{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST001668","ANALYSIS_ID":"AN002723","VERSION":"1","CREATED_ON":"January 28, 2021, 1:16 pm"},

"PROJECT":{"PROJECT_TITLE":"D-Allulose effects on metabolomics profile in rodents","PROJECT_SUMMARY":"To determine the metabolomics profile after D-allulose intake.","INSTITUTE":"Matsutani Chemical Industry Co., Ltd.","LAST_NAME":"Kanasaki","FIRST_NAME":"Akane","ADDRESS":"5-3 Kita-Itami, Itami, Hyogo, 664-8508, Japan","EMAIL":"akane-kanasaki@matsutani.co.jp","PHONE":"81-72-771-2052"},

"STUDY":{"STUDY_TITLE":"D-Allulose effects on hepatic metabolomics profile in rodents","STUDY_SUMMARY":"To determine the hepatic metabolomics profile after D-allulose intake.","INSTITUTE":"Matsutani Chemical Industry Co., Ltd.","LAST_NAME":"Kanasaki","FIRST_NAME":"Akane","ADDRESS":"5-3 Kita-Itami, Itami, Hyogo, 664-8508, Japan","EMAIL":"akane-kanasaki@matsutani.co.jp","PHONE":"81-72-771-2052"},

"SUBJECT":{"SUBJECT_TYPE":"Mammal","SUBJECT_SPECIES":"Rattus norvegicus","TAXONOMY_ID":"10116"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"-",
"Sample ID":"C1",
"Factors":{"Diet":"control"}
},
{
"Subject ID":"-",
"Sample ID":"C2",
"Factors":{"Diet":"control"}
},
{
"Subject ID":"-",
"Sample ID":"C3",
"Factors":{"Diet":"control"}
},
{
"Subject ID":"-",
"Sample ID":"C4",
"Factors":{"Diet":"control"}
},
{
"Subject ID":"-",
"Sample ID":"C5",
"Factors":{"Diet":"control"}
},
{
"Subject ID":"-",
"Sample ID":"C6",
"Factors":{"Diet":"control"}
},
{
"Subject ID":"-",
"Sample ID":"P1",
"Factors":{"Diet":"D-Allulose"}
},
{
"Subject ID":"-",
"Sample ID":"P2",
"Factors":{"Diet":"D-Allulose"}
},
{
"Subject ID":"-",
"Sample ID":"P3",
"Factors":{"Diet":"D-Allulose"}
},
{
"Subject ID":"-",
"Sample ID":"P4",
"Factors":{"Diet":"D-Allulose"}
},
{
"Subject ID":"-",
"Sample ID":"P5",
"Factors":{"Diet":"D-Allulose"}
},
{
"Subject ID":"-",
"Sample ID":"P6",
"Factors":{"Diet":"D-Allulose"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"The livers were collected and then flash-frozen in liquid N2","SAMPLE_TYPE":"Liver"},

"TREATMENT":{"TREATMENT_SUMMARY":"Seven-week old male Wistar rats were fed AIN-93G-based diets with/without 3% D-allulose, ad libitum for 4 weeks."},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"For CE-TOFMS, The frozen tissue was plunged into 50% acetonitrile/Milli-Q water containing internal standards. The tissues were homogenized thrice, and then centrifuged. The upper aqueous layer was centrifugally filtered to remove the proteins. The filtrate was then centrifugally concentrated and re-suspended in 50 µL of Milli-Q water for CE-MS analysis. For LC-TOFMS, the frozen tissue was plunged into 1% formic acid/acetonitrile containing the internal standard solution. Tissue was homogenized thrice, and the mixture was yet again homogenized after adding Milli-Q water and then centrifuged. The supernatant was collected and 500 1% formic acid/acetonitrile and Milli-Q water were added to the precipitate. Homogenization and centrifugation were performed as described previously, and the supernatant was mixed with previously collected one. The mixed supernatant was filtrated to remove the proteins and phospholipids. The filtrate was then desiccated and dissolved in 200 µL of isopropanol/Milli-Q water for LC-MS analysis."},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_TYPE":"Reversed phase","INSTRUMENT_NAME":"Agilent 1200SL","COLUMN_NAME":"ODS column (2×50 mm, 2 μm)"},

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

"MS":{"INSTRUMENT_NAME":"Agilent 6230 TOF","INSTRUMENT_TYPE":"QTOF","MS_TYPE":"ESI","ION_MODE":"NEGATIVE","MS_COMMENTS":"-"},

"MS_METABOLITE_DATA":{
"Units":"Relative Area",

"Data":[{"Metabolite":"Lauric acid","C1":"","C2":"0.000052","C3":"","C4":"0.000031","C5":"0.000036","C6":"","P1":"0.000029","P2":"0.000031","P3":"0.000031","P4":"0.000036","P5":"0.000025","P6":"0.000024"},{"Metabolite":"Tetradecatrienoic acid","C1":"0.002724","C2":"0.008856","C3":"0.013124","C4":"0.007704","C5":"0.012543","C6":"0.008616","P1":"0.008202","P2":"0.01209","P3":"0.011895","P4":"0.009533","P5":"0.008802","P6":"0.008964"},{"Metabolite":"Myristic acid","C1":"0.000067","C2":"0.000095","C3":"0.00027","C4":"0.000176","C5":"0.000423","C6":"0.000085","P1":"0.000284","P2":"0.000665","P3":"0.000475","P4":"0.000087","P5":"0.000755","P6":"0.000114"},{"Metabolite":"Pentadecanoic acid","C1":"0.000031","C2":"","C3":"0.00007","C4":"0.000049","C5":"0.000116","C6":"0.000025","P1":"0.000062","P2":"0.000153","P3":"0.000154","P4":"0.000035","P5":"0.000203","P6":"0.000039"},{"Metabolite":"Pentadecylic 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"Metabolites":[{"Metabolite":"Lauric acid","PubChem CID":"","m/z":"199.172"},{"Metabolite":"Tetradecatrienoic acid","PubChem CID":"","m/z":"221.159"},{"Metabolite":"Myristic acid","PubChem CID":"11005","m/z":"227.205"},{"Metabolite":"Pentadecanoic acid","PubChem CID":"13849","m/z":"241.22"},{"Metabolite":"Pentadecylic acid","PubChem CID":"","m/z":"241.2"},{"Metabolite":"243.2_13.0","PubChem CID":"656737","m/z":"243.2"},{"Metabolite":"243.2_12.6","PubChem CID":"16064","m/z":"243.2"},{"Metabolite":"243.2_12.8","PubChem CID":"","m/z":"243.2"},{"Metabolite":"Hexadecatrienoic acid","PubChem CID":"","m/z":"249.2"},{"Metabolite":"Palmitoleic acid","PubChem CID":"445638","m/z":"253.2"},{"Metabolite":"Palmitic acid","PubChem CID":"985","m/z":"255.2"},{"Metabolite":"Heptadecatrienoic acid","PubChem CID":"","m/z":"263.2"},{"Metabolite":"Heptadecenoic acid","PubChem CID":"","m/z":"267.2"},{"Metabolite":"269.3_14.8","PubChem CID":"10465","m/z":"269.3"},{"Metabolite":"269.3_14.9","PubChem CID":"10465","m/z":"269.3"},{"Metabolite":"Octadecatrienoic acid","PubChem CID":"5280934","m/z":"277.2"},{"Metabolite":"Linoleic acid","PubChem CID":"5280450","m/z":"279.2"},{"Metabolite":"Oleic acid","PubChem CID":"445639","m/z":"281.3"},{"Metabolite":"Stearic acid","PubChem CID":"5281","m/z":"283.3"},{"Metabolite":"297.2_12.5","PubChem CID":"643684","m/z":"297.2"},{"Metabolite":"297.2_12.7","PubChem CID":"643684","m/z":"297.2"},{"Metabolite":"297.3_15.4","PubChem CID":"","m/z":"297.3"},{"Metabolite":"297.3_15.5","PubChem CID":"","m/z":"297.3"},{"Metabolite":"301.2_13.9","PubChem CID":"446284","m/z":"301.2"},{"Metabolite":"301.2_13.7","PubChem CID":"446284","m/z":"301.2"},{"Metabolite":"Arachidonic acid","PubChem CID":"444899","m/z":"303.2"},{"Metabolite":"Eicosatrienoic acid","PubChem CID":"","m/z":"305.3"},{"Metabolite":"305.3_14.4","PubChem CID":"5280581","m/z":"305.3"},{"Metabolite":"11Z,14Z-Eicosadienoic acid","PubChem CID":"6439848","m/z":"307.3"},{"Metabolite":"cis-Gondoic acid","PubChem CID":"5282768","m/z":"309.3"},{"Metabolite":"Arachidic acid","PubChem CID":"10467","m/z":"311.3"},{"Metabolite":"327.2_14.0","PubChem CID":"445580","m/z":"327.2"},{"Metabolite":"329.2_14.0","PubChem CID":"","m/z":"329.2"},{"Metabolite":"329.3_14.4","PubChem CID":"","m/z":"329.3"},{"Metabolite":"329.3_14.2","PubChem CID":"","m/z":"329.3"},{"Metabolite":"Docosatetraenoic acid","PubChem CID":"","m/z":"331.3"},{"Metabolite":"Docosatrienoic acid","PubChem CID":"","m/z":"333.3"},{"Metabolite":"cis-Erucic acid","PubChem CID":"5281116","m/z":"337.3"},{"Metabolite":"Behenic acid","PubChem CID":"8215","m/z":"339.3"},{"Metabolite":"Tetracosapentaenoic acid","PubChem CID":"","m/z":"357.3"},{"Metabolite":"Tetracosatetraenoic acid","PubChem CID":"","m/z":"359.3"},{"Metabolite":"Nervonic acid","PubChem CID":"5281120","m/z":"365.3"},{"Metabolite":"Dehydroepiandrosterone sulfate","PubChem CID":"12594","m/z":"367.2"},{"Metabolite":"Lignoceric acid","PubChem CID":"","m/z":"367.4"},{"Metabolite":"LPA 14:0","PubChem CID":"","m/z":"381.2"},{"Metabolite":"Hyenic acid","PubChem CID":"","m/z":"381.4"},{"Metabolite":"Cholic acid","PubChem CID":"221493","m/z":"407.3"},{"Metabolite":"Glycolithocholic acid","PubChem CID":"115245","m/z":"432.3"},{"Metabolite":"Estrone 3-glucuronide","PubChem CID":"115255","m/z":"445.2"},{"Metabolite":"Glycoursodeoxycholic acid","PubChem CID":"12310288","m/z":"448.3"},{"Metabolite":"Glycochenodeoxycholic acid","PubChem CID":"12544","m/z":"448.3"},{"Metabolite":"Glycodeoxycholic acid","PubChem CID":"3035026","m/z":"448.3"},{"Metabolite":"Glycocholic acid","PubChem CID":"10140","m/z":"464.3"},{"Metabolite":"Cholesterol sulfate","PubChem CID":"65076","m/z":"465.3"},{"Metabolite":"Taurolithocholic acid","PubChem CID":"439763","m/z":"482.3"},{"Metabolite":"Asiatic acid","PubChem CID":"119034","m/z":"487.3"},{"Metabolite":"Tauroursodeoxycholic acid","PubChem CID":"12443252","m/z":"498.3"},{"Metabolite":"Taurochenodeoxycholic acid","PubChem CID":"387316","m/z":"498.3"},{"Metabolite":"Taurodeoxycholic acid","PubChem CID":"92042745","m/z":"498.3"},{"Metabolite":"509.3_15.2","PubChem CID":"","m/z":"509.3"},{"Metabolite":"509.3_15.6","PubChem CID":"","m/z":"509.3"},{"Metabolite":"Taurocholic acid","PubChem CID":"46783527","m/z":"514.3"}]
}

}