{
"METABOLOMICS WORKBENCH":{"STUDY_ID":"ST000089","ANALYSIS_ID":"AN000141","VERSION":"1","CREATED_ON":"2016-09-17"},

"PROJECT":{"PROJECT_TITLE":"A study of changes in lipid metabolism of ovarian cancer cells co-cultured with","PROJECT_TYPE":"timecourse study","PROJECT_SUMMARY":"This West Coast Metabolomics Center pilot and feasibility project was granted Ernst Lengyel  (University of Chicago). The biology of ovarian cancer is clearly distinct from that of most epithelial tumors, in that hematogenous are rare, and ovarian tumors remain confined to the peritoneal cavity. The a large pad of fat tissue (20x13x3cm) covering the bowel, is the most common of OvCa metastasis. It consists primarily of adipocytes, which become the microenvironment for the OvCa cells. The underlying hypothesis for this is that, in the presence of adipocytes, the metabolism of OvCa cells is and shifts towards lipid utilization, which provides energy that facilitates growth and metastasis. Preliminary results suggest that primary human omental secrete cytokines which promote the metastasis of OvCa cells to the omentum and subsequent invasion. Once metastasis has occurred, OvCa cells induce lipolysis omental adipocytes, and use the energy derived from these lipids to study the metabolic changes in the tumor microenvironment we have established a organotypic culture of the human omentum using primary human cells established patient tissue. Metabolic studies will be performed on adipocytes and OvCa individually, on conditioned media and on adipocytes and OvCa cells co-cultured our 3D model, with the goal of arriving at a comprehensive analysis of primary and lipids in the tumor microenvironment. In the current investigation, analysis of primary metabolites and complex lipids were conducted on adipocytes OvCa cells individually, on conditioned media and on adipocytes and OvCa cells in our 3D model. Analysis of oxylipins was conducted on conditioned media. To better understanding of the dynamic regulation of metabolic pathways we will perform metabolic flux analysis using labeled cells (13C-glucose, in the 3D culture model. The primary objective of this study is to gain into the dynamic interactions between OvCa cells and human adipocytes with the of elucidating targets of therapeutic intervention. ","INSTITUTE":"University of California, Davis","DEPARTMENT":"Genome and Biomedical Sciences Facility","LABORATORY":"WCMC Metabolomics Core","LAST_NAME":"Fiehn","FIRST_NAME":"Oliver","ADDRESS":"1315 Genome and Biomedical Sciences Facility,451 Health Sciences Drive, Davis, 95616","EMAIL":"ofiehn@ucdavis.edu","PHONE":"(530) 754-8258","FUNDING_SOURCE":"NIH U24DK097154"},

"STUDY":{"STUDY_TITLE":"A study of changes in lipid metabolism of ovarian cancer cells co-cultured with UHPLC-QTOF MS analysis","STUDY_TYPE":"timecourse study","STUDY_SUMMARY":"This West Coast Metabolomics Center pilot and feasibility project was granted Ernst Lengyel  (University of Chicago).The biology of ovarian cancer (OvCa) is distinct from that of most epithelial tumors, in that hematogenous metastases rare, and ovarian tumors remain confined to the peritoneal cavity. The omentum, large pad of fat tissue (20x13x3cm) covering the bowel, is the most common site OvCa metastasis. It consists primarily of adipocytes, which become the microenvironment for the OvCa cells. The underlying hypothesis for this is that, in the presence of adipocytes, the metabolism of OvCa cells is and shifts towards lipid utilization, which provides energy that facilitates growth and metastasis. Preliminary results suggest that primary human omental secrete cytokines which promote the metastasis of OvCa cells to the omentum and subsequent invasion. Once metastasis has occurred, OvCa cells induce lipolysis omental adipocytes, and use the energy derived from these lipids to study the metabolic changes in the tumor microenvironment we have established a organotypic culture of the human omentum using primary human cells established patient tissue. Metabolic studies will be performed on adipocytes and OvCa individually, on conditioned media and on adipocytes and OvCa cells co-cultured our 3D model, with the goal of arriving at a comprehensive analysis of primary and lipids in the tumor microenvironment.In the current investigation, analysis of primary metabolites and complex lipids were conducted on adipocytes OvCa cells individually, on conditioned media and on adipocytes and OvCa cells in our 3D model. Analysis of oxylipins was conducted on conditioned media. To better understanding of the dynamic regulation of metabolic pathways we will perform metabolic flux analysis using labeled cells (13C-glucose, in the 3D culture model.The primary objective of this study is to gain insight the dynamic interactions between OvCa cells and human adipocytes with the of elucidating targets of therapeutic intervention. ","INSTITUTE":"University of California, Davis","DEPARTMENT":"Genome and Biomedical Sciences Facility","LABORATORY":"WCMC Metabolomics Core","LAST_NAME":"Fiehn","FIRST_NAME":"Oliver","ADDRESS":"1315 Genome and Biomedical Sciences Facility451 Health Sciences DriveDavis, CA","EMAIL":"ofiehn@ucdavis.edu","PHONE":"(530) 754-8258","NUM_GROUPS":"2","TOTAL_SUBJECTS":"14","STUDY_COMMENTS":"Lipidomics profiles for studyFor the co-culture Human Adipocytes were grown in of SKOV3ip1 ovarian cancer cellsFor control samples the adipocytes were grown the absence of SKOV3ip1 ovarian cancer cells---Exp design 2 x 14Final result is by merging results from both files and applying dilution factor.Reason was high concentration in positive mode onlyRaw Data File (Positive Mode_TGs) Data File (Positive Mode_Non-TGs) (dilution2)"},

"SUBJECT":{"SUBJECT_TYPE":"Cells","SUBJECT_SPECIES":"Homo sapiens","TAXONOMY_ID":"9606","GENOTYPE_STRAIN":"Human Adipocytes","SPECIES_GROUP":"Human"},
"SUBJECT_SAMPLE_FACTORS":[
{
"Subject ID":"Patient 1171",
"Sample ID":"S17F",
"Factors":{"Treatment":"Human Adipocytes grown in the ABSENCE of SKOV3ip1 OvCa Cells (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1171",
"Sample ID":"S17F_QC",
"Factors":{"Treatment":"Human Adipocytes grown in the ABSENCE of SKOV3ip1 OvCa Cells (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1181",
"Sample ID":"S19F",
"Factors":{"Treatment":"Human Adipocytes grown in the ABSENCE of SKOV3ip1 OvCa Cells (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1182",
"Sample ID":"S20F",
"Factors":{"Treatment":"Human Adipocytes grown in the ABSENCE of SKOV3ip1 OvCa Cells (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1193",
"Sample ID":"S23F",
"Factors":{"Treatment":"Human Adipocytes grown in the ABSENCE of SKOV3ip1 OvCa Cells (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1194",
"Sample ID":"S24F",
"Factors":{"Treatment":"Human Adipocytes grown in the ABSENCE of SKOV3ip1 OvCa Cells (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1197",
"Sample ID":"S25F",
"Factors":{"Treatment":"Human Adipocytes grown in the ABSENCE of SKOV3ip1 OvCa Cells (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1198",
"Sample ID":"S26F",
"Factors":{"Treatment":"Human Adipocytes grown in the ABSENCE of SKOV3ip1 OvCa Cells (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1171",
"Sample ID":"S17G",
"Factors":{"Treatment":"Human Adipocytes grown in the PRESENCE of SKOV3ip1 OvCa cells (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1181",
"Sample ID":"S19G",
"Factors":{"Treatment":"Human Adipocytes grown in the PRESENCE of SKOV3ip1 OvCa cells (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1182",
"Sample ID":"S20G",
"Factors":{"Treatment":"Human Adipocytes grown in the PRESENCE of SKOV3ip1 OvCa cells (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1193",
"Sample ID":"S23G",
"Factors":{"Treatment":"Human Adipocytes grown in the PRESENCE of SKOV3ip1 OvCa cells (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1194",
"Sample ID":"S24G",
"Factors":{"Treatment":"Human Adipocytes grown in the PRESENCE of SKOV3ip1 OvCa cells (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1197",
"Sample ID":"S25G",
"Factors":{"Treatment":"Human Adipocytes grown in the PRESENCE of SKOV3ip1 OvCa cells (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1198",
"Sample ID":"S26G",
"Factors":{"Treatment":"Human Adipocytes grown in the PRESENCE of SKOV3ip1 OvCa cells (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1171",
"Sample ID":"S17C",
"Factors":{"Treatment":"Media from Human Adipocytes and SKOV3ip1 OvCa Cells Co-Cultured","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1181",
"Sample ID":"S19C",
"Factors":{"Treatment":"Media from Human Adipocytes and SKOV3ip1 OvCa Cells Co-Cultured","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1182",
"Sample ID":"S20C",
"Factors":{"Treatment":"Media from Human Adipocytes and SKOV3ip1 OvCa Cells Co-Cultured","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1193",
"Sample ID":"S23C",
"Factors":{"Treatment":"Media from Human Adipocytes and SKOV3ip1 OvCa Cells Co-Cultured","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1194",
"Sample ID":"S24C",
"Factors":{"Treatment":"Media from Human Adipocytes and SKOV3ip1 OvCa Cells Co-Cultured","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1197",
"Sample ID":"S25C",
"Factors":{"Treatment":"Media from Human Adipocytes and SKOV3ip1 OvCa Cells Co-Cultured","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1198",
"Sample ID":"S26C",
"Factors":{"Treatment":"Media from Human Adipocytes and SKOV3ip1 OvCa Cells Co-Cultured","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1171",
"Sample ID":"S17A",
"Factors":{"Treatment":"Media from Human Adipocytes Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1181",
"Sample ID":"S19A",
"Factors":{"Treatment":"Media from Human Adipocytes Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1182",
"Sample ID":"S20A",
"Factors":{"Treatment":"Media from Human Adipocytes Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1193",
"Sample ID":"S23A",
"Factors":{"Treatment":"Media from Human Adipocytes Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1194",
"Sample ID":"S24A",
"Factors":{"Treatment":"Media from Human Adipocytes Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1197",
"Sample ID":"S25A",
"Factors":{"Treatment":"Media from Human Adipocytes Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1198",
"Sample ID":"S26A",
"Factors":{"Treatment":"Media from Human Adipocytes Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1171",
"Sample ID":"S17B",
"Factors":{"Treatment":"Media from SKOV3ip1 OvCa Cells Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1181",
"Sample ID":"S19B",
"Factors":{"Treatment":"Media from SKOV3ip1 OvCa Cells Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1182",
"Sample ID":"S20B",
"Factors":{"Treatment":"Media from SKOV3ip1 OvCa Cells Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1193",
"Sample ID":"S23B",
"Factors":{"Treatment":"Media from SKOV3ip1 OvCa Cells Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1194",
"Sample ID":"S24B",
"Factors":{"Treatment":"Media from SKOV3ip1 OvCa Cells Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1197",
"Sample ID":"S25B",
"Factors":{"Treatment":"Media from SKOV3ip1 OvCa Cells Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1198",
"Sample ID":"S26B",
"Factors":{"Treatment":"Media from SKOV3ip1 OvCa Cells Culturing Only","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1171",
"Sample ID":"S17D",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the ABSENCE of human adipocytes (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1181",
"Sample ID":"S19D",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the ABSENCE of human adipocytes (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1182",
"Sample ID":"S20D",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the ABSENCE of human adipocytes (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1194",
"Sample ID":"S24D",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the ABSENCE of human adipocytes (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1197",
"Sample ID":"S25D",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the ABSENCE of human adipocytes (Control)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1171",
"Sample ID":"S17E",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the PRESENCE of Human Adipocytes (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1181",
"Sample ID":"S19E",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the PRESENCE of Human Adipocytes (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1182",
"Sample ID":"S20E",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the PRESENCE of Human Adipocytes (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1194",
"Sample ID":"S24E",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the PRESENCE of Human Adipocytes (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1197",
"Sample ID":"S25E",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the PRESENCE of Human Adipocytes (Co-Culture)","Time Point":"4 hours"}
},
{
"Subject ID":"Patient 1198",
"Sample ID":"S26E",
"Factors":{"Treatment":"SKOV3ip1 OvCa cells grown in the PRESENCE of Human Adipocytes (Co-Culture)","Time Point":"4 hours"}
}
],
"COLLECTION":{"COLLECTION_SUMMARY":"-"},

"TREATMENT":{"TREATMENT_SUMMARY":"-"},

"SAMPLEPREP":{"SAMPLEPREP_SUMMARY":"-"},

"CHROMATOGRAPHY":{"CHROMATOGRAPHY_SUMMARY":"UPLC","CHROMATOGRAPHY_TYPE":"Reversed phase","INSTRUMENT_NAME":"Waters Acquity","COLUMN_NAME":"Waters Acquity CSH C18 (100 x 2.1mm, 1.7um) Pre-Column","METHODS_FILENAME":"Data_Dictionary_Fiehn_laboratory_CSH_QTOF_lipidomics.pdf","COLUMN_PRESSURE":"450-850 bar","COLUMN_TEMPERATURE":"65 C","FLOW_GRADIENT":"15% B to 99% B","FLOW_RATE":"0.6 mL/min","INTERNAL_STANDARD":"See data dictionary","RETENTION_TIME":"See data dictionary","SAMPLE_INJECTION":"1.67 uL","SOLVENT_A":"60:40 Acetonitrile:Water +10mM Ammonium Formate +10mM Formic Acid","SOLVENT_B":"9:1 Isopropanol:Acetonitrile +10mM Ammonium Formate +10mM Formic Acid","ANALYTICAL_TIME":"13 min","CAPILLARY_VOLTAGE":"3500","TIME_PROGRAM":"15 min","WEAK_WASH_SOLVENT_NAME":"Isopropanol","WEAK_WASH_VOLUME":"5 seconds","STRONG_WASH_SOLVENT_NAME":"Same","TARGET_SAMPLE_TEMPERATURE":"Autosampler temp 4 C","RANDOMIZATION_ORDER":"Excel generated"},

"ANALYSIS":{"ANALYSIS_TYPE":"MS","LABORATORY_NAME":"WCMC Metabolomics Core","SOFTWARE_VERSION":"MassHunter","DETECTOR_TYPE":"TOF MCP","DATA_FORMAT":".d"},

"MS":{"INSTRUMENT_NAME":"Agilent 6530 QTOF","INSTRUMENT_TYPE":"QTOF","MS_TYPE":"ESI","ION_MODE":"POSITIVE","CAPILLARY_VOLTAGE":"3500","COLLISION_GAS":"Nitrogen","DRY_GAS_FLOW":"8 l/min","DRY_GAS_TEMP":"325","FRAGMENT_VOLTAGE":"120","FRAGMENTATION_METHOD":"Auto MS/MS","ION_SOURCE_TEMPERATURE":"325","ION_SPRAY_VOLTAGE":"1000","IONIZATION":"Pos","PRECURSOR_TYPE":"Intact Molecule","REAGENT_GAS":"Nitrogen","SOURCE_TEMPERATURE":"325 C","DATAFORMAT":".d","DESOLVATION_GAS_FLOW":"11 l/min","DESOLVATION_TEMPERATURE":"350 C","NEBULIZER":"35 psig","OCTPOLE_VOLTAGE":"750","SCAN_RANGE_MOVERZ":"60-1700 Da","SCANNING_CYCLE":"2 Hz","SCANNING_RANGE":"60-1700 Da","SKIMMER_VOLTAGE":"65","MS_COMMENTS":"UHPLC-QTOFMS(Positive)"},

"MS_METABOLITE_DATA":{
"Units":"Peak area",

"Data":[{"Metabolite":"1-Hexadecanoyl-sn-glycero-3-phosphocholine","S17F":"","S17F_QC":"","S19F":"","S20F":"","S23F":"","S24F":"","S25F":"","S26F":"","S17G":"","S19G":"","S20G":"","S23G":"","S24G":"","S25G":"","S26G":"","S17C":"","S19C":"","S20C":"","S23C":"","S24C":"","S25C":"","S26C":"","S17A":"","S19A":"","S20A":"","S23A":"","S24A":"","S25A":"","S26A":"","S17B":"","S19B":"","S20B":"","S23B":"","S24B":"","S25B":"","S26B":"","S17D":"5322.3000","S19D":"3719.2000","S20D":"4924.1000","S24D":"4087.5000","S25D":"5273.2000","S17E":"4989.1000","S19E":"2943.4000","S20E":"4572.1000","S24E":"3937.6000","S25E":"3872.0000","S26E":"5333.4000"},{"Metabolite":"1-hexadecyl-2-(8Z_11Z_14Z-eicosatrienoyl)-sn-glycero-3-phosphocholine","S17F":"7024.3000","S17F_QC":"8010.9000","S19F":"2699.1000","S20F":"2857.8000","S23F":"9928.2000","S24F":"10860.4000","S25F":"2283.6000","S26F":"8313.3000","S17G":"13826.0000","S19G":"1882.4000","S20G":"4438.0000","S23G":"7890.6000","S24G":"19438.9000","S25G":"2267.0000","S26G":"5647.3000","S17C":"","S19C":"","S20C":"","S23C":"","S24C":"","S25C":"","S26C":"","S17A":"","S19A":"","S20A":"","S23A":"","S24A":"","S25A":"","S26A":"","S17B":"","S19B":"","S20B":"","S23B":"","S24B":"","S25B":"","S26B":"","S17D":"600328.7000","S19D":"485359.2000","S20D":"552491.1000","S24D":"484452.8000","S25D":"587553.8000","S17E":"637047.0000","S19E":"442750.4000","S20E":"536371.8000","S24E":"452536.0000","S25E":"561159.8000","S26E":"558220.3000"},{"Metabolite":"1-Hexadecylpyridinium 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C16:0","S17F":"","S17F_QC":"","S19F":"","S20F":"","S23F":"","S24F":"","S25F":"","S26F":"","S17G":"","S19G":"","S20G":"","S23G":"","S24G":"","S25G":"","S26G":"","S17C":"","S19C":"","S20C":"","S23C":"","S24C":"","S25C":"","S26C":"","S17A":"","S19A":"","S20A":"","S23A":"","S24A":"","S25A":"","S26A":"","S17B":"","S19B":"","S20B":"","S23B":"","S24B":"","S25B":"","S26B":"","S17D":"71107.2000","S19D":"28939.6000","S20D":"21782.3000","S24D":"18130.4000","S25D":"36191.9000","S17E":"115634.5000","S19E":"56090.0000","S20E":"24960.3000","S24E":"49197.0000","S25E":"70206.2000","S26E":"61944.2000"},{"Metabolite":"Acylcarnitine 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