabolite":"Eicosatetraenoic acid","KEGG ID":"C00219","mz":"303.2325","r.t.":"2.53"},{"Metabolite":"Eicosapentaenoic acid","KEGG ID":"C06428","mz":"301.2172","r.t.":"2.38"},{"Metabolite":"Docosahexaenoic acid","KEGG ID":"C06429","mz":"327.2328","r.t.":"2.44"},{"Metabolite":"Dodecanedioic acid","KEGG ID":"C02678","mz":"229.1441","r.t.":"1.69"},{"Metabolite":"(8Z-11Z-14Z)-Icosatrienoic acid","KEGG ID":"C03242","mz":"305.2482","r.t.":"2.70"},{"Metabolite":"(5Z-8Z-11Z-14Z-17Z)-Icosapentaenoic acid","KEGG ID":"C06428","mz":"301.2172","r.t.":"2.38"},{"Metabolite":"(7Z-10Z-13Z-16Z-19Z)-Docosa-7-10-13-16-19-pentaenoic acid","KEGG ID":"C16513","mz":"329.2483","r.t.":"2.55"},{"Metabolite":"3alpha-7alpha-12alpha-Trihydroxy-5beta-cholanate","KEGG ID":"C00695","mz":"407.2826","r.t.":"2.08"},{"Metabolite":"3alpha-12alpha-Dihydroxy-5beta-cholanate","KEGG ID":"C04483","mz":"391.2878","r.t.":"2.27"},{"Metabolite":"13(S)-HODE","KEGG ID":"C14762","mz":"295.2275","r.t.":"2.16"},{"Metabolite":"9(S)-HODE","KEGG ID":"C14767","mz":"295.2275","r.t.":"2.27"},{"Metabolite":"11(R)-HPETE/Leukotriene B4 (isobars)","KEGG ID":"C14820","mz":"335.2202","r.t.":"2.58"},{"Metabolite":"Prostaglandin A2","KEGG ID":"C05953","mz":"333.2095","r.t.":"1.73"},{"Metabolite":"Prostaglandin B2","KEGG ID":"C05954","mz":"333.2096","r.t.":"2.01"},{"Metabolite":"Prostaglandin D2/Thromboxane A2 (isobars)","KEGG ID":"C00696","mz":"351.2201","r.t.":"1.92"},{"Metabolite":"Prostaglandin E2","KEGG ID":"C00584","mz":"351.2206","r.t.":"2.90"},{"Metabolite":"Prostaglandin F2alpha/beta/D1 (isobars)","KEGG ID":"C00639","mz":"353.2303","r.t.":"2.16"},{"Metabolite":"Prostaglandin D3 (isobars)","KEGG ID":"C13802","mz":"349.2047","r.t.":"2.58"},{"Metabolite":"Prostaglandin G2","KEGG ID":"C05956","mz":"367.2138","r.t.":"2.18"},{"Metabolite":"Thromboxane B2","KEGG ID":"C05963","mz":"369.2279","r.t.":"1.72"},{"Metabolite":"Leukotriene A4","KEGG ID":"C00909","mz":"317.2126","r.t.":"2.08"},{"Metabolite":"Undecanoic acid","KEGG ID":"C17715","mz":"185.1538","r.t.":"2.20"},{"Metabolite":"Stearidonic acid","KEGG ID":"C16300","mz":"275.2013","r.t.":"2.33"},{"Metabolite":"trans-9-Octadecenoic acid","KEGG ID":"C01712","mz":"281.2481","r.t.":"2.93"},{"Metabolite":"Docosatetraenoic acid","KEGG ID":"C16527","mz":"331.2638","r.t.":"2.78"},{"Metabolite":"(15Z)-Tetracosenoic acid","KEGG ID":"C08323","mz":"365.3423","r.t.":"2.20"},{"Metabolite":"N1-Acetylspermine","KEGG ID":"C02567","mz":"243.2233","r.t.":"2.70"},{"Metabolite":"Ferric gluconate","KEGG ID":"C13511","mz":"194.0469","r.t.":"1.82"},{"Metabolite":"D-Alanyl-alanyl-poly(glycerolphosphate)","KEGG ID":"C04457","mz":"313.0782","r.t.":"2.11"},{"Metabolite":"Vanillate","KEGG ID":"C06672","mz":"167.0353","r.t.":"2.23"},{"Metabolite":"N-Acetylmethionine","KEGG ID":"C02712","mz":"190.0525","r.t.":"0.64"},{"Metabolite":"10-Hydroxydecanoic acid","KEGG ID":"C02774","mz":"187.1330","r.t.":"1.71"},{"Metabolite":"Oxalosuccinate","KEGG ID":"C05379","mz":"189.0064","r.t.":"3.80"},{"Metabolite":"N-Carbamyl-L-glutamate","KEGG ID":"C05829","mz":"189.0488","r.t.":"0.62"}]
}

}