{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST003101","ANALYSIS_ID":"AN005072","VERSION":"1","CREATED_ON":"February 23, 2024, 7:46 am"},

"PROJECT":{"PROJECT_TITLE":"Parallel pheromonal, metabolite, and lipid analyses reveal patterns associated with early life transitions and ovary activation in honey bee (Apis mellifera) queens","PROJECT_SUMMARY":"We used a novel pheromone detection method to quantify retinue pheromone (QRP) concurrently with shotgun metabolomics and lipidomics analysis to determine what changes in pheromones and small molecules may underpin differences in age, laying status, and acceptance by workers in honey bee queens.","INSTITUTE":"Life Sciences Institute, The University of British Columbia","LAST_NAME":"Alcazar Magana","FIRST_NAME":"Armando","ADDRESS":"2350 Health Sciences Mall, Vancouver, BC, V6T1Z3, Canada","EMAIL":"armando.alcazarmagana@ubc.ca","PHONE":"5416097172"},

"STUDY":{"STUDY_TITLE":"Parallel pheromonal, metabolite, and lipid analyses reveal patterns associated with early life transitions and ovary activation in honey bee (Apis mellifera) queens","STUDY_SUMMARY":"We used a novel pheromone detection method to quantify retinue pheromone (QRP) concurrently with shotgun metabolomics and lipidomics analysis to determine what changes in pheromones and small molecules may underpin differences in age, laying status, and acceptance by workers in honey bee queens.","INSTITUTE":"Life Sciences Institute, The University of British Columbia","LAST_NAME":"Alcazar Magana","FIRST_NAME":"Armando","ADDRESS":"2350 Health Sciences Mall, Vancouver, BC, V6T1Z3, Canada","EMAIL":"armando.alcazarmagana@ubc.ca","PHONE":"5416097172","NUM_GROUPS":"4","TOTAL_SUBJECTS":"40","NUM_FEMALES":"40"},

"SUBJECT":{"SUBJECT_TYPE":"Insect","SUBJECT_SPECIES":"Apis mellifera","GENDER":"Female"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"V1",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V1_11-1-2023_R-A2_14936","RAW_FILE_NAME":"V1_11-2-2023_R-A2_15001","RAW_FILE_NAME":"V1_11-3-2023_R-A2_15065","RAW_FILE_NAME":"V1_11-4-2023_R-A2_15124"}
},
{
"Subject ID":"-",
"Sample ID":"V2",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V2_10-31-2023_R-A3_14896","RAW_FILE_NAME":"V2_11-1-2023_R-A3_14961","RAW_FILE_NAME":"V2_11-2-2023_R-A3_15025","RAW_FILE_NAME":"V2_11-3-2023_R-A3_15084"}
},
{
"Subject ID":"-",
"Sample ID":"V3",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V3_11-1-2023_R-A4_14913","RAW_FILE_NAME":"V3_11-1-2023_R-A4_14978","RAW_FILE_NAME":"V3_11-3-2023_R-A4_15042","RAW_FILE_NAME":"V3_11-3-2023_R-A4_15101"}
},
{
"Subject ID":"-",
"Sample ID":"V4",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V4_10-31-2023_R-A5_14905","RAW_FILE_NAME":"V4_11-1-2023_R-A5_14970","RAW_FILE_NAME":"V4_11-2-2023_R-A5_15034","RAW_FILE_NAME":"V4_11-3-2023_R-A5_15093"}
},
{
"Subject ID":"-",
"Sample ID":"V5",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V5_10-31-2023_R-A6_14902","RAW_FILE_NAME":"V5_11-1-2023_R-A6_14967","RAW_FILE_NAME":"V5_11-2-2023_R-A6_15031","RAW_FILE_NAME":"V5_11-3-2023_R-A6_15090"}
},
{
"Subject ID":"-",
"Sample ID":"V6",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V6_11-1-2023_R-A7_14933","RAW_FILE_NAME":"V6_11-2-2023_R-A7_14998","RAW_FILE_NAME":"V6_11-3-2023_R-A7_15062","RAW_FILE_NAME":"V6_11-4-2023_R-A7_15121"}
},
{
"Subject ID":"-",
"Sample ID":"V7",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V7_11-1-2023_R-A8_14939","RAW_FILE_NAME":"V7_11-2-2023_R-A8_15004","RAW_FILE_NAME":"V7_11-3-2023_R-A8_15068","RAW_FILE_NAME":"V7_11-4-2023_R-A8_15127"}
},
{
"Subject ID":"-",
"Sample ID":"V8",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V8_11-1-2023_R-A9_14926","RAW_FILE_NAME":"V8_11-2-2023_R-A9_14991","RAW_FILE_NAME":"V8_11-3-2023_R-A9_15055","RAW_FILE_NAME":"V8_11-3-2023_R-A9_15114"}
},
{
"Subject ID":"-",
"Sample ID":"V9",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V9_11-1-2023_R-B1_14923","RAW_FILE_NAME":"V9_11-2-2023_R-B1_14988","RAW_FILE_NAME":"V9_11-3-2023_R-B1_15052","RAW_FILE_NAME":"V9_11-3-2023_R-B1_15111"}
},
{
"Subject ID":"-",
"Sample ID":"V10",
"Factors":{"Sample source":"Bee head","Treatment":"Virgin"},
"Additional sample data":{"RAW_FILE_NAME":"V10_11-1-2023_R-B2_14932","RAW_FILE_NAME":"V10_11-2-2023_R-B2_14997","RAW_FILE_NAME":"V10_11-3-2023_R-B2_15061","RAW_FILE_NAME":"V10_11-4-2023_R-B2_15120"}
},
{
"Subject ID":"-",
"Sample ID":"Q11",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q11_11-1-2023_R-B4_14920","RAW_FILE_NAME":"Q11_11-2-2023_R-B4_14985","RAW_FILE_NAME":"Q11_11-3-2023_R-B4_15049","RAW_FILE_NAME":"Q11_11-3-2023_R-B4_15108"}
},
{
"Subject ID":"-",
"Sample ID":"Q12",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q12_11-1-2023_R-B5_14910","RAW_FILE_NAME":"Q12_11-1-2023_R-B5_14975","RAW_FILE_NAME":"Q12_11-2-2023_R-B5_15039","RAW_FILE_NAME":"Q12_11-3-2023_R-B5_15098"}
},
{
"Subject ID":"-",
"Sample ID":"Q13",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q13_11-1-2023_R-B6_14938","RAW_FILE_NAME":"Q13_11-2-2023_R-B6_15003","RAW_FILE_NAME":"Q13_11-3-2023_R-B6_15067","RAW_FILE_NAME":"Q13_11-4-2023_R-B6_15126"}
},
{
"Subject ID":"-",
"Sample ID":"Q14",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q14_11-1-2023_R-B7_14934","RAW_FILE_NAME":"Q14_11-2-2023_R-B7_14999","RAW_FILE_NAME":"Q14_11-3-2023_R-B7_15063","RAW_FILE_NAME":"Q14_11-4-2023_R-B7_15122"}
},
{
"Subject ID":"-",
"Sample ID":"Q15",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q15_11-1-2023_R-B8_14911","RAW_FILE_NAME":"Q15_11-1-2023_R-B8_14976","RAW_FILE_NAME":"Q15_11-2-2023_R-B8_15040","RAW_FILE_NAME":"Q15_11-3-2023_R-B8_15099"}
},
{
"Subject ID":"-",
"Sample ID":"Q16",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q16_11-1-2023_R-B9_14909","RAW_FILE_NAME":"Q16_11-1-2023_R-B9_14974","RAW_FILE_NAME":"Q16_11-2-2023_R-B9_15038","RAW_FILE_NAME":"Q16_11-3-2023_R-B9_15097"}
},
{
"Subject ID":"-",
"Sample ID":"Q17",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q17_10-31-2023_R-C1_14903","RAW_FILE_NAME":"Q17_11-1-2023_R-C1_14968","RAW_FILE_NAME":"Q17_11-2-2023_R-C1_15032","RAW_FILE_NAME":"Q17_11-3-2023_R-C1_15091"}
},
{
"Subject ID":"-",
"Sample ID":"Q18",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q18_11-1-2023_R-C2_14917","RAW_FILE_NAME":"Q18_11-2-2023_R-C2_14982","RAW_FILE_NAME":"Q18_11-3-2023_R-C2_15046","RAW_FILE_NAME":"Q18_11-3-2023_R-C2_15105"}
},
{
"Subject ID":"-",
"Sample ID":"Q19",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q19_11-1-2023_R-C3_14916","RAW_FILE_NAME":"Q19_11-2-2023_R-C3_14981","RAW_FILE_NAME":"Q19_11-3-2023_R-C3_15045","RAW_FILE_NAME":"Q19_11-3-2023_R-C3_15104"}
},
{
"Subject ID":"-",
"Sample ID":"Q20",
"Factors":{"Sample source":"Bee head","Treatment":"Early mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q20_10-31-2023_R-C4_14904","RAW_FILE_NAME":"Q20_11-1-2023_R-C4_14969","RAW_FILE_NAME":"Q20_11-2-2023_R-C4_15033","RAW_FILE_NAME":"Q20_11-3-2023_R-C4_15092"}
},
{
"Subject ID":"-",
"Sample ID":"Q21",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q21_11-1-2023_R-C6_14915","RAW_FILE_NAME":"Q21_11-1-2023_R-C6_14980","RAW_FILE_NAME":"Q21_11-3-2023_R-C6_15044","RAW_FILE_NAME":"Q21_11-3-2023_R-C6_15103"}
},
{
"Subject ID":"-",
"Sample ID":"Q22",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q22_11-1-2023_R-C7_14921","RAW_FILE_NAME":"Q22_11-2-2023_R-C7_14986","RAW_FILE_NAME":"Q22_11-3-2023_R-C7_15050","RAW_FILE_NAME":"Q22_11-3-2023_R-C7_15109"}
},
{
"Subject ID":"-",
"Sample ID":"Q23",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q23_11-1-2023_R-C8_14914","RAW_FILE_NAME":"Q23_11-1-2023_R-C8_14979","RAW_FILE_NAME":"Q23_11-3-2023_R-C8_15043","RAW_FILE_NAME":"Q23_11-3-2023_R-C8_15102"}
},
{
"Subject ID":"-",
"Sample ID":"Q24",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q24_11-1-2023_R-C9_14941","RAW_FILE_NAME":"Q24_11-2-2023_R-C9_15006","RAW_FILE_NAME":"Q24_11-3-2023_R-C9_15070","RAW_FILE_NAME":"Q24_11-4-2023_R-C9_15129"}
},
{
"Subject ID":"-",
"Sample ID":"Q25",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q25_11-1-2023_R-D1_14908","RAW_FILE_NAME":"Q25_11-1-2023_R-D1_14973","RAW_FILE_NAME":"Q25_11-2-2023_R-D1_15037","RAW_FILE_NAME":"Q25_11-3-2023_R-D1_15096"}
},
{
"Subject ID":"-",
"Sample ID":"Q26",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q26_11-1-2023_R-D2_14940","RAW_FILE_NAME":"Q26_11-2-2023_R-D2_15005","RAW_FILE_NAME":"Q26_11-3-2023_R-D2_15069","RAW_FILE_NAME":"Q26_11-4-2023_R-D2_15128"}
},
{
"Subject ID":"-",
"Sample ID":"Q27",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q27_11-1-2023_R-D3_14929","RAW_FILE_NAME":"Q27_11-2-2023_R-D3_14994","RAW_FILE_NAME":"Q27_11-3-2023_R-D3_15058","RAW_FILE_NAME":"Q27_11-4-2023_R-D3_15117"}
},
{
"Subject ID":"-",
"Sample ID":"Q28",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q28_10-31-2023_R-D4_14897","RAW_FILE_NAME":"Q28_11-1-2023_R-D4_14962","RAW_FILE_NAME":"Q28_11-2-2023_R-D4_15026","RAW_FILE_NAME":"Q28_11-3-2023_R-D4_15085"}
},
{
"Subject ID":"-",
"Sample ID":"Q29",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q29_10-31-2023_R-D5_14898","RAW_FILE_NAME":"Q29_11-1-2023_R-D5_14963","RAW_FILE_NAME":"Q29_11-2-2023_R-D5_15027","RAW_FILE_NAME":"Q29_11-3-2023_R-D5_15086"}
},
{
"Subject ID":"-",
"Sample ID":"Q30",
"Factors":{"Sample source":"Bee head","Treatment":"Banked"},
"Additional sample data":{"RAW_FILE_NAME":"Q30_10-31-2023_R-D6_14899","RAW_FILE_NAME":"Q30_11-1-2023_R-D6_14964","RAW_FILE_NAME":"Q30_11-2-2023_R-D6_15028","RAW_FILE_NAME":"Q30_11-3-2023_R-D6_15087"}
},
{
"Subject ID":"-",
"Sample ID":"Q31",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q31_11-1-2023_R-D8_14925","RAW_FILE_NAME":"Q31_11-2-2023_R-D8_14990","RAW_FILE_NAME":"Q31_11-3-2023_R-D8_15054","RAW_FILE_NAME":"Q31_11-3-2023_R-D8_15113"}
},
{
"Subject ID":"-",
"Sample ID":"Q32",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q32_11-1-2023_R-D9_14935","RAW_FILE_NAME":"Q32_11-2-2023_R-D9_15000","RAW_FILE_NAME":"Q32_11-3-2023_R-D9_15064","RAW_FILE_NAME":"Q32_11-4-2023_R-D9_15123"}
},
{
"Subject ID":"-",
"Sample ID":"Q33",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q33_11-1-2023_R-E1_14912","RAW_FILE_NAME":"Q33_11-1-2023_R-E1_14977","RAW_FILE_NAME":"Q33_11-3-2023_R-E1_15041","RAW_FILE_NAME":"Q33_11-3-2023_R-E1_15100"}
},
{
"Subject ID":"-",
"Sample ID":"Q34",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q34_11-1-2023_R-E2_14937","RAW_FILE_NAME":"Q34_11-2-2023_R-E2_15002","RAW_FILE_NAME":"Q34_11-3-2023_R-E2_15066","RAW_FILE_NAME":"Q34_11-4-2023_R-E2_15125"}
},
{
"Subject ID":"-",
"Sample ID":"Q35",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q35_11-1-2023_R-E3_14928","RAW_FILE_NAME":"Q35_11-2-2023_R-E3_14993","RAW_FILE_NAME":"Q35_11-3-2023_R-E3_15057","RAW_FILE_NAME":"Q35_11-4-2023_R-E3_15116"}
},
{
"Subject ID":"-",
"Sample ID":"Q36",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q36_11-1-2023_R-E4_14927","RAW_FILE_NAME":"Q36_11-2-2023_R-E4_14992","RAW_FILE_NAME":"Q36_11-3-2023_R-E4_15056","RAW_FILE_NAME":"Q36_11-3-2023_R-E4_15115"}
},
{
"Subject ID":"-",
"Sample ID":"Q37",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q37_10-31-2023_R-E5_14900","RAW_FILE_NAME":"Q37_11-1-2023_R-E5_14965","RAW_FILE_NAME":"Q37_11-2-2023_R-E5_15029","RAW_FILE_NAME":"Q37_11-3-2023_R-E5_15088"}
},
{
"Subject ID":"-",
"Sample ID":"Q38",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q38_11-1-2023_R-E6_14922","RAW_FILE_NAME":"Q38_11-2-2023_R-E6_14987","RAW_FILE_NAME":"Q38_11-3-2023_R-E6_15051","RAW_FILE_NAME":"Q38_11-3-2023_R-E6_15110"}
},
{
"Subject ID":"-",
"Sample ID":"Q39",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q39_10-31-2023_R-E7_14901","RAW_FILE_NAME":"Q39_11-1-2023_R-E7_14966","RAW_FILE_NAME":"Q39_11-2-2023_R-E7_15030","RAW_FILE_NAME":"Q39_11-3-2023_R-E7_15089"}
},
{
"Subject ID":"-",
"Sample ID":"Q40",
"Factors":{"Sample source":"Bee head","Treatment":"Late mated"},
"Additional sample data":{"RAW_FILE_NAME":"Q40_11-1-2023_R-E8_14924","RAW_FILE_NAME":"Q40_11-2-2023_R-E8_14989","RAW_FILE_NAME":"Q40_11-3-2023_R-E8_15053","RAW_FILE_NAME":"Q40_11-3-2023_R-E8_15112"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Queens were produced by Scandia Honey in May 2023 in Scandia, AB, Canada, according to standard queen rearing methods.","SAMPLE_TYPE":"queen bee head","STORAGE_CONDITIONS":"-80℃"},

"TREATMENT":{"TREATMENT_SUMMARY":"very young (≤ 1 day old) larvae were grafted from a single mother colony into queen cell cups (JZBZ) and reared into queen cells in strong cell builder colonies. Ten days after grafting (June 1), queen cells were placed in mating nucleus colonies (nucs)."},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"two-phase extraction was conducted according to methods previously described at J. Lipid Res. 49, 1137–1146 (2008)","PROCESSING_STORAGE_CONDITIONS":"4℃","EXTRACT_STORAGE":"-80℃"},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_SUMMARY":"Separation of compounds was achieved using a multigradient method on an Inertsil Ph-3 UHPLC column (2 µm, 150 x 2.1 mm) (GL Sciences) equipped with a Ph-3 guard column (2 µm, 2.1 x 10 mm","CHROMATOGRAPHY_TYPE":"Reversed phase","INSTRUMENT_NAME":"Thermo Vanquish","COLUMN_NAME":"Inertsil Ph-3 UHPLC column (2 µm, 150 x 2.1 mm)","SOLVENT_A":"100% water; 0.1% formic acid","SOLVENT_B":"100% methanol; 0.1% formic acid","FLOW_GRADIENT":"0 min (5% B), 0–1 min (5% B), 1–8 min (35% B), 8–10.5 min (99% B), 10.5–14 min (99% B), 14–14.5 min (5% B), and 14.5–18 min (5% B)","FLOW_RATE":"0.3 ml/min","COLUMN_TEMPERATURE":"55"},

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

"MS":{"INSTRUMENT_NAME":"Bruker Impact II","INSTRUMENT_TYPE":"QTOF","MS_TYPE":"ESI","ION_MODE":"POSITIVE","MS_COMMENTS":"For positive ion mode, the mass spectrometer settings were as follows: capillary voltage of 4500 V, nebulizer gas pressure of 2.0 bar, dry gas flow rate of 9 L min-1, dry gas temperature of 220°C, mass scan range of 60-1300 m/z, and a total cycle time of 0.6 s. To obtain comprehensive structural information, collision energy of 20 V was ramped through each MS/MS scan from 100 to 250%.","MS_RESULTS_FILE":"ST003101_AN005072_Results.txt UNITS:Rel Abundance Has m/z:Yes Has RT:Yes RT units:Minutes"},

"MS_METABOLITE_DATA":{
"Units":"Rel Abundance",

"Data":[{"Metabolite":"methylpiperidine-2-carboxylic acid","V1":"448.7648475","V2":"1128.11084","V3":"538.5464556","V4":"263.1186048","V5":"389.4135616","V6":"902.1781529","V7":"355.039174","V8":"435.1763016","V9":"210.3487459","V10":"1047.254658","Q11":"3068.657539","Q12":"3649.772611","Q13":"8033.738571","Q14":"3078.379889","Q15":"2425.510193","Q16":"6807.116923","Q17":"8231.988335","Q18":"7222.980822","Q19":"4360.367113","Q20":"2719.879812","Q21":"1863.775874","Q22":"1393.598989","Q23":"1134.876869","Q24":"678.1218254","Q25":"1048.851383","Q26":"1320.355992","Q27":"1348.249475","Q28":"1361.578577","Q29":"1300.091017","Q30":"1061.846492","Q31":"2088.724386","Q32":"842.4752316","Q33":"856.1472821","Q34":"3354.307722","Q35":"1583.247545","Q36":"1262.755101","Q37":"1319.94973","Q38":"3651.179318","Q39":"1294.070439","Q40":"1152.622382"},{"Metabolite":"carbamoylpyrrolidine-2-carboxylic 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"Metabolites":[{"metabolite_name":"methylpiperidine-2-carboxylic acid"},{"metabolite_name":"carbamoylpyrrolidine-2-carboxylic acid"},{"metabolite_name":"methylguanosine"},{"metabolite_name":"methyl-L-histidine"},{"metabolite_name":"phenylglycine"},{"metabolite_name":"9(R)-hydroxydec-2(E)-enoic acid"},{"metabolite_name":"E-9-oxodec-2-enoic acid"},{"metabolite_name":"10-hydroxy-2-decenoic Acid"},{"metabolite_name":"3-hydroxy-DL-kynurenine"},{"metabolite_name":"glycerophosphocholine"},{"metabolite_name":"saccharopine"},{"metabolite_name":"acetylputrescine"},{"metabolite_name":"methylindole"},{"metabolite_name":"cinnamaldehyde"},{"metabolite_name":"hydroxycaprylic acid"},{"metabolite_name":"phenacylamine"},{"metabolite_name":"acetylhistamine"},{"metabolite_name":"estragole"},{"metabolite_name":"delta-octanolactone"},{"metabolite_name":"adenosine"},{"metabolite_name":"alpinetin methyl ether"},{"metabolite_name":"L-arginine monohydrochloride"},{"metabolite_name":"beta-nicotinamide adenine dinucleotide"},{"metabolite_name":"E-3-(4-hydroxy-3-methoxyphenyl)-prop-2-en-1-ol"},{"metabolite_name":"caffeine 13C3"},{"metabolite_name":"cuminyl alcohol"},{"metabolite_name":"dopamine"},{"metabolite_name":"D-phenylalanine-d5"},{"metabolite_name":"ferulic acid-d3"},{"metabolite_name":"fructoselysine"},{"metabolite_name":"galactosamine"},{"metabolite_name":"gamma-aminobutyric acid"},{"metabolite_name":"gamma-glutamylglutamine"},{"metabolite_name":"gamma-glutamylphenylalanine"},{"metabolite_name":"gamma-glutamyltyrosine"},{"metabolite_name":"glutamic acid"},{"metabolite_name":"glutamine"},{"metabolite_name":"glutathione (oxidized)"},{"metabolite_name":"guanine"},{"metabolite_name":"dopamine quinone"},{"metabolite_name":"PS(18:0/18:2)"},{"metabolite_name":"20-COOH-leukotriene E4"},{"metabolite_name":"hydroxyprolyl-valine"},{"metabolite_name":"2,6-nonadien-1-ol"},{"metabolite_name":"L-2-amino-5-hydroxypentanoic acid"},{"metabolite_name":"octenoic acid"},{"metabolite_name":"isoscoparin 2''''-(6-(E)-ferulylglucoside)"},{"metabolite_name":"3,4-dihydroxydecanoylcarnitine"},{"metabolite_name":"proline, 1-acetyl-4-hydroxy-, cis-"},{"metabolite_name":"ethylcarboxamidoadenosine"},{"metabolite_name":"p-menthen-1,2-diol"},{"metabolite_name":"planteose"},{"metabolite_name":"4-hydroxy-3-methoxyphenylethanol"},{"metabolite_name":"hypoxanthine"},{"metabolite_name":"indole"},{"metabolite_name":"isophorone"},{"metabolite_name":"kynurenine"},{"metabolite_name":"carnitine"},{"metabolite_name":"tert-leucine"},{"metabolite_name":"lysine"},{"metabolite_name":"maltose"},{"metabolite_name":"mannitol"},{"metabolite_name":"methionine"},{"metabolite_name":"methionine-methyl-d3"},{"metabolite_name":"5''-deoxy-5''-(methylthio)adenosine"},{"metabolite_name":"methyltyrosinate"},{"metabolite_name":"methyl oleate"},{"metabolite_name":"N,N,N-trimethyllysine"},{"metabolite_name":"N,N-dimethylguanosine"},{"metabolite_name":"N2-methylguanosine"},{"metabolite_name":"N6,N6-dimethyllysine"},{"metabolite_name":"N6-methyl-lysine"},{"metabolite_name":"N-acetyl-glutamic acid"},{"metabolite_name":"N-acetyl-D-mannosamine"},{"metabolite_name":"N-acetyl-5-hydroxytryptamine"},{"metabolite_name":"N-fructosyl isoleucine"},{"metabolite_name":"N-fructosyl phenylalanine"},{"metabolite_name":"N-fructosyl tyrosine"},{"metabolite_name":"nicotinamide"},{"metabolite_name":"N-methyl-L-glutamic acid"},{"metabolite_name":"N-omega-acetylhistamine"},{"metabolite_name":"norvaline"},{"metabolite_name":"acetyl-L-carnitine"},{"metabolite_name":"octanoylcarnitine"},{"metabolite_name":"phenylacetic acid"},{"metabolite_name":"2-amino-1-phenylethanol"},{"metabolite_name":"phosphorylcholine"},{"metabolite_name":"octopamine"},{"metabolite_name":"proline"},{"metabolite_name":"pyroglutamic acid"},{"metabolite_name":"S-adenosyl-methionine"},{"metabolite_name":"serotonin"},{"metabolite_name":"sorbose"},{"metabolite_name":"spermidine"},{"metabolite_name":"threonine"},{"metabolite_name":"thymine"},{"metabolite_name":"thymol"},{"metabolite_name":"trans-4-hydroxy-L-proline"},{"metabolite_name":"tryptophan"},{"metabolite_name":"xanthommatin"}]
}

}