{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST001251","ANALYSIS_ID":"AN002077","VERSION":"1","CREATED_ON":"September 17, 2019, 10:35 am"},

"PROJECT":{"PROJECT_TITLE":"The effects of a training program encompassing cold exposure, breathing exercises, and meditation on the inflammatory response","PROJECT_TYPE":"Experimental human endotoxemia project","PROJECT_SUMMARY":"Project to investigate the effects of a training program encompassing cold exposure, breathing exercises, and meditation on the inflammatory response during experimental human endotoxemia.","INSTITUTE":"Radboud University Medical Centre Nijmegen","DEPARTMENT":"Intensive Care Medicine","LAST_NAME":"Kox","FIRST_NAME":"Matthijs","ADDRESS":"Intensive Care Medicine (710), Geert Grooteplein 10, 6500 HB, Nijmegen, the Netherlands","EMAIL":"matthijs.kox@radboudumc.nl","PHONE":"+31243653881","FUNDING_SOURCE":"Dutch Arthritis Society (ReumaNederland, https://reumanederland.nl/) Serendipity Grant, no. 12-1-101","PUBLICATIONS":"https://www.pnas.org/content/111/20/7379.long; https://link.springer.com/article/10.1007%2Fs10067-015-3009-8"},

"STUDY":{"STUDY_TITLE":"The effects of a training program encompassing cold exposure, breathing exercises, and meditation on plasma metabomics during experimental human endotoxemia","STUDY_TYPE":"Experimental human endotoxemia study","STUDY_SUMMARY":"Study to investigate the effects of a training program encompassing cold exposure, breathing exercises, and meditation on plasma metabolomic during experimental human endotoxemia.","INSTITUTE":"Radboud University Medical Centre Nijmegen","DEPARTMENT":"Intensive Care Medicine","LABORATORY":"Metabolomic Discoveries (acquired by Metabolon in September 2017)","LAST_NAME":"Kox","FIRST_NAME":"Matthijs","ADDRESS":"Intensive Care Medicine (710), Geert Grooteplein 10","EMAIL":"matthijs.kox@radboudumc.nl","PHONE":"243653881","NUM_GROUPS":"2","TOTAL_SUBJECTS":"24","NUM_MALES":"24"},

"SUBJECT":{"SUBJECT_TYPE":"Human","SUBJECT_SPECIES":"Homo sapiens","TAXONOMY_ID":"9606","AGE_OR_AGE_RANGE":"19-27","WEIGHT_OR_WEIGHT_RANGE":"58-92","HEIGHT_OR_HEIGHT_RANGE":"172-190","GENDER":"Male","HUMAN_RACE":"Caucasian","HUMAN_TRIAL_TYPE":"Prospective randomized open label controlled intervention study","HUMAN_MEDICATIONS":"None","HUMAN_PRESCRIPTION_OTC":"None","HUMAN_SMOKING_STATUS":"Non smoker","HUMAN_ALCOHOL_DRUG_USE":"Not in","HUMAN_NUTRITION":"Fasted for 12 hours before the first sample was obtained.","HUMAN_INCLUSION_CRITERIA":"Healthy (normal physical examination, electrocardiography, and routine laboratory values).","HUMAN_EXCLUSION_CRITERIA":"Febrile illness during the 2 weeks before the endotoxemia experiment, taking any prescription medication, history of spontaneous vagal collapse, practicing or experience with any kind of meditation, or participation in a previous trial where LPS was administered."},
"SUBJECT_SAMPLE_FACTORS":[
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"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"21","height (cm)":"180","weight  (kg)":"77.7"}
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{
"Subject ID":"17_41",
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},
{
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},
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{
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{
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"Subject ID":"17_40",
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{
"Subject ID":"17_14",
"Sample ID":"17_14 _t_minus_50",
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"Subject ID":"17_14",
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"Subject ID":"17_14",
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"Subject ID":"17_14",
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"Additional sample data":{"age (years)":"24","height (cm)":"177","weight  (kg)":"74.1"}
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"Subject ID":"17_14",
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"Additional sample data":{"age (years)":"24","height (cm)":"177","weight  (kg)":"74.1"}
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{
"Subject ID":"17_14",
"Sample ID":"17_14 _t_480",
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"Additional sample data":{"age (years)":"24","height (cm)":"177","weight  (kg)":"74.1"}
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{
"Subject ID":"17_23",
"Sample ID":"17_23 _t_minus_50",
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"Additional sample data":{"age (years)":"24","height (cm)":"172","weight  (kg)":"69.6"}
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"Subject ID":"17_23",
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"Subject ID":"17_23",
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"Subject ID":"17_23",
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"Subject ID":"17_01",
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"Subject ID":"17_01",
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{
"Subject ID":"17_01",
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"Subject ID":"17_34",
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{
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{
"Subject ID":"17_34",
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{
"Subject ID":"17_34",
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{
"Subject ID":"17_34",
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{
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"Subject ID":"17_29",
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{
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{
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{
"Subject ID":"17_29",
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},
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"Subject ID":"17_05",
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{
"Subject ID":"17_05",
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{
"Subject ID":"17_05",
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{
"Subject ID":"17_05",
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{
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{
"Subject ID":"17_05",
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"Subject ID":"17_20",
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{
"Subject ID":"17_20",
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{
"Subject ID":"17_20",
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{
"Subject ID":"17_20",
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"Additional sample data":{"age (years)":"25","height (cm)":"184","weight  (kg)":"72.3"}
},
{
"Subject ID":"17_20",
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"Additional sample data":{"age (years)":"25","height (cm)":"184","weight  (kg)":"72.3"}
},
{
"Subject ID":"17_20",
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"Additional sample data":{"age (years)":"25","height (cm)":"184","weight  (kg)":"72.3"}
},
{
"Subject ID":"17_13",
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},
{
"Subject ID":"17_13",
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"Additional sample data":{"age (years)":"20","height (cm)":"186","weight  (kg)":"78.5"}
},
{
"Subject ID":"17_13",
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},
{
"Subject ID":"17_13",
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},
{
"Subject ID":"17_13",
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"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"20","height (cm)":"186","weight  (kg)":"78.5"}
},
{
"Subject ID":"17_13",
"Sample ID":"17_13 _t_480",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"20","height (cm)":"186","weight  (kg)":"78.5"}
},
{
"Subject ID":"17_22",
"Sample ID":"17_22 _t_minus_50",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"186","weight  (kg)":"69.5"}
},
{
"Subject ID":"17_22",
"Sample ID":"17_22 _t_0",
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"Additional sample data":{"age (years)":"22","height (cm)":"186","weight  (kg)":"69.5"}
},
{
"Subject ID":"17_22",
"Sample ID":"17_22 _t_60",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"186","weight  (kg)":"69.5"}
},
{
"Subject ID":"17_22",
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"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"186","weight  (kg)":"69.5"}
},
{
"Subject ID":"17_22",
"Sample ID":"17_22 _t_240",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"186","weight  (kg)":"69.5"}
},
{
"Subject ID":"17_22",
"Sample ID":"17_22 _t_480",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"186","weight  (kg)":"69.5"}
},
{
"Subject ID":"17_30",
"Sample ID":"17_30 _t_minus_50",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"180","weight  (kg)":"64.5"}
},
{
"Subject ID":"17_30",
"Sample ID":"17_30 _t_0",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"180","weight  (kg)":"64.5"}
},
{
"Subject ID":"17_30",
"Sample ID":"17_30 _t_60",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"180","weight  (kg)":"64.5"}
},
{
"Subject ID":"17_30",
"Sample ID":"17_30 _t_120",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"180","weight  (kg)":"64.5"}
},
{
"Subject ID":"17_30",
"Sample ID":"17_30 _t_240",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"180","weight  (kg)":"64.5"}
},
{
"Subject ID":"17_30",
"Sample ID":"17_30 _t_480",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"22","height (cm)":"180","weight  (kg)":"64.5"}
},
{
"Subject ID":"17_10",
"Sample ID":"17_10 _t_minus_50",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"27","height (cm)":"190","weight  (kg)":"83"}
},
{
"Subject ID":"17_10",
"Sample ID":"17_10 _t_0",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"27","height (cm)":"190","weight  (kg)":"83"}
},
{
"Subject ID":"17_10",
"Sample ID":"17_10 _t_60",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"27","height (cm)":"190","weight  (kg)":"83"}
},
{
"Subject ID":"17_10",
"Sample ID":"17_10 _t_120",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"27","height (cm)":"190","weight  (kg)":"83"}
},
{
"Subject ID":"17_10",
"Sample ID":"17_10 _t_240",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"27","height (cm)":"190","weight  (kg)":"83"}
},
{
"Subject ID":"17_10",
"Sample ID":"17_10 _t_480",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"27","height (cm)":"190","weight  (kg)":"83"}
},
{
"Subject ID":"17_15",
"Sample ID":"17_15 _t_minus_50",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"22","height (cm)":"175","weight  (kg)":"58"}
},
{
"Subject ID":"17_15",
"Sample ID":"17_15 _t_0",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"22","height (cm)":"175","weight  (kg)":"58"}
},
{
"Subject ID":"17_15",
"Sample ID":"17_15 _t_60",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"22","height (cm)":"175","weight  (kg)":"58"}
},
{
"Subject ID":"17_15",
"Sample ID":"17_15 _t_120",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"22","height (cm)":"175","weight  (kg)":"58"}
},
{
"Subject ID":"17_15",
"Sample ID":"17_15 _t_240",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"22","height (cm)":"175","weight  (kg)":"58"}
},
{
"Subject ID":"17_15",
"Sample ID":"17_15 _t_480",
"Factors":{"treatment":"trained"},
"Additional sample data":{"age (years)":"22","height (cm)":"175","weight  (kg)":"58"}
},
{
"Subject ID":"17_08",
"Sample ID":"17_08_t_minus_50",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"26","height (cm)":"179","weight  (kg)":"75.6"}
},
{
"Subject ID":"17_08",
"Sample ID":"17_08_t_0",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"26","height (cm)":"179","weight  (kg)":"75.6"}
},
{
"Subject ID":"17_08",
"Sample ID":"17_08_t_60",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"26","height (cm)":"179","weight  (kg)":"75.6"}
},
{
"Subject ID":"17_08",
"Sample ID":"17_08_t_120",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"26","height (cm)":"179","weight  (kg)":"75.6"}
},
{
"Subject ID":"17_08",
"Sample ID":"17_08_t_240",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"26","height (cm)":"179","weight  (kg)":"75.6"}
},
{
"Subject ID":"17_08",
"Sample ID":"17_08_t_480",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"26","height (cm)":"179","weight  (kg)":"75.6"}
},
{
"Subject ID":"17_03",
"Sample ID":"17_03_t_minus_50",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"24","height (cm)":"189","weight  (kg)":"76"}
},
{
"Subject ID":"17_03",
"Sample ID":"17_03_t_0",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"24","height (cm)":"189","weight  (kg)":"76"}
},
{
"Subject ID":"17_03",
"Sample ID":"17_03_t_60",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"24","height (cm)":"189","weight  (kg)":"76"}
},
{
"Subject ID":"17_03",
"Sample ID":"17_03_t_120",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"24","height (cm)":"189","weight  (kg)":"76"}
},
{
"Subject ID":"17_03",
"Sample ID":"17_03_t_240",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"24","height (cm)":"189","weight  (kg)":"76"}
},
{
"Subject ID":"17_03",
"Sample ID":"17_03_t_480",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"24","height (cm)":"189","weight  (kg)":"76"}
},
{
"Subject ID":"17_09",
"Sample ID":"17_09_t_minus_50",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"27","height (cm)":"184","weight  (kg)":"90.5"}
},
{
"Subject ID":"17_09",
"Sample ID":"17_09_t_0",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"27","height (cm)":"184","weight  (kg)":"90.5"}
},
{
"Subject ID":"17_09",
"Sample ID":"17_09_t_120",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"27","height (cm)":"184","weight  (kg)":"90.5"}
},
{
"Subject ID":"17_09",
"Sample ID":"17_09_t_240",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"27","height (cm)":"184","weight  (kg)":"90.5"}
},
{
"Subject ID":"17_09",
"Sample ID":"17_09_t_480",
"Factors":{"treatment":"control"},
"Additional sample data":{"age (years)":"27","height (cm)":"184","weight  (kg)":"90.5"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"Ethylenediaminetetraacetic acid (EDTA) anti-coagulated blood was obtained one hour before LPS administration (baseline), and at T=0, T=1, T=2, T=4 and T=8 h. Blood was immediately centrifuged at 2000 g for 10 minutes at 4 °C after which plasma was stored at –80 °C until analysis.","SAMPLE_TYPE":"Blood (plasma)","COLLECTION_METHOD":"Arterial canulla","COLLECTION_LOCATION":"Radial artery","COLLECTION_FREQUENCY":"6","COLLECTION_DURATION":"1 minute","STORAGE_CONDITIONS":"-80℃","COLLECTION_VIALS":"Vacutainer blood collection tubes (BD)","STORAGE_VIALS":"Micronic vials (polypropylene)","COLLECTION_TUBE_TEMP":"Room temperature","ADDITIVES":"Ethylenediaminetetraacetic acid (EDTA)"},

"TREATMENT":{"TREATMENT_SUMMARY":"The subjects were randomly allocated to the trained group (n=12) or the control group (n=12) by the opening of sealed envelopes prepared by unblinded staff not involved in the study. The trained group underwent a 10-day training program provided by Dutch individual Wim Hof, which consisted of three main elements: meditation, exposure to cold, and breathing exercises (see https://www.pnas.org/content/111/20/7379.long for a detailed description). After completion of the training, subjects underwent experimental human endotoxemia at our intensive care research unit, consisting of administration of an intravenous bolus of 2 ng/kg of US Standard Reference Escherichia coli endotoxin (E. coli O:113 [LPS], Clinical Center Reference Endotoxin; National Institutes of Health, Bethesda, MD, USA). The experimental human endotoxemia protocol is provided in detail elsewhere (https://www.ncbi.nlm.nih.gov/pubmed/29936295; https://www.sciencedirect.com/science/article/pii/S0300908418301718?via%3Dihub). The control group did not undergo any training procedures and also underwent experimental human endotoxemia. Subjects in the trained group started practicing the breathing exercises acquired during the training program 30 minutes before LPS administration until two-and-a-half hours afterwards. The control group did not practice any techniques throughout the endotoxemia experiment. As described in detail elsewhere (https://www.pnas.org/content/111/20/7379.long), the breathing techniques consisted of two exercises. In brief, the first exercise comprised cycles of vigorous hyperventilation (approximately 30 breaths) followed by breath holding for several minutes at the discretion of the subject. The second exercise was similar, but at the end of the hyperventilation period, breath was only held for 10 seconds during all body muscles were tightened.","TREATMENT":"Nonpharmacological training intervention","TREATMENT_ROUTE":"n/a.","TREATMENT_DOSE":"n/a.","TREATMENT_DOSEVOLUME":"n/a.","TREATMENT_DOSEDURATION":"10 days","TREATMENT_VEHICLE":"control group","HUMAN_FASTING":"Yes, 12 hours before obtaining the first sample.","TREATMENT_COMPOUND":"n/a."},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"Sample extraction was performed as described previously (https://journals.plos.org/plosone/article?id=10.1371/journal.pone.0154597), with some modifications. Briefly, 50 µL of plasma was mixed with 450 µL of 90% (v/v) methanol containing internal standards and incubated for 15 min at 37°C with 1150 rpm. Precipitated proteins were separated from the extract by centrifugation for 12 min at 15000 rpm, after which supernatants were stored at -80 °C until further analysis.","PROCESSING_STORAGE_CONDITIONS":"-80℃","EXTRACTION_METHOD":"Ethanol precipitation"},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_TYPE":"Reversed phase","INSTRUMENT_NAME":"Agilent 1290","COLUMN_NAME":"Discovery HS F5-3 column (15 cm x 2.1 mm, 3 µm, Supelco, Sigma Aldrich)","FLOW_GRADIENT":"5% B from 0-0.1min to 35% B at 1.5 min, to 95% B at 2.05 min which was kept constant until 3.2 min, to 5% B at 3.21 min and washing until 4.3 min with 5% B.","FLOW_RATE":"The flow rate was kept constant at 700 µL/min from 0 min to 2.2 min, and increased up to 900 µL/min from 2.2 min to 2.5 min, after which flow rate was kept constant until 3.2 min.The flow rate was decreased from 900 µL/min to 800 µL/min from 3.2 min to 3.1 min and kept constant until 3.7 min, when flow rate was changed to 700 µL/min.","SOLVENT_A":"95% 10 mM ammonium formate with 0.1% formic acid and 5% acetonitrile","SOLVENT_B":"and 95% acetonitrile with 5% 10 mM ammonium formate with 0.1% formic acid","INJECTION_TEMPERATURE":"40 °C"},

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

"MS":{"INSTRUMENT_NAME":"Agilent 6540 QTOF","INSTRUMENT_TYPE":"QTOF","MS_TYPE":"ESI","ION_MODE":"UNSPECIFIED","MS_COMMENTS":"The 6540 QTOF/MS Detector (Agilent) operated in both positive and negative ESI mode in a detection range of 50 to 1700 m/z at 2 GHz in extended dynamic range. The DualAJS ESI source was set to the following parameters: Gas temperature 200 °C, drying gas 8 L/min, nebulizer 35 psig, sheath gas temp: 350 °C, sheath gas flow 11 L/min, VCAp 3500 V and nozzle voltage of 0 V. Online calibration of the instrument was performed throughout the data acquisition using Agilent ES-TOF Reference Mass Solution Kit. Chromatograms were generated by the LC-MS instrument in .d format. Raw data were converted into mzXML and chromatogram peaks were extracted using XCMS v1.42.0 (https://pubs.acs.org/doi/10.1021/ac051437y), which was optimized using the IPO R package (https://bmcbioinformatics.biomedcentral.com/articles/10.1186/s12859-015-0562-8) with the following settings: peakwidth=c(10, 70), ppm= 20, snthresh=10, mzdiff=0.0034, prefilter=c(3, 100), noise=100, gapInit=0.8448, gapExtend=2.0544, bw=5, mzwid=0.015, minfrac=0.5, max=50. All further analyses were performed in R programming language, Metaboanalyst 4.0 (https://www.nature.com/articles/nprot.2011.319), and GraphPad Prism version 5.0 (GraphPad Software). IDEOM software (http://mzmatch.sourceforge.net/ideom.php; https://academic.oup.com/bioinformatics/article/28/7/1048/210126) was used to eliminate noise and for putative peak annotation by exact mass within ±10 ppm against the Metabolomic Discoveries in house metabolite library (https://journals.plos.org/plosone/article?id=10.1371/journal.pone.0125044) in negative and positive ESI mode, respectively. Retention time prediction was applied to aid metabolite annotation."},

"MS_METABOLITE_DATA":{
"Units":"relative abundance",

"Data":[{"Metabolite":"Creatinine","17_41 _t_minus_50":"0.388","17_41 _t_0":"0.366","17_41 _t_60":"0.393","17_41 _t_120":"0.373","17_41 _t_240":"0.390","17_41 _t_480":"0.395","17_42 _t_minus_50":"0.751","17_42 _t_0":"0.699","17_42 _t_60":"0.663","17_42 _t_120":"0.659","17_42 _t_240":"0.653","17_42 _t_480":"0.642","17_36 _t_minus_50":"0.552","17_36 _t_0":"0.508","17_36 _t_60":"0.526","17_36 _t_120":"0.434","17_36 _t_240":"0.462","17_36 _t_480":"0.481","17_35 _t_minus_50":"0.557","17_35 _t_0":"0.508","17_35 _t_120":"0.597","17_35 _t_240":"0.575","17_40 _t_0":"0.613","17_40 _t_60":"0.796","17_40 _t_120":"0.522","17_40 _t_240":"0.496","17_40 _t_480":"0.520","17_14 _t_minus_50":"0.775","17_14 _t_0":"0.698","17_14 _t_60":"0.667","17_14 _t_120":"0.671","17_14 _t_240":"0.666","17_14 _t_480":"0.711","17_23 _t_minus_50":"0.577","17_23 _t_60":"0.506","17_23 _t_120":"0.530","17_23 _t_240":"0.495","17_23 _t_480":"0.501","17_33 _t_minus_50":"0.468","17_33 _t_0":"0.468","17_33 _t_60":"0.507","17_33 _t_120":"0.453","17_33 _t_240":"0.493","17_33 _t_480":"0.439","17_02 _t_minus_50":"0.460","17_02 _t_0":"0.445","17_02 _t_60":"0.418","17_02 _t_120":"0.469","17_02 _t_240":"0.450","17_02 _t_480":"0.450","17_27 _t_minus_50":"0.428","17_27 _t_0":"0.508","17_27 _t_60":"0.415","17_27 _t_120":"0.479","17_27 _t_240":"0.476","17_27 _t_480":"0.489","17_21 _t_0":"0.525","17_21 _t_60":"0.527","17_21 _t_120":"0.558","17_21 _t_240":"0.557","17_21 _t_480":"0.474","17_01 _t_minus_50":"0.519","17_01 _t_0":"0.452","17_01 _t_60":"0.439","17_01 _t_120":"0.508","17_01 _t_240":"0.499","17_01 _t_480":"0.508","17_34 _t_minus_50":"0.601","17_34 _t_0":"0.632","17_34 _t_60":"0.642","17_34 _t_120":"0.607","17_34 _t_240":"0.600","17_34 _t_480":"0.659","17_29 _t_minus_50":"0.570","17_29 _t_0":"0.538","17_29 _t_60":"0.543","17_29 _t_120":"0.507","17_29 _t_240":"0.535","17_29 _t_480":"0.608","17_05 _t_minus_50":"0.500","17_05 _t_0":"0.456","17_05 _t_60":"0.458","17_05 _t_120":"0.451","17_05 _t_240":"0.484","17_05 _t_480":"0.468","17_20 _t_minus_50":"0.547","17_20 _t_0":"0.549","17_20 _t_60":"0.540","17_20 _t_120":"0.496","17_20 _t_240":"0.506","17_20 _t_480":"0.554","17_13 _t_minus_50":"0.742","17_13 _t_0":"0.628","17_13 _t_60":"0.579","17_13 _t_120":"0.606","17_13 _t_240":"0.600","17_13 _t_480":"0.561","17_22 _t_minus_50":"0.392","17_22 _t_0":"0.411","17_22 _t_60":"0.395","17_22 _t_120":"0.392","17_22 _t_240":"0.420","17_22 _t_480":"0.402","17_30 _t_minus_50":"0.377","17_30 _t_0":"0.372","17_30 _t_60":"0.453","17_30 _t_120":"0.455","17_30 _t_240":"0.512","17_30 _t_480":"0.402","17_10 _t_minus_50":"0.490","17_10 _t_0":"0.443","17_10 _t_60":"0.449","17_10 _t_120":"0.492","17_10 _t_240":"0.521","17_10 _t_480":"0.476","17_15 _t_minus_50":"0.337","17_15 _t_0":"0.367","17_15 _t_60":"0.382","17_15 _t_120":"0.408","17_15 _t_240":"0.414","17_15 _t_480":"0.382","17_08_t_minus_50":"0.515","17_08_t_0":"0.433","17_08_t_60":"0.472","17_08_t_120":"0.612","17_08_t_240":"0.465","17_08_t_480":"0.488","17_03_t_minus_50":"0.627","17_03_t_0":"0.490","17_03_t_60":"0.562","17_03_t_120":"0.591","17_03_t_240":"0.565","17_03_t_480":"0.582","17_09_t_minus_50":"0.650","17_09_t_0":"0.486","17_09_t_120":"0.462","17_09_t_240":"0.518","17_09_t_480":"0.522"},{"Metabolite":"Deoxycytidine","17_41 _t_minus_50":"0.000","17_41 _t_0":"0.000","17_41 _t_60":"0.000","17_41 _t_120":"0.000","17_41 _t_240":"0.014","17_41 _t_480":"0.000","17_42 _t_minus_50":"0.000","17_42 _t_0":"0.000","17_42 _t_60":"0.000","17_42 _t_120":"0.001","17_42 _t_240":"0.010","17_42 _t_480":"0.003","17_36 _t_minus_50":"0.004","17_36 _t_0":"0.014","17_36 _t_60":"0.012","17_36 _t_120":"0.001","17_36 _t_240":"0.018","17_36 _t_480":"0.007","17_35 _t_minus_50":"0.000","17_35 _t_0":"0.028","17_35 _t_120":"0.001","17_35 _t_240":"0.025","17_40 _t_0":"0.000","17_40 _t_60":"0.001","17_40 _t_120":"0.000","17_40 _t_240":"0.000","17_40 _t_480":"0.001","17_14 _t_minus_50":"0.000","17_14 _t_0":"0.030","17_14 _t_60":"0.022","17_14 _t_120":"0.005","17_14 _t_240":"0.003","17_14 _t_480":"0.115","17_23 _t_minus_50":"0.017","17_23 _t_60":"0.129","17_23 _t_120":"0.061","17_23 _t_240":"0.009","17_23 _t_480":"0.026","17_33 _t_minus_50":"0.021","17_33 _t_0":"0.019","17_33 _t_60":"0.050","17_33 _t_120":"0.000","17_33 _t_240":"0.003","17_33 _t_480":"0.007","17_02 _t_minus_50":"0.000","17_02 _t_0":"0.000","17_02 _t_60":"0.000","17_02 _t_120":"0.012","17_02 _t_240":"0.001","17_02 _t_480":"0.002","17_27 _t_minus_50":"0.000","17_27 _t_0":"0.013","17_27 _t_60":"0.006","17_27 _t_120":"0.017","17_27 _t_240":"0.007","17_27 _t_480":"0.016","17_21 _t_0":"0.012","17_21 _t_60":"0.047","17_21 _t_120":"0.037","17_21 _t_240":"0.024","17_21 _t_480":"0.005","17_01 _t_minus_50":"0.014","17_01 _t_0":"0.016","17_01 _t_60":"0.025","17_01 _t_120":"0.030","17_01 _t_240":"0.050","17_01 _t_480":"0.007","17_34 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ID":"C08512","HMDB ID":"","Map":"Unknown"},{"Metabolite":"1-Pyrrolinium","KEGG ID":"","HMDB ID":"HMDB60246","Map":"Pyrrolines"},{"Metabolite":"3'-O-Methyladenosine","KEGG ID":"","HMDB ID":"HMDB06023","Map":"Nucleosids, Nucleotids and Derivatives"},{"Metabolite":"Probenecid","KEGG ID":"C07372","HMDB ID":"HMDB15166","Map":"Benzoic Acid and Derivatives"},{"Metabolite":"1,6-Naphthalenedisulfonic acid","KEGG ID":"C16193","HMDB ID":"","Map":"Xenobiotics Biodegradation and Metabolism"},{"Metabolite":"Pyrrolidine","KEGG ID":"","HMDB ID":"HMDB31641","Map":"Pyrrolidines"},{"Metabolite":"D-Sedoheptulose 7-phosphate","KEGG ID":"C00281","HMDB ID":"HMDB01068","Map":"Disaccharides"},{"Metabolite":"1-Octen-3-yl glucoside","KEGG ID":"","HMDB ID":"HMDB32959","Map":"Alkyl Glycosides"},{"Metabolite":"5-Hexyltetrahydro-2-furanoctanoic acid","KEGG ID":"","HMDB ID":"HMDB31127","Map":"Eicosanoids"},{"Metabolite":"4'-Methoxy-2',3,7-trihydroxyisoflavanone","KEGG ID":"","HMDB ID":"HMDB41673","Map":"Flavonoids"},{"Metabolite":"L-Cyclo(alanylglycyl)","KEGG ID":"","HMDB ID":"HMDB31547","Map":"Piperazines"},{"Metabolite":"Narciclasine","KEGG ID":"C08533","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Pipecolic acid","KEGG ID":"C00408","HMDB ID":"HMDB00070","Map":"Amino Acids and Derivatives"},{"Metabolite":"5-Ethoxy-4,5-dihydro-2(3H)furanone","KEGG ID":"","HMDB ID":"HMDB31214","Map":"Lactones"},{"Metabolite":"Niclosamide","KEGG ID":"","HMDB ID":"HMDB15679","Map":"Anilides"},{"Metabolite":"Moracin","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"2,2,4-Trimethyl-3-(4-fluorophenyl)-2H-1-benzopyran-7-ol acetate","KEGG ID":"C15056","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Creatine","KEGG ID":"C00300","HMDB ID":"HMDB00064","Map":"Amino Acids and Derivatives"},{"Metabolite":"Lysyl-Tryptophan","KEGG ID":"","HMDB ID":"HMDB28962","Map":"Peptides"},{"Metabolite":"[FA hydroxy(4:0)] 1,9S,11R,15S-tetrahydroxy-13E-prostaene","KEGG ID":"","HMDB ID":"","Map":"Fatty Acyls"},{"Metabolite":"Prostaglandin F1a","KEGG ID":"C06475","HMDB ID":"HMDB02685","Map":"Eicosanoids"},{"Metabolite":"[PR trimethyl,methyl,methyl(5:0/15:0)] 2,6,14-trimethyl-6,7-epoxy-10-methylene-9-(3-methylpent-4-enyl)-pentadec-2-ene","KEGG ID":"","HMDB ID":"","Map":"Prenols"},{"Metabolite":"N-[2-(4-Chloro-phenyl)-acetyl]-N'-(4,7-dimethyl-quinazolin-2-yl)- guanidine","KEGG ID":"C11562","HMDB ID":"","Map":"Unknown"},{"Metabolite":"3-O-Caffeoyl-4-O-methylquinic acid","KEGG ID":"","HMDB ID":"HMDB39960","Map":"Cyclic Alcohols and Derivatives"},{"Metabolite":"Kanzonol R","KEGG ID":"","HMDB ID":"HMDB41099","Map":"Flavonoids"},{"Metabolite":"[6]-Gingerdiol 3,5-diacetate","KEGG ID":"","HMDB ID":"HMDB40568","Map":"Phenols and Derivatives"},{"Metabolite":"Erucicoyl-EA","KEGG ID":"","HMDB ID":"","Map":"Fatty Acyls"},{"Metabolite":"Artonin K","KEGG ID":"","HMDB ID":"HMDB40673","Map":"Flavonoids"},{"Metabolite":"Trihydroxy-3,6,7,4'-tetramethoxyflavone","KEGG ID":"","HMDB ID":"","Map":"Polyketides"},{"Metabolite":"3-Amino-1,2,4-triazole","KEGG ID":"C11261","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Proline betaine","KEGG ID":"C10172","HMDB ID":"HMDB04827","Map":"Pyrrolidines"},{"Metabolite":"Piperidine","KEGG ID":"C01746","HMDB ID":"HMDB34301","Map":"Piperidines"},{"Metabolite":"hydroxymethyl-dCDP","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"FA amino(7:0) aminoheptanoic acid","KEGG ID":"","HMDB ID":"","Map":"Fatty Acyls"},{"Metabolite":"Glutamine","KEGG ID":"C00064","HMDB ID":"","Map":"Amino Acids and Derivatives"},{"Metabolite":"2,3-Dimethylbenzofuran","KEGG ID":"","HMDB ID":"HMDB33176","Map":"Cinnamaldehydes"},{"Metabolite":"Sorbitan stearate","KEGG ID":"","HMDB ID":"HMDB29888","Map":"Monosaccharides"},{"Metabolite":"6-Hydroxyluteolin 6-xyloside","KEGG ID":"","HMDB ID":"HMDB37595","Map":"Flavonoids"},{"Metabolite":"6-Deoxodolichosterone","KEGG ID":"","HMDB ID":"HMDB34332","Map":"Steroids and Steroid Derivatives"},{"Metabolite":"Pyruvic acid","KEGG ID":"C00022","HMDB ID":"HMDB00243","Map":"Keto-Acids and Derivatives"},{"Metabolite":"Deoxyuridine triphosphate","KEGG ID":"C00460","HMDB ID":"HMDB01191","Map":"Nucleosids, Nucleotids and Derivatives"},{"Metabolite":"Camelliagenin A","KEGG ID":"","HMDB ID":"HMDB34528","Map":"Prenol Lipids"},{"Metabolite":"(2alpha,3alpha,5alpha,22R,23R)-2,3,22,23-Tetrahydroxy-25-methylergost-24(28)en-6-one","KEGG ID":"","HMDB ID":"HMDB39443","Map":"Steroids and Steroid Derivatives"},{"Metabolite":"LysoPE(18:0/0:0)","KEGG ID":"","HMDB ID":"HMDB11130","Map":"Glycerophospholipids"},{"Metabolite":"Oxolucidine B","KEGG ID":"C09891","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Prenol 30,32-dihydroxy-2b-methyl-bishomohopane","KEGG ID":"","HMDB ID":"","Map":"Prenols"},{"Metabolite":"Lumequoylacetone","KEGG ID":"","HMDB ID":"HMDB35956","Map":"Carbonyl Compounds"},{"Metabolite":"LysoPC(16:0)","KEGG ID":"C04230","HMDB ID":"HMDB10382","Map":"Glycerophospholipids"},{"Metabolite":"L-Histidine","KEGG ID":"C00135","HMDB ID":"HMDB00177","Map":"Amino Acids and Derivatives"},{"Metabolite":"Lactic acid","KEGG ID":"C00186","HMDB ID":"","Map":"Hydroxy Acids and Derivatives"},{"Metabolite":"1,2,4,8-Tetraacetoxy-7-hydroxy-3-(4-hydroxyphenyl)dibenzofuran","KEGG ID":"","HMDB ID":"HMDB34700","Map":"Benzofurans"},{"Metabolite":"LysoPE(20:0/0:0)","KEGG ID":"","HMDB ID":"HMDB11511","Map":"Glycerophospholipids"},{"Metabolite":"Didodecyl thiobispropanoate","KEGG ID":"","HMDB ID":"HMDB40172","Map":"Fatty Acids and Conjugates"},{"Metabolite":"LysoPC(18:2(9Z,12Z))","KEGG ID":"C04230","HMDB ID":"HMDB10386","Map":"Glycerophospholipids"},{"Metabolite":"Epoxymurin B","KEGG ID":"","HMDB ID":"HMDB40922","Map":"Dihydrofurans"},{"Metabolite":"[FA amino(8:0)] 3-amino-octanoic acid","KEGG ID":"","HMDB ID":"","Map":"Amino Acids and Derivatives"},{"Metabolite":"LysoPC(20:5(5Z,8Z,11Z,14Z,17Z))","KEGG ID":"C04230","HMDB ID":"HMDB10397","Map":"Glycerophospholipids"},{"Metabolite":"LysoPC(20:4(8Z,11Z,14Z,17Z))","KEGG ID":"C04230","HMDB ID":"HMDB10396","Map":"Glycerophospholipids"},{"Metabolite":"L-Carnitine","KEGG ID":"C15025","HMDB ID":"HMDB00062","Map":"Alkylamines"},{"Metabolite":"PS(21:0/0:0)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Cer(d18:0/20:0)","KEGG ID":"","HMDB ID":"HMDB11764","Map":"Sphingolipids"},{"Metabolite":"Gnidicin","KEGG ID":"C09095","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Uric acid","KEGG ID":"C00366","HMDB ID":"HMDB00289","Map":"Imidazopyrimidines"},{"Metabolite":"Cer(d18:1/24:1(15Z))","KEGG ID":"C00195","HMDB ID":"HMDB04953","Map":"Sphingolipids"},{"Metabolite":"N-(2-hydroxytetracosanoyl)-4,8-sphingadienine","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"PE(P-18:1(9Z)/14:1(9Z))","KEGG ID":"","HMDB ID":"HMDB11435","Map":"Glycerophospholipids"},{"Metabolite":"PE(P-18:1(9Z)/14:0)","KEGG ID":"","HMDB ID":"HMDB11434","Map":"Glycerophospholipids"},{"Metabolite":"Hymenocardine","KEGG ID":"C10004","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Bruceoside A","KEGG ID":"C08753","HMDB ID":"","Map":"Unknown"},{"Metabolite":"SM(d33:1)","KEGG ID":"","HMDB ID":"","Map":"Sphingolipids"},{"Metabolite":"Spirolide B","KEGG ID":"","HMDB ID":"HMDB30492","Map":"Azepines"},{"Metabolite":"SM(d34:2)","KEGG ID":"","HMDB ID":"","Map":"Sphingolipids"},{"Metabolite":"SM(d18:0/16:1(9Z))","KEGG ID":"C00550","HMDB ID":"HMDB13464","Map":"Sphingolipids"},{"Metabolite":"[ST (20:4)] cholest-5-en-3beta-yl (15S-hydroperoxy-5Z,8Z,12E,14Z-eicosatetraenoate)","KEGG ID":"","HMDB ID":"","Map":"Sterol Lipids"},{"Metabolite":"PE-NMe(16:0/16:0)","KEGG ID":"","HMDB ID":"HMDB10567","Map":"Glycerophospholipids"},{"Metabolite":"SM(d18:0/16:0)","KEGG ID":"C00550","HMDB ID":"HMDB10168","Map":"Sphingolipids"},{"Metabolite":"TG(41:0)","KEGG ID":"","HMDB ID":"","Map":"Glycerolipids"},{"Metabolite":"DG(43:5)","KEGG ID":"","HMDB ID":"","Map":"Glycerolipids"},{"Metabolite":"Tin chloride (SnCl4)","KEGG ID":"","HMDB ID":"HMDB36546","Map":"Post-transition Metal Salts"},{"Metabolite":"PG(16:0/16:0)","KEGG ID":"","HMDB ID":"HMDB10570","Map":"Glycerophospholipids"},{"Metabolite":"PE(P-18:1(9Z)/18:3(6Z,9Z,12Z))","KEGG ID":"","HMDB ID":"HMDB11443","Map":"Glycerophospholipids"},{"Metabolite":"SM(d18:1/18:1(11Z))","KEGG ID":"C00550","HMDB ID":"HMDB12100","Map":"Sphingolipids"},{"Metabolite":"PE(20:2(11Z,14Z)/15:0)","KEGG ID":"C00350","HMDB ID":"HMDB09285","Map":"Glycerophospholipids"},{"Metabolite":"PE(18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z))","KEGG ID":"C00350","HMDB ID":"HMDB09195","Map":"Glycerophospholipids"},{"Metabolite":"PE-NMe(16:0/18:1(9Z))","KEGG ID":"","HMDB ID":"HMDB10569","Map":"Glycerophospholipids"},{"Metabolite":"PC(P-18:0/15:0)","KEGG ID":"","HMDB ID":"HMDB11238","Map":"Glycerophospholipids"},{"Metabolite":"N-desmethylclarithromycin","KEGG ID":"","HMDB ID":"HMDB61020","Map":"Macrolides and Analogues"},{"Metabolite":"PC(16:0/16:0)","KEGG ID":"C00157","HMDB ID":"HMDB00564","Map":"Glycerophospholipids"},{"Metabolite":"Stenopalustroside A","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"PC(o-16:1(9Z)/18:2(9Z,12Z))","KEGG ID":"","HMDB ID":"HMDB13413","Map":"Glycerophospholipids"},{"Metabolite":"Hordatine B glucoside","KEGG ID":"","HMDB ID":"HMDB30460","Map":"Glycosyl Compounds"},{"Metabolite":"PC(O-16:0/18:2(9Z,12Z))","KEGG ID":"","HMDB ID":"HMDB11151","Map":"Glycerophospholipids"},{"Metabolite":"PE(P-18:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z))","KEGG ID":"","HMDB ID":"HMDB11453","Map":"Glycerophospholipids"},{"Metabolite":"PE(P-18:1(9Z)/20:4(8Z,11Z,14Z,17Z))","KEGG ID":"","HMDB ID":"HMDB11452","Map":"Glycerophospholipids"},{"Metabolite":"Arginine","KEGG ID":"C00062","HMDB ID":"","Map":"Amino Acids and Derivatives"},{"Metabolite":"PC(14:1(9Z)/20:2(11Z,14Z))","KEGG ID":"C00157","HMDB ID":"HMDB07913","Map":"Glycerophospholipids"},{"Metabolite":"PE-NMe(18:1(9Z)/18:1(9Z))","KEGG ID":"","HMDB ID":"HMDB10565","Map":"Glycerophospholipids"},{"Metabolite":"7-methylthioheptanaldoxime","KEGG ID":"C17249","HMDB ID":"","Map":"Unknown"},{"Metabolite":"carboxynorspermidine","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"PE(22:1(13Z)/15:0)","KEGG ID":"C00350","HMDB ID":"HMDB09516","Map":"Glycerophospholipids"},{"Metabolite":"PE(15:0/22:0)","KEGG ID":"C00350","HMDB ID":"HMDB08907","Map":"Glycerophospholipids"},{"Metabolite":"PG(O-36:1)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PE(18:4(6Z,9Z,12Z,15Z)/20:2(11Z,14Z))","KEGG ID":"C00350","HMDB ID":"HMDB09198","Map":"Glycerophospholipids"},{"Metabolite":"PE(22:5(7Z,10Z,13Z,16Z,19Z)/16:0)","KEGG ID":"C00350","HMDB ID":"HMDB09649","Map":"Glycerophospholipids"},{"Metabolite":"PC(o-16:1(9Z)/20:4(8Z,11Z,14Z,17Z))","KEGG ID":"","HMDB ID":"HMDB13415","Map":"Glycerophospholipids"},{"Metabolite":"PC(o-18:2(9Z,12Z)/18:2(9Z,12Z))","KEGG ID":"","HMDB ID":"HMDB13435","Map":"Glycerophospholipids"},{"Metabolite":"PE(18:3(6Z,9Z,12Z)/20:0)","KEGG ID":"C00350","HMDB ID":"HMDB09130","Map":"Glycerophospholipids"},{"Metabolite":"PC(o-18:1(11Z)/18:2(9Z,12Z))","KEGG ID":"","HMDB ID":"HMDB13425","Map":"Glycerophospholipids"},{"Metabolite":"Phosphatidyl glycerophosphate (O-42:2)","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"PE-NMe2(18:1(9Z)/18:1(9Z))","KEGG ID":"","HMDB ID":"HMDB10564","Map":"Organic Phosphoric Acids and Derivatives"},{"Metabolite":"PS(35:0)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PC(14:1(9Z)/22:4(7Z,10Z,13Z,16Z))","KEGG ID":"C00157","HMDB ID":"HMDB07922","Map":"Glycerophospholipids"},{"Metabolite":"PC(18:2(9Z,12Z)/18:2(9Z,12Z))","KEGG ID":"C00157","HMDB ID":"HMDB08138","Map":"Glycerophospholipids"},{"Metabolite":"PC(14:1(9Z)/22:2(13Z,16Z))","KEGG ID":"C00157","HMDB ID":"HMDB07921","Map":"Glycerophospholipids"},{"Metabolite":"PC(18:1(9Z)/18:1(9Z))","KEGG ID":"C00157","HMDB ID":"HMDB00593","Map":"Glycerophospholipids"},{"Metabolite":"PE(24:1(15Z)/15:0)","KEGG ID":"C00350","HMDB ID":"HMDB09747","Map":"Glycerophospholipids"},{"Metabolite":"PC(o-16:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z))","KEGG ID":"","HMDB ID":"HMDB13409","Map":"Glycerophospholipids"},{"Metabolite":"1-18:2-2-18:3-monogalactosyldiacylglycerol","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"PC(o-18:1(9Z)/20:4(8Z,11Z,14Z,17Z))","KEGG ID":"","HMDB ID":"HMDB13432","Map":"Glycerophospholipids"},{"Metabolite":"PC(o-18:0/20:4(8Z,11Z,14Z,17Z))","KEGG ID":"","HMDB ID":"HMDB13420","Map":"Glycerophospholipids"},{"Metabolite":"Glucose","KEGG ID":"","HMDB ID":"","Map":"Monosaccharides"},{"Metabolite":"PE(18:3(6Z,9Z,12Z)/22:0)","KEGG ID":"C00350","HMDB ID":"HMDB09138","Map":"Glycerophospholipids"},{"Metabolite":"N-(2-hydroxy-tetracosanoyl)-1-beta-glucosyl-4E,6E-hexadecasphingadienine","KEGG ID":"","HMDB ID":"","Map":"Sphingolipids"},{"Metabolite":"Luteolin 7,4'-diglucuronide-3'-glucoside","KEGG ID":"","HMDB ID":"","Map":"Polyketides"},{"Metabolite":"PC(18:4(6Z,9Z,12Z,15Z)/20:4(8Z,11Z,14Z,17Z))","KEGG ID":"C00157","HMDB ID":"HMDB08247","Map":"Glycerophospholipids"},{"Metabolite":"PS(37:2)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PC(18:3(6Z,9Z,12Z)/20:3(8Z,11Z,14Z))","KEGG ID":"C00157","HMDB ID":"HMDB08179","Map":"Glycerophospholipids"},{"Metabolite":"PC(20:3(8Z,11Z,14Z)/18:2(9Z,12Z))","KEGG ID":"C00157","HMDB ID":"HMDB08402","Map":"Glycerophospholipids"},{"Metabolite":"PC(18:2(9Z,12Z)/20:2(11Z,14Z))","KEGG ID":"C00157","HMDB ID":"HMDB08145","Map":"Glycerophospholipids"},{"Metabolite":"PC(22:2(13Z,16Z)/16:1(9Z))","KEGG ID":"C00157","HMDB ID":"HMDB08594","Map":"Glycerophospholipids"},{"Metabolite":"PC(18:1(9Z)/20:1(11Z))","KEGG ID":"C00157","HMDB ID":"HMDB08110","Map":"Glycerophospholipids"},{"Metabolite":"PC(P-18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))","KEGG ID":"","HMDB ID":"HMDB11295","Map":"Glycerophospholipids"},{"Metabolite":"PC(P-18:1(11Z)/22:5(7Z,10Z,13Z,16Z,19Z))","KEGG ID":"","HMDB ID":"HMDB11294","Map":"Glycerophospholipids"},{"Metabolite":"PS(P-39:0)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Glycerophosphocholine (38:6)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PI(O-20:0/14:1(9Z))","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PS(39:4)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Succinic acid semialdehyde","KEGG ID":"C00232","HMDB ID":"HMDB01259","Map":"Fatty Acids and Conjugates"},{"Metabolite":"Glycerophosphocholine (40:6)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PI(16:1(9Z)/18:1(11Z))","KEGG ID":"C00626","HMDB ID":"HMDB09800","Map":"Glycerophospholipids"},{"Metabolite":"PC(20:3(8Z,11Z,14Z)/20:2(11Z,14Z))","KEGG ID":"C00157","HMDB ID":"HMDB08407","Map":"Glycerophospholipids"},{"Metabolite":"PC(20:3(8Z,11Z,14Z)/20:1(11Z))","KEGG ID":"","HMDB ID":"HMDB11201","Map":"Glycerophospholipids"},{"Metabolite":"PI(O-36:2)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PG(42:6)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PS(41:4)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Propanoylagmatine","KEGG ID":"C02581","HMDB ID":"","Map":"Unknown"},{"Metabolite":"PS(41:2)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"N(6)-Trimethyl-L-lysine","KEGG ID":"","HMDB ID":"","Map":"Amino Acids and Derivatives"},{"Metabolite":"PI (36:0)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"PI(18:2(9Z,12Z)/20:1(11Z))","KEGG ID":"C00626","HMDB ID":"HMDB09852","Map":"Glycerophospholipids"},{"Metabolite":"Isocitric acid","KEGG ID":"C00311","HMDB ID":"HMDB00193","Map":"Carboxylic Acids and Derivatives"},{"Metabolite":"Phosphocreatinine","KEGG ID":"","HMDB ID":"HMDB41624","Map":"Organic Phosphoric Acids and Derivatives"},{"Metabolite":"Tartronate semialdehyde","KEGG ID":"C01146","HMDB ID":"HMDB06938","Map":"Hydroxy Acids and Derivatives"},{"Metabolite":"TG(15:0/20:0/20:0)","KEGG ID":"","HMDB ID":"HMDB43079","Map":"Glycerolipids"},{"Metabolite":"4-Hydroxybutyric acid","KEGG ID":"C00989","HMDB ID":"HMDB00710","Map":"Hydroxy Acids and Derivatives"},{"Metabolite":"Xanthine-8-carboxylate","KEGG ID":"C03314","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Glycerophosphoinositol (41:6)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Glyceric acid","KEGG ID":"C00258","HMDB ID":"HMDB00139","Map":"Sugar Acids and Derivatives"},{"Metabolite":"2-Hydroxyundecanoate","KEGG ID":"","HMDB ID":"HMDB59736","Map":"Hydroxy Acids and Derivatives"},{"Metabolite":"cis-(homo)2aconitate","KEGG ID":"","HMDB ID":"","Map":"Metabolism of Cofactors and Vitamins"},{"Metabolite":"N3-fumaramoyl-L-2,3-diaminopropanoate","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Dimethylarginine","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"L-Acetylcarnitine","KEGG ID":"C02571","HMDB ID":"HMDB00201","Map":"Fatty Acid Esters"},{"Metabolite":"Epimedin K","KEGG ID":"","HMDB ID":"","Map":"Polyketides"},{"Metabolite":"Triradylglycero (60:5)","KEGG ID":"","HMDB ID":"","Map":"Glycerolipids"},{"Metabolite":"Triradylglycerol (61:8)","KEGG ID":"","HMDB ID":"","Map":"Glycerolipids"},{"Metabolite":"CDP-DG(16:0/20:4(5Z,8Z,11Z,14Z))","KEGG ID":"","HMDB ID":"HMDB06973","Map":"Glycerophospholipids"},{"Metabolite":"CDP-Glycerophospholipid (18:1(9Z)/18:2(9Z,12Z))","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Glycerophosphocholine (52:4)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"CDP-Glycerophospholipid (38:6)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"CDP-Glycerophospholipid (38:5)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"CDP-Glycerophospholipid (38:4)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Dehydrotomatine","KEGG ID":"","HMDB ID":"HMDB32002","Map":"Prenol Lipids"},{"Metabolite":"Triradylglycerol (65:6)","KEGG ID":"","HMDB ID":"","Map":"Glycerolipids"},{"Metabolite":"Galactaric acid","KEGG ID":"C00879","HMDB ID":"HMDB00639","Map":"Sugar Acids and Derivatives"},{"Metabolite":"Sedoheptulose","KEGG ID":"C02076","HMDB ID":"HMDB03219","Map":"Monosaccharides"},{"Metabolite":"Kaempferol 3-rhamnosyl-(1->2)-[glucosyl-(1->3)-(4'''-p-coumaroylrhamnosyl)-(1->6)-galactoside]","KEGG ID":"","HMDB ID":"","Map":"Polyketides"},{"Metabolite":"CDP-Glycerophospholipid(40:6)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Glycerophosphoserine (55:0)","KEGG ID":"","HMDB ID":"","Map":"Glycerophospholipids"},{"Metabolite":"Beta-1,4-D-Mannosylchitobiosyldiphosphodolichol","KEGG ID":"C05860","HMDB ID":"HMDB11673","Map":"Prenol Lipids"},{"Metabolite":"Phosphocreatine","KEGG ID":"C02305","HMDB ID":"HMDB01511","Map":"Amino Acids and Derivatives"},{"Metabolite":"UDP-N-acetylmuramoyl-L-Ala-D-gamma-Glu-6-carboxy-L-Lys-D-Ala","KEGG ID":"C04804","HMDB ID":"","Map":"Unknown"},{"Metabolite":"N-(2-hydroxyhexacosanoyl)-eicosasphinganine-1-O-[D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate]","KEGG ID":"","HMDB ID":"","Map":"Sphingolipids"},{"Metabolite":"Trihexosylceramide (d18:1/24:0)","KEGG ID":"C04737","HMDB ID":"HMDB04886","Map":"Sphingolipids"},{"Metabolite":"Iodipamide","KEGG ID":"","HMDB ID":"HMDB15581","Map":"Peptides"},{"Metabolite":"N-(2-hydroxyhexacosanoyl)-4R-hydroxyeicosasphinganine-1-O-[D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate]","KEGG ID":"","HMDB ID":"","Map":"Sphingolipids"},{"Metabolite":"3S-hydroxyhexacosanoyl-CoA","KEGG ID":"","HMDB ID":"","Map":"Fatty Acyls"},{"Metabolite":"Psidinin C","KEGG ID":"","HMDB ID":"HMDB39628","Map":"Complex Tannins"},{"Metabolite":"Ganglioside GM3 (d18:0/20:0)","KEGG ID":"","HMDB ID":"HMDB11919","Map":"Sphingolipids"},{"Metabolite":"Tetrahexosylceramide (d18:1/16:0)","KEGG ID":"C03272","HMDB ID":"HMDB04960","Map":"Sphingolipids"},{"Metabolite":"Ganglioside GM3 (d18:1/24:1(15Z))","KEGG ID":"C04730","HMDB ID":"HMDB04848","Map":"Sphingolipids"},{"Metabolite":"beta-D-Glucosyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol","KEGG ID":"C04830","HMDB ID":"","Map":"Unknown"},{"Metabolite":"N-(tetracosanoyl)-sphinganine-1-O-[myo-inositol-1-phosphoryl-6-D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate]","KEGG ID":"","HMDB ID":"","Map":"Sphingolipids"},{"Metabolite":"5-(3-Buten-1-ynyl)-2,2'-bithienyl","KEGG ID":"C08397","HMDB ID":"","Map":"Unknown"},{"Metabolite":"N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoate","KEGG ID":"","HMDB ID":"","Map":"Unknown"},{"Metabolite":"Iodixanol","KEGG ID":"","HMDB ID":"HMDB15379","Map":"Anilides"},{"Metabolite":"Propionylcarnitine","KEGG ID":"C03017","HMDB ID":"HMDB00824","Map":"Fatty Acid Esters"}]
}

}