#METABOLOMICS WORKBENCH Jung_DNLI_20240919_115027 DATATRACK_ID:5207 STUDY_ID:ST003501 ANALYSIS_ID:AN005746 PROJECT_ID:PR002147 VERSION 1 CREATED_ON September 26, 2024, 4:43 pm #PROJECT PR:PROJECT_TITLE TREM2 expression level is critical for microglial state, metabolic capacity and PR:PROJECT_TITLE efficacy of TREM2 agonism PR:PROJECT_TYPE Preclinical Mouse study PR:PROJECT_SUMMARY Triggering receptor expressed on myeloid cells 2 (TREM2) is a central regulator PR:PROJECT_SUMMARY of microglial activity and sequence variants are major risk factors for late PR:PROJECT_SUMMARY onset Alzheimer’s disease (LOAD). To better understand the molecular and PR:PROJECT_SUMMARY functional changes associated with TREM2 signalling, we generated a TREM2 PR:PROJECT_SUMMARY reporter mouse model and observed a gradual upregulation of reporter expression PR:PROJECT_SUMMARY with increasing plaque proximity. Isolated microglia were sorted based on PR:PROJECT_SUMMARY reporter expression and their transcriptomic profiles acquired in both wildtype PR:PROJECT_SUMMARY and APP transgenic animals, allowing us to disentangle TREM2 versus PR:PROJECT_SUMMARY pathology-specific effects. Bulk RNA sequencing highlighted TREM2 PR:PROJECT_SUMMARY level-dependent changes in major immunometabolic pathways, with enrichment of PR:PROJECT_SUMMARY genes in oxidative phosphorylation and cholesterol metabolism in microglia with PR:PROJECT_SUMMARY increased TREM2 expression. To confirm these findings, we next analysed uptake PR:PROJECT_SUMMARY of fluorodeoxyglucose (FDG) and examined metabolomic and lipidomic profiles. PR:PROJECT_SUMMARY Again, independent of Aβ pathology, TREM2 expression correlated with uptake of PR:PROJECT_SUMMARY FDG as well as increased cellular redox, energetics, and cholesterol PR:PROJECT_SUMMARY homeostasis. Finally, we performed chronic treatment with a brain penetrant PR:PROJECT_SUMMARY TREM2 agonist and identified a window of TREM2 expression where microglia are PR:PROJECT_SUMMARY most responsive. Thus, our data provide novel insights into TREM2-mediated PR:PROJECT_SUMMARY regulation of microglial metabolic function and informs current efforts to bring PR:PROJECT_SUMMARY TREM2 agonists into clinical application. PR:INSTITUTE Denali Therapeutics PR:DEPARTMENT Development Sciences PR:LAST_NAME Suh PR:FIRST_NAME Jung PR:ADDRESS 161 Oyster Point Blvd, South San Francisco, California, 94080, USA PR:EMAIL suh@dnli.com PR:PHONE +1 6507973837 PR:FUNDING_SOURCE Denali Therapeutics PR:PUBLICATIONS https://www.biorxiv.org/content/10.1101/2024.07.18.604115v1 #STUDY ST:STUDY_TITLE TREM2 expression level is critical for microglial state, metabolic capacity and ST:STUDY_TITLE efficacy of TREM2 agonism ST:STUDY_SUMMARY Triggering receptor expressed on myeloid cells 2 (TREM2) is a central regulator ST:STUDY_SUMMARY of microglial activity and sequence variants are major risk factors for late ST:STUDY_SUMMARY onset Alzheimer’s disease (LOAD). To better understand the molecular and ST:STUDY_SUMMARY functional changes associated with TREM2 signalling, we generated a TREM2 ST:STUDY_SUMMARY reporter mouse model and observed a gradual upregulation of reporter expression ST:STUDY_SUMMARY with increasing plaque proximity. Isolated microglia were sorted based on ST:STUDY_SUMMARY reporter expression and their transcriptomic profiles acquired in both wildtype ST:STUDY_SUMMARY and APP transgenic animals, allowing us to disentangle TREM2 versus ST:STUDY_SUMMARY pathology-specific effects. Bulk RNA sequencing highlighted TREM2 ST:STUDY_SUMMARY level-dependent changes in major immunometabolic pathways, with enrichment of ST:STUDY_SUMMARY genes in oxidative phosphorylation and cholesterol metabolism in microglia with ST:STUDY_SUMMARY increased TREM2 expression. To confirm these findings, we next analysed uptake ST:STUDY_SUMMARY of fluorodeoxyglucose (FDG) and examined metabolomic and lipidomic profiles. ST:STUDY_SUMMARY Again, independent of Aβ pathology, TREM2 expression correlated with uptake of ST:STUDY_SUMMARY FDG as well as increased cellular redox, energetics, and cholesterol ST:STUDY_SUMMARY homeostasis. Finally, we performed chronic treatment with a brain penetrant ST:STUDY_SUMMARY TREM2 agonist and identified a window of TREM2 expression where microglia are ST:STUDY_SUMMARY most responsive. Thus, our data provide novel insights into TREM2-mediated ST:STUDY_SUMMARY regulation of microglial metabolic function and informs current efforts to bring ST:STUDY_SUMMARY TREM2 agonists into clinical application. ST:INSTITUTE Denali Therapeutics ST:LAST_NAME Suh ST:FIRST_NAME Jung ST:ADDRESS 161 Oyster Point Blvd, South San Francisco, California, 94080, USA ST:EMAIL suh@dnli.com ST:PHONE +1 6507973837 ST:NUM_GROUPS 5 ST:TOTAL_SUBJECTS 26 ST:NUM_MALES 26 ST:STUDY_COMMENTS Release as soon as it is possible ST:PUBLICATIONS https://www.biorxiv.org/content/10.1101/2024.07.18.604115v1 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:AGE_OR_AGE_RANGE 15 mo SU:GENDER Male #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS Pool_1 HSA-000019615 genotype:NA | condition:NA | group:NA | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_002; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_001; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_002; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_002 SUBJECT_SAMPLE_FACTORS 2_59_mid_WT HSA-000019571 genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_003; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_009; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_003; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_003 SUBJECT_SAMPLE_FACTORS 12_63_mid_WT HSA-000019581 genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_004; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_027; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_004; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_004 SUBJECT_SAMPLE_FACTORS 24_78_low_APP HSA-000019593 genotype:APP | condition:low | group:low_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_005; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_017; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_005; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_005 SUBJECT_SAMPLE_FACTORS 10_62_mid_WT HSA-000019579 genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_006; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_016; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_006; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_006 SUBJECT_SAMPLE_FACTORS 15_69_low_WT HSA-000019584 genotype:WT | condition:low | group:low_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_007; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_022; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_007; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_007 SUBJECT_SAMPLE_FACTORS 25_78_mid_APP HSA-000019594 genotype:APP | condition:mid | group:mid_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_008; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_012; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_008; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_008 SUBJECT_SAMPLE_FACTORS 18_74_mid_APP HSA-000019587 genotype:APP | condition:mid | group:mid_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_009; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_003; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_009; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_009 SUBJECT_SAMPLE_FACTORS 17_74_low_APP HSA-000019586 genotype:APP | condition:low | group:low_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_010; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_004; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_010; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_010 SUBJECT_SAMPLE_FACTORS 8_61_high_APP HSA-000019577 genotype:APP | condition:high | group:high_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_011; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_011; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_011; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_011 SUBJECT_SAMPLE_FACTORS 21_76_mid_WT HSA-000019590 genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_012; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_020; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_012; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_012 SUBJECT_SAMPLE_FACTORS 14_65_mid_WT HSA-000019583 genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_013; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_028; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_013; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_013 SUBJECT_SAMPLE_FACTORS 7_61_mid_APP HSA-000019576 genotype:APP | condition:mid | group:mid_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_014; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_023; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_014; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_014 SUBJECT_SAMPLE_FACTORS 1_59_low_WT HSA-000019570 genotype:WT | condition:low | group:low_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_015; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_026; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_015; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_015 SUBJECT_SAMPLE_FACTORS 5_60_high_APP HSA-000019574 genotype:APP | condition:high | group:high_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_016; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_007; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_016; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_016 SUBJECT_SAMPLE_FACTORS 22_77_low_WT HSA-000019591 genotype:WT | condition:low | group:low_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_017; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_010; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_017; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_017 SUBJECT_SAMPLE_FACTORS Pool_2 HSA-000019616 genotype:NA | condition:NA | group:NA | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_018; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_014; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_018; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_018 SUBJECT_SAMPLE_FACTORS 23_77_mid_WT HSA-000019592 genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_019; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_015; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_019; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_019 SUBJECT_SAMPLE_FACTORS 11_63_low_WT HSA-000019580 genotype:WT | condition:low | group:low_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_020; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_019; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_020; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_020 SUBJECT_SAMPLE_FACTORS 3_60_low_APP HSA-000019572 genotype:APP | condition:low | group:low_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_021; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_008; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_021; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_021 SUBJECT_SAMPLE_FACTORS 26_78_high_APP HSA-000019595 genotype:APP | condition:high | group:high_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_022; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_025; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_022; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_022 SUBJECT_SAMPLE_FACTORS 19_74_high_APP HSA-000019588 genotype:APP | condition:high | group:high_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_023; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_013; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_023; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_023 SUBJECT_SAMPLE_FACTORS 9_62_low_WT HSA-000019578 genotype:WT | condition:low | group:low_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_024; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_002; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_024; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_024 SUBJECT_SAMPLE_FACTORS 6_61_low_APP HSA-000019575 genotype:APP | condition:low | group:low_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_025; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_021; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_025; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_025 SUBJECT_SAMPLE_FACTORS 20_76_low_WT HSA-000019589 genotype:WT | condition:low | group:low_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_026; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_024; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_026; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_026 SUBJECT_SAMPLE_FACTORS 4_60_mid_APP HSA-000019573 genotype:APP | condition:mid | group:mid_disease | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_027; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_006; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_027; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_027 SUBJECT_SAMPLE_FACTORS 13_65_low_WT HSA-000019582 genotype:WT | condition:low | group:low_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_028; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_018; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_028; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_028 SUBJECT_SAMPLE_FACTORS 16_69_mid_WT HSA-000019585 genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_029; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_005; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_029; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_029 SUBJECT_SAMPLE_FACTORS Pool_3 HSA-000019617 genotype:NA | condition:NA | group:NA | Sample source:microglia RAW_FILE_NAME(Raw Source Name.LP)=20220209_BL_HEX-000330_Lipid_Pos_030; RAW_FILE_NAME(Raw Source Name.TG)=20220324_BL_HEX-000330_TGs_Pos_029; RAW_FILE_NAME(Raw Source Name.MP)=20220209_BL_HEX-000330_Met_Pos_030; RAW_FILE_NAME(Raw Source Name.MN)=20220211_BL_HEX-000330_Met_Neg_030 #COLLECTION CO:COLLECTION_SUMMARY Microglia isolation was performed using the Magnetic-activated cell sorting CO:COLLECTION_SUMMARY (MACS) system (Miltenyi Biotec). No CD11b enrichment step was performed as the CO:COLLECTION_SUMMARY intrinsic mKate2 reporter is only expressed in TREM2 expressing (microglia) CO:COLLECTION_SUMMARY cells. Hence, fluorescence-activated cell sorting was performed based on the CO:COLLECTION_SUMMARY mKate2 fluorescence signal and sorted into low, mid and high expressing CO:COLLECTION_SUMMARY subpopulations, as a proxy for the TREM2 expression of individual cells. CO:SAMPLE_TYPE microglia CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY No treatment #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Pellets from the sorted subpopulations were reconstituted on ice in 9:1 SP:SAMPLEPREP_SUMMARY MeOH:water including internal standards, vortexed for 1 minute, and spun down SP:SAMPLEPREP_SUMMARY for 5 minutes at 10,000 g. Supernatant was transferred to glass vial for SP:SAMPLEPREP_SUMMARY analysis by LC-MS. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY For each analysis, 5 µL of sample was injected on a BEH C18 1.7 µm, 2.1×100 CH:CHROMATOGRAPHY_SUMMARY mm column (Waters) using a flow rate of 0.25 mL/min at 55°C. For positive CH:CHROMATOGRAPHY_SUMMARY ionization mode, mobile phase A consisted of 60:40 acetonitrile/water (v/v) with CH:CHROMATOGRAPHY_SUMMARY 10 mM ammonium formate + 0.1% formic acid; mobile phase B consisted of CH:CHROMATOGRAPHY_SUMMARY 90:10 isopropyl alcohol/acetonitrile (v/v) with 10 mM ammonium formate + CH:CHROMATOGRAPHY_SUMMARY 0.1% formic acid. The gradient was programmed as follows: 0.0-8.0 min from 45% B CH:CHROMATOGRAPHY_SUMMARY to 99% B, 8.0-9.0 min at 99% B, 9.0-9.1 min to 45% B, and 9.1-10.0 min at 45% B. CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Agilent 1290 Infinity II CH:COLUMN_NAME Waters ACQUITY UPLC BEH C18 (100 x 2.1mm,1.7um) CH:SOLVENT_A 60% acetonitrile/40% water; 10 mM ammonium formate; 0.1% formic acid CH:SOLVENT_B 90% isopropyl alcohol/10% acetonitrile; 10 mM ammonium formate; 0.1% formic CH:SOLVENT_B acid CH:FLOW_GRADIENT 0.0-8.0 min from 45% B to 99% B, 8.0-9.0 min at 99% B, 9.0-9.1 min to 45% B, and CH:FLOW_GRADIENT 9.1-10.0 min at 45% B. CH:FLOW_RATE 0.25 mL/min CH:COLUMN_TEMPERATURE 55 #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME ABI Sciex 6500+ Qtrap MS:INSTRUMENT_TYPE Triple quadrupole MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Curtain gas at 40 psi (positive mode); collision gas was set at medium; ion MS:MS_COMMENTS spray voltage at 5500 V (positive mode); temperature at 250°C (positive mode); MS:MS_COMMENTS ion source Gas 1 at 55 psi; ion source Gas 2 at 60 psi; entrance potential at 10 MS:MS_COMMENTS V (positive mode); and  collision cell exit potential at 12.5 V (positive MS:MS_COMMENTS mode). Quantification was performed using MultiQuant 3.02 (Sciex). #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS log2(area) MS_METABOLITE_DATA_START Samples HSA-000019615 HSA-000019571 HSA-000019581 HSA-000019593 HSA-000019579 HSA-000019584 HSA-000019594 HSA-000019587 HSA-000019586 HSA-000019577 HSA-000019590 HSA-000019583 HSA-000019576 HSA-000019570 HSA-000019574 HSA-000019591 HSA-000019616 HSA-000019592 HSA-000019580 HSA-000019572 HSA-000019595 HSA-000019588 HSA-000019578 HSA-000019575 HSA-000019589 HSA-000019573 HSA-000019582 HSA-000019585 HSA-000019617 Factors genotype:NA | condition:NA | group:NA | Sample source:microglia genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia genotype:APP | condition:low | group:low_disease | Sample source:microglia genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia genotype:WT | condition:low | group:low_healthy | Sample source:microglia genotype:APP | condition:mid | group:mid_disease | Sample source:microglia genotype:APP | condition:mid | group:mid_disease | Sample source:microglia genotype:APP | condition:low | group:low_disease | Sample source:microglia genotype:APP | condition:high | group:high_disease | Sample source:microglia genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia genotype:APP | condition:mid | group:mid_disease | Sample source:microglia genotype:WT | condition:low | group:low_healthy | Sample source:microglia genotype:APP | condition:high | group:high_disease | Sample source:microglia genotype:WT | condition:low | group:low_healthy | Sample source:microglia genotype:NA | condition:NA | group:NA | Sample source:microglia genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia genotype:WT | condition:low | group:low_healthy | Sample source:microglia genotype:APP | condition:low | group:low_disease | Sample source:microglia genotype:APP | condition:high | group:high_disease | Sample source:microglia genotype:APP | condition:high | group:high_disease | Sample source:microglia genotype:WT | condition:low | group:low_healthy | Sample source:microglia genotype:APP | condition:low | group:low_disease | Sample source:microglia genotype:WT | condition:low | group:low_healthy | Sample source:microglia genotype:APP | condition:mid | group:mid_disease | Sample source:microglia genotype:WT | condition:low | group:low_healthy | Sample source:microglia genotype:WT | condition:mid | group:mid_healthy | Sample source:microglia genotype:NA | condition:NA | group:NA | Sample source:microglia 1-O-Palmitoyl-Cer(d18:1/18:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA 24-Hydroxycholesterol NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA 24-Hydroxycholesterol(d7) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA 3-O-SulfoLacCer(d18:1/18:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA 4-beta-Hydroxycholesterol NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA 7-keto-Cholesterol NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE HETE NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE HODE NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE HpODE NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE oxoHETE NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE oxoODE NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE(16:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE(18:1(d7)) 16.025639642184274 15.780612504478182 16.974152803337212 15.90833256946513 16.67107581564915 17.30180952120171 16.183886882806064 17.65179739611172 17.031422939401367 16.16744975523072 18.033206396811174 17.13953696374618 15.847932331357129 15.916192974106309 14.851833448696757 16.974255429925208 16.12059625259742 16.534869998238765 16.190351936070737 16.69437366797257 16.38710925916133 16.698926143992512 16.51438993426447 17.59558742 15.955170941954957 15.962679840790646 17.112332621470223 17.456709910919827 16.029286364112096 CE(18:1) 13.50084187955693 13.14720196200707 13.94690627445331 13.436711530715709 13.49921609619402 14.70529111074708 13.659271023817666 14.84365218888076 14.403588860786689 13.370583396826973 15.173594181423129 13.622324964314934 13.299207988257622 13.250298402625315 11.387247488926105 13.58224078363397 12.476129205256177 13.092757140919849 13.767442864625169 13.931553796051308 12.677719641641005 13.117438521656169 12.376535198996633 14.582290196138386 12.479733967996566 12.250298417906329 14.311299872790965 14.358217102581772 13.007027266893965 CE(18:2) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE(20:4) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE(20:5) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA CE(22:6) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Cer(d18:0/16:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Cer(d18:0/18:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Cer(d18:0/24:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Cer(d18:0/24:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Cer(d18:1/16:0(d7)) 20.728061493453584 20.677245433027245 20.776825587967966 20.694156497154353 20.726570117918794 20.755939279762487 20.63735121423753 20.89651914130549 20.774905749248944 20.73498965341819 20.912870730427912 20.89471010818446 20.77314262699108 20.672614916122516 20.55003282294628 20.83891892800169 20.75875927761707 20.72362551418738 20.656517006410734 20.79586818792265 20.56967752977644 20.83080471445805 20.73338408241197 20.851728204788014 20.801123964570138 20.79420201201501 20.840942931843358 20.87613679462071 20.81803595770001 Cer(d18:1/16:0) 16.730270101236453 15.436258346598214 15.490166234772568 15.511492006376319 15.167489772958666 15.823103520426761 17.058328334119686 16.796159995197332 15.547388624695646 16.955120512307776 17.333364599251514 16.37289974 16.437166490042742 15.064848841367976 16.703436799003477 16.314570339153892 16.638760049388114 15.977608772071733 14.87694944236414 15.67334330893598 17.158670177247817 17.24635767520336 14.931631354046162 15.364033391375576 16.831570796074505 15.687207538210323 15.418303233137499 16.34103163937282 16.92623112394134 Cer(d18:1/18:0) 16.778854750792764 15.320531054509232 15.772041536100405 17.69131422313507 14.876294386015017 15.352492024008516 17.512317603008764 17.43752532729983 17.63405864260923 16.549913651838814 16.439863593841174 15.954883985623578 16.196835565429055 14.723323906498257 16.35560368312891 16.036498182424943 16.77226609497808 15.907677274175429 14.262769418971986 16.916238470885645 17.02006572434589 17.06572889783861 14.75868334086133 17.53150205833799 15.85612785352066 15.601970120398141 15.21268788067562 16.219159199776808 16.572698895335844 Cer(d18:1/24:0) 16.703365837451855 16.103400075944975 15.71577970611953 14.425795471521104 15.665020156691982 14.76594130177019 17.11950812899011 16.66874463174075 14.93010162756669 16.064990264726756 17.502898782355444 17.069068216583346 15.927958643393492 14.601866976652666 15.72810133437656 15.329285576291019 16.656676767990824 16.352768314675494 14.572592455557242 15.780636135297856 16.960997258394183 16.752373210082137 14.801793214500826 15.050255151484093 15.173622267376146 15.18041620675442 14.810296482412594 17.134938248350544 16.337641851063395 Cer(d18:1/24:1) 17.78756030409215 17.147860840279545 17.034736682103798 16.30252024712857 16.59001364929946 16.445315765608918 18.317923766053283 18.083668272889827 16.293551768977522 17.776072642769428 18.325276923319795 17.872072401248374 17.371065357958948 15.93170709922752 17.76305126963471 17.281746036767796 18.077592389696225 17.48357085233816 15.658114260356072 16.810899685194293 18.390131736372062 18.36934663662224 15.780549151975894 16.177107192836832 16.90653911715737 16.77007021694213 15.876395118097017 18.082599742385838 17.947223400304715 Cholesterol 18.530313603558543 17.81879249803733 17.858791588420782 18.460213251245758 17.020974831281993 18.76704394533073 18.669587114409875 18.34762427 18.625098760140382 17.939807667530474 18.94454615795909 18.765035574851176 17.695802527554907 16.59036752508794 17.50493375357652 19.763505313367535 18.445741420327614 18.518414980281015 16.746270342636997 17.33161174536483 18.680879640552646 18.393944557575647 17.459694489169998 17.64542541424689 19.593189049422634 17.08478797275406 19.503533999734273 18.52662283348488 18.406321339505503 Cholesterol(d7) 22.960025278446885 23.03476804 22.98670772153683 22.791554687060888 22.97253082874393 23.031992797775768 22.918697028745985 23.142530869154015 23.001077097233022 22.820480690130644 22.980183454122876 22.869645756755457 22.940846093825936 22.88432432789717 22.83770564719861 23.021080641002932 22.896892848989243 23.067467523309478 22.966461611850153 23.086312673081704 22.96396960121157 22.994977310596727 22.90778257 23.086163173601484 23.129971676670767 22.97978725 23.095207528564035 23.06336152555753 23.009585131352033 Cholesteryl hexoside NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Coenzyme Q10 13.173675402043482 12.81858217748086 12.784634845557523 10.39231742277876 11.915736600622783 NA 13.659103920319536 13.542166136948524 11.09275714091986 12.250298417906338 14.827070734158257 14.358159413169494 10.851757718488935 11.29920801838728 12.092757140919852 10.976921775944582 13.414685235804388 13.436710263799338 9.714245518 11.392317422732635 12.562242513953503 13.521703485689335 NA NA NA NA NA 14.381058907450223 13.12023787734196 DG(15:0/18:1(d7)) 21.39645154 21.158560623740467 21.27141690338802 21.332925268257448 21.19449106783424 21.77468724739177 20.93392784562641 21.666767427155385 21.430787942123157 21.081526046217437 21.521549098491047 21.37629959591289 21.26042313513538 21.053721378185028 20.687810821004614 21.260335506778645 21.23935796929841 21.480144162541762 21.036601295393186 21.31503016447805 21.03103777956222 21.481981169692354 21.10776189 21.263968782601527 21.384931709383196 20.95171969076069 21.408771512928915 21.63835856715785 21.39082421570775 DG(16:0_18:1) 16.072603108768195 15.01375300757473 14.41679629 14.976402552867425 14.655315857167713 14.963498822851115 16.358375643502765 16.21132401016114 15.027717923890892 15.919719232376798 19.359375013466913 15.760731327349792 15.687533014836193 13.580511596723383 15.472450911498877 16.56876276557978 15.812970872750515 16.17975757670866 14.053722942044969 14.476145236513029 16.453017929039426 16.60288623041243 14.18675994410651 13.978384229298888 18.191533002576072 14.374372980903587 15.654576735407275 15.741366450972336 15.831114337919667 DG(16:0_20:4) 16.384105076985747 15.511414173617057 16.00354514 14.908135509908476 14.860045229973046 15.428645312014853 16.87862956 16.640639341559456 15.154034847881672 17.134298362000376 16.514225990381547 16.646859521760625 16.506411105261385 14.369654594946008 16.70314546455588 15.687121942773224 16.09651504078459 15.797165899577076 14.109642452851762 14.05052890551542 17.304323511437055 17.40544793532049 14.732256478164317 15.256658354734395 16.059330550086425 15.485206672580247 16.029195761344997 16.26052034776253 16.28130723428962 DG(18:0_18:1) 14.510972480543105 13.199672344836365 12.30070848 13.621136113274641 12.669348947779682 13.851749035091297 13.811476920717212 14.21262164023923 13.861793165890411 13.90068335807622 17.897561574032917 13.555146606686922 12.946744059449097 11.71475424632033 12.692138698548405 15.384922508512513 13.93214747312344 13.985378868655413 9.737974585168299 11.71193565056499 14.18167010095707 14.250360601697247 11.977553143475928 11.97727992349992 16.57060705094822 13.031830143818715 14.210134683306531 14.062383540716501 14.26285129328639 DG(18:0_20:4) 16.389849770305126 16.594796365515613 17.125815820934555 15.463744734915485 15.39240195321486 16.127314875974918 17.27400488815351 16.661853236181987 16.317471264457666 16.69874372838163 16.367032910400273 17.47249762702573 16.58743121 14.659684379961787 15.231678701737813 17.13480946887063 16.20641917727695 16.57023140485932 15.007174473163255 14.732257669483548 16.30848053360637 16.488272948390264 15.682543671022632 16.251000368233054 16.736899992017097 15.396829263939406 17.092520372884454 16.50881249557292 16.466793421268196 DG(18:0_22:6) 13.385126829636274 10.422132517436456 12.208337513170777 11.784632848353404 11.948486574058983 14.199567671581729 14.423598175270445 15.16080400692572 13.72351142992135 14.618803127480907 14.829246653908324 12.328525154019479 14.961585195940836 11.718855719064004 14.28953942374484 12.874688537773688 13.788217986515512 11.97572481029981 12.718830040260364 12.744613163274007 11.926972090361442 14.73227966341165 14.986437665479777 11.573855363111688 13.819037733716664 13.666915889238268 14.67774095281924 14.581391454446466 14.173701979396233 DG(18:1/18:1) 16.25764017084321 14.847534705620404 15.077459871126013 15.257173506581504 14.806930130360799 15.820665983541714 15.841823038788608 15.826956362277459 15.562477628171315 16.12038067090873 19.99954102 15.951089058167812 15.685193059574528 14.509418248288242 15.609657331966025 17.093443455313594 15.916114464010468 16.309347460549603 13.869789366938601 14.883793512311977 16.060730086613212 16.119748455854825 14.679034725442854 14.747038783912187 18.461648981439208 14.832950856460892 16.08933539744598 15.780020213406841 15.673226610836888 DG(18:1_20:4) 15.305315824198935 14.621184202307852 15.029050785081507 14.133783961450275 13.900102159156798 14.57232600557266 16.215955341798455 15.640434752029588 14.696234696756582 16.284380535944123 15.895208656634104 15.73232908235858 15.526872090941668 13.036175499884132 15.876334679693832 14.962173031109703 15.092930531346225 14.723323906498257 12.714245517666123 13.878818362476757 16.120445299701746 16.47748255459754 13.60177078840771 13.900112062977456 14.962331534036558 14.51131039007398 15.02064805653002 15.668651236328053 15.186830765230447 GB3(d18:1/16:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA GB3(d18:1/18:0(d3)) 20.808427739888113 20.745803595650397 20.952612112697604 20.96109741289933 21.05734831733392 21.03519760348772 20.725774458323258 21.06413736185275 20.925659734967724 20.738590186115022 20.869451530342147 20.886283154418088 20.924589133309116 20.624090933799714 20.532480974089232 20.913139095201846 20.947474088473083 20.84966637461395 20.809202697787157 20.95684297728639 20.942473198175897 20.968310452555524 20.856575026938255 20.995108924453266 20.864182072308825 20.958869286732074 20.883140846770814 21.008588235160328 20.951020325618998 GB3(d18:1/18:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA GB3(d18:1/24:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA GB3(d18:1/24:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA GlcCer(d18:1(d5)/18:0) 23.155203640342286 23.071089310870832 23.212382225950986 23.24690276287786 23.22043516826749 23.270492799697397 23.086633557902093 23.356084192860322 23.26920817054154 23.166033874934204 23.364960079937173 23.293950029637536 23.264745741695275 23.16194473376437 22.99693417094276 23.213345117044906 23.263390730463712 23.303547088364095 23.163459948816914 23.284481170483918 23.075475019561182 23.282723971002486 23.176048003322904 23.326624710199624 23.29400559431282 23.202626557016785 23.35613798391444 23.433806377982517 23.23588238005505 HexCer(d18:1/12:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA GlcCer(d18:1/16:0(d3)) 20.153249909037225 20.072806983257504 20.243203436380806 20.157475028674437 20.109479654928332 20.07481637 20.044772309652384 20.235487854668637 19.86922860799404 20.080669495694874 20.168936805094706 20.158381776615656 20.117282804160634 20.06916814096854 19.865127670999797 20.13217602215247 20.050214668033835 20.177383762859314 20.109161655811505 20.155851798358622 20.08157569720008 20.16844004130485 20.083236414180387 20.194398132214815 20.184209922068813 20.03855681 20.15718254834791 20.258516379380165 20.21298228364031 Glucosylsphingosine(d5) 16.722319857250106 16.80864005420965 16.927298171372325 16.966622030147278 16.737071357610798 16.97318147154132 16.754952968581588 16.92009481517559 16.858182827165326 16.859248779212827 16.970288446965082 16.67767188 16.947393890875915 16.85020103778033 16.662460885695722 16.94279159164556 16.939710454570093 17.023466566006825 16.606988669957683 16.96079611902409 16.80358614637244 17.039664115894738 16.565149371215888 16.870599171844248 16.859652996767682 16.900075343328737 16.99109023225458 16.98866122782836 16.649890860530224 HexCer(d18:1/16:0) 14.732256478164317 14.436766188641682 14.021819762270734 14.015869319709958 13.14979947477312 15.154001614535476 15.532059130429426 14.999793265654578 14.480303241106714 15.180415620940733 14.876334679685572 14.741178040421179 14.640339140378998 13.915879378835774 14.977467762178719 15.250422778033752 14.784763651864546 14.381159604856858 13.801708358916462 14.521637827797719 15.452741824991058 15.299448018012194 14.346630074848767 14.225270711651534 15.388592668929363 14.458557364135748 14.947021371842927 14.749957393917304 14.414796208080718 HexCer(d18:1/18:0) 16.638099811699938 14.147204924942228 13.659197641928348 15.193411394179876 14.444830925029205 15.745706881579896 16.054398208419165 15.862951485434067 15.999853487507542 15.120904319059468 15.434438675582056 15.323290977205195 15.00717446714898 13.784720717706643 14.262222311629843 16.335242391342565 16.609772023254276 15.050764019840408 12.749869427396845 14.287195582321564 15.630984880655856 15.606952086259918 13.542064542283443 15.09296520693024 16.308585052380888 13.749869427396844 15.935180022851322 15.275204455455132 16.417913812303887 HexCer(d18:1/22:0) 17.620835467497795 16.127365664069618 15.880428080202554 15.39900483114619 15.386839328486355 16.645392014279324 17.34875166 16.902398758782482 16.093086564914664 16.106872056263033 17.356023678060048 17.084299672451206 15.908277032818292 14.741222583947167 15.58448914390909 17.264944978594002 17.521057091272212 16.588357569079577 14.650879039950311 15.41501533603459 16.928137109928898 16.522051211494585 14.572326005572664 15.16726916419518 16.748402376891203 15.133919234192003 16.570160487812753 16.886093055932655 17.46621604057641 HexCer(d18:1/24:0) 17.962321096533174 15.193379050745968 15.293143987970158 15.071973447575065 15.050671739552838 16.539990219801783 16.514483347163797 16.296590158900486 16.22269434418347 15.20516661561205 16.75254510112183 16.643067977384636 15.007211272383778 14.469710172686135 14.776194482756868 17.161286362875607 17.80702821564014 16.09278211293968 14.262520020030772 14.705336474949297 16.392634540872344 15.951099449014842 13.801708358916462 14.414796208080713 16.76347330250707 14.358156530304484 16.392669472764013 16.278425452030582 17.739543240387807 HexCer(d18:1/24:1) 19.66340946630991 15.587301865206502 15.23171019784725 17.380236866415377 15.44235650341413 18.964487601091054 17.46243324031106 17.43060143 18.693545626640596 16.401166186105783 17.79230760442563 17.639996300386784 16.029187577612976 14.659197641928348 16.014983543725194 20.00449299918137 19.516927205331758 17.060085390588313 15.0145157 15.640434672019584 17.32530685567004 16.858448995850598 14.999832685567453 15.939559013497053 19.920824373892703 15.557450537878504 19.622402874804084 17.365380194003713 19.652957872668647 Hexosylsphingosine NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA LacCer(d18:1/16:0) 12.913937811710314 12.196212186225376 12.299283263963007 11.46269113350231 11.29920801838728 13.290406524271901 11.561975757994045 12.299203838490165 11.973031189594927 9.977138233 13.414782058190442 11.297110000846011 11.56223735376864 12.479778517021245 11.784634845557521 13.621135609005588 11.91587618 12.884172455932138 11.391882161486219 11.714245517666123 11.08222321485277 11.391616951717786 12.29886428162487 11.640244936179345 12.036173515556687 NA 13.346287439215384 12.092757137428125 12.03736410937679 LacCer(d18:1/17:0) 20.605245024802354 20.455091804989163 20.62676647531481 20.399984446770144 20.45224448564013 20.588513841172745 20.397677713484324 20.598512010183377 20.540822007455695 20.46723846400382 20.58487514554186 20.526557195502697 20.556987362184238 20.47124743844775 20.33103608721374 20.609264657387065 20.497315786182444 20.448089665089583 20.37464379 20.61953719097484 20.357971860081264 20.68836467106099 20.57337580645897 20.66943471 20.657085847518672 20.558806574272026 20.53418252446806 20.690134924410174 20.56431133598388 LacCer(d18:1/18:0) 13.71172167226024 11.266015247349667 11.807958094598462 13.134372663934261 NA 11.966988022856562 14.446649200664524 14.104299072007692 13.440240810510698 13.86960458123394 NA 12.347994436614163 13.331057336283115 12.34673200559143 12.478440202997865 13.082908055610568 13.225436088652378 11.75787036596997 11.327383194523847 13.17227178373826 13.925991354413727 13.809969832274737 11.082187849434083 13.744043432908486 10.56258356763683 12.344853975759992 12.75097937331532 12.768028088788117 12.654901140883817 LacCer(d18:1/24:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA LacCer(d18:1/24:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Lactosylsphingosine NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA LPC(16:0) 21.260050593241715 21.110020398302442 20.69950010154093 21.247652276767262 20.26493504880888 20.39232457993404 21.028329125088995 21.690217298000423 20.841635924491587 20.836840187918146 22.381082884851683 21.647122238217076 20.781215415073312 20.735456548961047 20.87523985618112 21.640739989171678 21.191453425551444 21.10233920412719 20.378210920654105 20.73057339006975 21.758628485059873 21.117567777649562 20.694748106469504 20.776035112783504 21.75471358982174 20.661216998036807 21.663366994715286 21.123601426155183 21.197002447299674 LPC(16:1) 16.820777307964867 16.822503336720985 16.31888242235939 16.48348173985534 16.196801233881462 16.117126502886656 17.008818079474267 17.174832587543694 16.48654842816498 16.820891843878865 17.430901643777283 17.23611996674569 16.82757134708313 16.558658925619497 17.150159759164865 17.083763245658492 16.826223255619205 16.865108933968948 16.10659401716702 16.439195081475262 17.45369556921899 17.217589123554593 16.709928553217733 16.46042261795594 16.894907285791252 16.481311289592227 17.014375510520644 16.857298295918525 16.96950781237456 LPC(18:0) 21.195372390870546 21.207944225681402 20.524368787817206 21.475456007657584 20.55680237246164 20.344565185667122 21.11546067290526 21.396915277699414 21.12629287018066 21.101701786109224 22.08979291966988 21.652353405405382 21.016649923146296 21.09464709450791 21.04614444830861 21.739222441379745 21.341959101426625 21.403848778219018 20.41297749321013 21.162646253585557 21.331426243619276 21.30359727 20.950592861721365 21.199254795963572 21.77386528873381 20.55073880628955 21.750416684706483 21.04838428 21.37453752532009 LPC(18:1(d7)) 25.871641032563147 25.76877583022179 25.883695792444186 25.98391464186726 25.85642908 26.008521038931754 25.92439613 26.086387348935713 26.10486507865767 25.976820181162047 26.140346873254487 26.10256188215737 26.018536963014906 25.99308974064059 25.63804794784649 26.100294440863163 26.00474590449955 25.97094928152076 26.058724493591736 26.032853875482765 26.05995104115394 26.06013669524172 26.024216700439485 26.135916322966928 26.005219006629723 26.072944854388417 26.084604012621572 26.176913239275475 26.04747388835988 LPC(18:1) 20.964982217788506 20.916224184641223 20.655032583761212 21.049557232072292 20.47197311927184 20.525957202357976 20.77121310632336 21.14081938519009 20.886844630277828 20.91875645976041 21.469267828122515 21.22167549904983 20.871097405819686 20.798502646800117 20.876646967472592 21.284327472190842 20.996305912520352 20.99320797889735 20.496877360129098 20.768763674703003 21.060427546040188 20.996090075908235 20.83083311342775 20.906465457591576 20.98479319518287 20.55948982938632 21.138648207282984 20.79248266424291 20.901482534082646 LPC(20:4) 18.389539713132553 18.80681969 18.248934830552837 18.414279779405508 18.239163147966238 17.300164875301586 18.73696126692391 18.758803735082513 18.130505994220513 18.815708830986317 18.56406068998093 18.987447768936576 18.628847233070665 18.191869891543714 18.606352776666938 18.16377023430511 18.568849840616707 18.75271673931059 17.701340676551478 18.496767646494803 19.08716340987996 18.893792128800932 18.249372232948723 18.244757525194387 18.118609977320634 18.105609485471216 18.322414310203207 18.298256965219288 18.590464415263643 LPC(22:6) 16.09872459805504 16.068496566836174 15.77055540212309 15.726872716678933 15.647879125615395 14.791069580615838 16.213586291647754 16.200070435430543 15.718189853351602 16.54265698 15.434899838168878 16.284321092773368 16.18758571 15.552317576997924 16.163841960285055 15.953871309851541 15.83049638921342 16.363970216862903 14.742121799716545 16.01794552425151 16.73005487411937 16.393785112112614 15.752933060684072 15.93870668768138 14.962213621178147 15.492642454378032 15.467368658377946 15.529395112616434 15.886852704339832 LPC(24:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA LPC(24:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA LPC(26:0) 12.915879378835776 12.147204924942232 13.250289195091822 12.43671154213721 12.946906274451772 13.198734101558891 13.521600439723727 12.60177078840771 13.458406613236532 13.064742764750259 12.780785036701216 13.696226939259518 12.520490020362669 13.092615214743931 12.521600439723732 12.43670559330343 12.677719641641014 12.94690627 13.323054760341646 12.343898621374585 12.15828727971568 13.323054760341646 12.97728395 12.47976051161716 13.199104884127376 13.369597346278677 12.299204656283523 12.251984621737623 12.240100656804579 LPC(26:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA lyso-GB3 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA lyso-GB3-d7 18.37039179708558 18.2454251 18.402679713671922 18.365453749663036 18.408096112918592 18.46079591824145 18.362354926706182 18.635629510234157 18.385704973240742 18.253052331386513 18.46182140262199 18.464250950901356 18.325163733817668 18.21980511053513 18.067847625604877 18.190308497594174 18.327453087329406 18.363874533247337 18.329268050800454 18.235391669989074 18.23602565361034 18.36472238 18.352444068306852 18.430524687764827 18.35969536173087 18.296367506055823 18.37741043046286 18.510911452561768 18.302136232430428 lyso-GB4 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA MG(16:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA MG(16:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA MG(18:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA MG(18:1(d7)) 15.691875228059951 15.317306081839535 15.38064758588402 15.647624050290702 15.381162188560273 15.767595835015612 15.42041687123025 15.753033708346122 15.333986174836866 15.636160552823453 15.485312109645191 15.363177869111958 15.029050734571516 15.323296883457783 15.55241573917117 14.922232316399123 15.743080265431454 15.35283027364992 15.113927517455279 15.44877902620951 15.269018531423235 15.425988194166422 15.320656571780834 15.42576628392188 15.602014428963905 15.625547794232341 15.542293083265715 15.16076125958009 15.452860019093245 MG(18:1) 11.51935225430429 11.980654607354557 NA 11.088804524642152 11.179772524566403 10.977279382523903 12.436711542137209 NA 11.294637456755757 12.67454204931386 13.498181834694615 11.707048618600062 11.476216898275192 11.19894778506579 13.120237877341957 11.709669936982147 12.147606968948407 10.970651820434274 11.104570881386898 12.521519359849929 13.03850216996364 12.587978837370702 11.71406526673653 NA 11.909501050464247 11.19967226477987 12.09209027870629 10.848168818146684 NA MG(20:4) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA N-Oleoylethanolamine NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA N-Palmitoyl-O-phosphocholineserine NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Palmitoylethanolamine NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA PC(15:0/18:1(d7)) 27.364737435653137 27.33410498394641 27.398731457678718 27.35236836 27.356177585171555 27.42501788699784 27.32397657474317 27.440595696199157 27.43963571358017 27.34234766 27.414672952430593 27.413088813914726 27.36994020220499 27.34115829732856 27.254332807650137 27.403017598446684 27.378661280375454 27.348344335128182 27.406507127721394 27.405131406373982 27.390296560570512 27.39540570566883 27.344778395448824 27.42826177026793 27.40793893353761 27.400720001739383 27.44228579965408 27.459130660462286 27.38820391847186 PC(16:0/5:0(CHO)) 13.838406682700182 14.432795744918964 14.036967332011878 13.814878955384314 14.261971971975456 14.724021294855564 14.016617456517258 15.202553974914188 13.026865086584753 12.736342510833525 16.13023733146429 14.941759879715773 12.470185892643451 10.06776869271491 13.472359656758805 12.596174843029814 13.360361105572812 14.188700589928922 12.23111368709168 12.564808274453899 13.283934590448377 14.093868344138967 11.36921230555491 11.500284444074813 14.175917991328731 12.347196403299147 12.888310510566331 15.645834298400766 13.54801583935905 PC(16:0/9:0(CHO)) 15.282008112459604 15.212273806405694 15.29106157289466 15.266730962419595 15.176435917184627 15.550194995766963 15.113964402471959 16.09627703125485 14.581685597324094 14.018712332950638 15.806617665677953 14.915047729518601 14.471701185120638 13.860258465680813 13.726780151278573 14.558217911806258 14.14474316672713 14.856758788153146 13.746343190471828 14.382018321456433 13.941293216664283 13.626448193356701 12.657888203662878 13.677767418777025 14.653242337837158 12.533865864918488 12.363616962662901 15.654405965628827 14.53218582528644 PC(16:0/9:0(COOH)) 15.351540524830426 15.128701635939757 15.423256487266098 15.43299664539806 15.49245143992439 15.50741948163808 14.816021656963468 18.151991095826713 15.703004701703717 14.95237131636706 15.190457358816726 14.757047921370052 14.014481139048463 14.266914750253967 14.309433782769357 15.465277024251561 15.104236783326805 15.296815792754742 14.219991769670331 14.416434617409896 14.797394452313828 14.973138053445153 14.075194330374286 13.83381916255422 14.54913352891236 14.488576559145404 15.220418406358828 14.353855952156652 15.020288100441316 PC(18:0/20:4(OH[S])) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA PC(18:0/20:4(OOH[S])) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA PC(34:1) 24.638986897263766 24.138394933652773 24.04826437112843 24.130262207653065 23.632154291980786 23.990077065314296 25.466056235870322 25.09491054135905 24.04042243063866 24.98941869164026 25.12904305428845 25.162592355236153 24.525761936156446 22.46083581267111 24.700820194816224 24.712275482680933 24.689004568797078 24.65622018351157 22.60706927895486 23.599913908338745 25.409363879440264 25.19007245258355 22.872791667400755 23.629652266675635 24.57755157624092 23.99866499 24.71464093182818 25.091836143512662 24.748419554568365 PC(36:1) 21.934060400032596 21.084847502152098 20.961732497367528 21.62492241210496 20.627776176987265 21.923625296885717 21.984288449872874 21.826901424340402 21.855325674511562 21.09396670752943 22.168282678959336 22.146131051797983 20.894327551041325 19.62203529971892 20.65349460294649 22.77043200766752 21.998281265049016 21.74191897901122 19.719090591648705 20.680046998045572 21.33806757693076 21.438639524072258 19.88057190423652 20.79074959197916 22.57751573823138 20.382953358202954 22.758027988933787 22.126029049773422 22.03957069087081 PC(36:2) 22.059731327490777 21.262056215300962 21.217800890610626 21.40123909412179 20.76401311829908 21.353083591808037 22.590306571529695 22.296490089026467 21.179303850916178 22.512765115078853 22.295437793510985 22.18286477625634 21.74943153383085 19.793973766718025 22.23563182717118 22.112988990535534 21.976045104263264 21.661820213912208 20.15594704098647 20.880064968359605 22.816038511084383 22.780802128472413 20.28987662046071 20.61739646390535 22.05156594063359 21.33316156327461 22.036956945445283 22.311985688358064 22.004977871353518 PC(36:4) 25.96095415783786 25.837906978116486 25.845237647070224 25.071984052645274 25.447586077034774 24.634767990972097 26.741312625399686 26.596633593337497 24.711703272559134 26.439147545414514 26.602640167704813 26.605356785631507 26.040027135200706 23.979441935928186 26.14216957290596 25.00557924929897 26.01166747692227 26.20383565535117 24.25256823219589 25.055881072101197 26.865711577738576 26.612314641326364 24.35769090479772 24.939752651223326 25.11050208583332 25.69410110439965 25.27815720879245 26.67348493 25.988187698726737 PC(38:4) 22.69782889867154 22.920605404142247 22.85592880386083 21.88590329879486 22.316055954741206 21.622760899113842 23.763853913595923 23.644684880770864 21.74225586280571 22.848866160389203 23.791302723172024 23.795217405972416 22.759576754508675 20.896379035391554 22.385130522245657 22.28052974384205 22.718629725370256 23.314477981839687 21.055486073688666 21.93669746149388 23.194683957609683 23.098015237320187 21.24347987529381 21.699440286423417 22.059940782682077 22.21967143514112 22.168291373269845 23.877723051380983 22.731640020067644 PC(38:6) 21.205621673989782 20.807449394808586 20.76462209225997 20.876256800025075 20.356683688855057 20.385375269384873 21.97220655107173 21.741142153132753 20.58546435496652 21.49378975 21.657485379580002 21.69332648 21.140432681272525 19.133872242489613 21.317654456796458 20.826276676192258 21.119935454910777 21.345945505656093 19.175945619224432 20.37515740736992 21.923147214934023 21.856145428915134 19.623138020719175 20.478909016476997 20.52780649870201 20.69437770068946 20.797003561265452 21.80481798575207 21.289384680092184 PC(40:5) 17.499077101563486 17.488416414322845 17.27487187830823 16.87538392514946 16.879587287791853 16.93110841675023 18.318363817093804 18.14047685536372 16.96829728424668 17.48411413463175 18.23068677604326 18.420640187816655 17.46366368580381 15.938447709513305 17.1451418 17.573505308316857 17.545976471412544 17.84051529158944 15.885437701797402 16.765358043670002 17.752954950852434 17.853650417585794 16.075462223603477 16.61585094 17.302328708271126 16.875356105326908 17.424259705657782 18.178417641227497 17.47308267 PC(40:6) 19.86689987 19.96533934877787 19.769108105115915 19.830749264831628 19.298504149327695 19.24137229353707 20.653332603800937 20.527084094902925 19.728101243798115 19.711482946554035 20.610638387851683 20.70238634296885 19.729202599974577 18.096598394271634 19.40312118793158 19.883355451994575 19.93049860658937 20.385388777987966 18.116267680681535 19.48108728990532 20.03991534 20.057104605377905 18.363460048631165 19.422284458888015 19.578164203495067 19.442067481628452 19.81434772947564 20.758683757504695 19.83082654 PC(O-16:0/0:0) 17.093414133812445 17.21671698865806 16.97648544656656 17.05174478571949 17.269386396048667 16.404423394870143 17.27142175875005 16.741228187310607 16.967843194929294 17.173982116988476 17.273635041470286 17.140524655866912 16.897269182623713 17.34846913235368 17.441258256703485 17.311261899198247 17.25253918026705 16.862363583933888 17.32367156098265 17.25227709631085 17.33386611847908 16.884096551081445 17.05280170544173 17.27416649218448 16.953147071241766 17.587751916455844 16.894886037012228 16.56738642227402 17.201121154795594 PC(O-16:0/2:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA PC(O-18:0/2:0) 14.605301077204587 14.111816892962354 13.519618809156402 14.491178258811399 14.429249764112228 14.050501839712611 14.189187601964447 14.559000190667208 14.668267757700296 14.478833636318223 15.319156839563826 14.859331795595438 14.05283552 14.15483371639869 14.57171518205482 14.890464637098598 14.911943718393584 15.083557156475116 14.144849356214381 14.120027052445785 14.733567173304413 14.348500500206965 13.959241231583784 14.10990644937987 14.85216046 13.63216743621424 15.11559678 13.900753994254718 14.905190106635581 PE(15:0/18:1(d7)) 22.583039700306497 22.53582049455672 22.575975287991476 22.589605039906186 22.583703625428466 22.69198214493459 22.501970896575113 22.653469759784265 22.598129901599535 22.517242772642344 22.60859238 22.61456589406894 22.546789173168946 22.53014859270271 22.303501915433102 22.51586787759604 22.529388059441324 22.57609280474523 22.53295473710574 22.632348392184777 22.538926028109447 22.549137159710078 22.61679161679867 22.669103869368907 22.51816277392281 22.628113990131396 22.679329451985378 22.605637437397682 22.605063138723423 PE(18:0/20:4(OH[S])) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA PE(18:0/20:4(OOH[S])) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA PE(34:1) 19.134563331468602 17.31638293740803 17.02408377730717 18.239781986866603 17.120942561917428 18.392369117624124 19.481678093359868 19.046731096607378 18.402629321544907 19.357280504197313 18.411540339241903 18.642229307904213 18.674143874298956 16.794064490345416 19.17303407377819 19.24363744 19.089277655220304 17.913926496774987 16.369994620950997 17.54062410688666 19.83516564 19.59973739411384 16.305949663520238 17.71518014464431 19.10834099961335 18.133319589468993 19.063339420261272 18.43626669784594 19.007562749467795 PE(36:1) 19.33270001440739 17.730991796688585 17.605188926288147 18.34111935826077 17.409692306994256 19.15848396232843 18.9273967 18.790061575365275 18.808624788179298 18.053569792520104 19.009130588247867 18.961296432159585 17.786711500846472 17.04576880619123 17.55156743 20.031827073915963 19.422425757972253 18.316284055954863 16.962732540955024 17.25904067454152 18.483120699703623 18.393599330933228 16.825345124913326 17.48411389710409 19.916863571826973 17.18717130628011 19.480793919282387 18.90040754186003 19.345522555917952 PE(36:2) 19.190994976134952 16.666229763460407 16.916289029834306 18.515914630632256 16.423219012399464 19.24355493441216 18.862008670032058 18.48884365758811 18.944627027774384 18.781983587728035 17.95909393927531 18.24545209296834 18.03881763194831 16.564957444500706 18.851961649303846 20.299044642621347 19.10520065120853 17.715440950905716 16.99815803013242 17.395540094162946 19.24936050858989 19.143502768690098 16.73684801432494 17.267996136704785 20.143871659768482 17.54654184076137 20.030385578179096 18.127816454003586 19.066440349496236 PE(36:4) 19.444896412013577 18.489172523758732 18.613572566231635 18.20650243074182 18.279492990773107 18.12449415680241 20.28885399085096 19.864879746888548 18.22286635841719 20.262649273586156 19.418186407026873 19.622076520728744 19.61944490338731 17.24131857159763 20.009497707011093 18.537048597695613 19.452360323792856 19.091343037426395 17.082954811378368 18.184935603859916 20.618387589836566 20.530414944095018 17.252823287739332 18.11731954317953 18.430133362809674 19.158905000852965 18.72613313816038 19.59071277202971 19.364968206306585 PE(38:4) 20.891598629486598 20.30140280834452 20.46466876027748 20.13048173 19.982990652937612 20.111851531501454 21.633000883241657 21.345802697309324 20.29692409825156 20.83971332 21.349994467910314 21.406883414844057 20.735721939910547 19.13870210668085 20.360106492560732 20.789734673963466 20.68707283968005 21.00638354223208 19.345871252262214 19.873352906846293 21.164001644231384 21.149330683781464 19.22433222 19.84667311148177 20.55369083275311 20.110758705149816 20.619236279177038 21.418134111078743 20.79537703436094 PE(38:5) 18.83213907 18.167996903589703 18.045852514395374 17.968067424562026 17.775072313937375 18.191325905067238 19.353296801462893 19.15529502228643 17.92716118472016 19.062257502349986 18.901413532998625 19.330157009007557 18.73813937033039 16.592318375288052 19.133597666559062 19.117223617054368 18.81276518349235 18.690836103734817 16.790852321952862 17.47932001455893 19.63506233216533 19.548876292062438 16.920683534395632 17.31933043610983 18.790174133569522 18.107969424923294 19.028866459844508 19.042445123999727 18.866866720988547 PE(38:6) 20.670912403677132 19.529584742888936 19.697874338837533 20.110092790580623 19.300299277153098 19.846211691465083 21.288882563663503 20.950500779225578 20.115605016271548 21.216346723784863 20.33361714122786 20.607150611732028 20.585532024779162 18.500652254578767 21.101699846703635 20.760879926686222 20.699084670624416 20.29483524 18.35523952872024 19.719867007938973 21.529331494659775 21.478826367305434 18.707475062814467 19.76626237 20.039947169090397 20.218113460116683 20.41482678641506 20.496960048899645 20.714040994817832 PE(40:4) 18.287314477032027 17.131049458178897 17.006988197780622 17.746428668020535 16.37866670978848 18.157277349228025 18.77596454408168 18.37990380429303 17.987596912285117 17.779262904256505 18.355558068840516 18.279568517729416 17.569139626123132 16.67204608945862 17.27629481 18.785490359928712 18.15330819114925 17.893610220446025 16.732207623306554 17.401646751550786 18.13473548680859 18.080404052339677 16.902136462614894 17.389784110374386 18.53880285925642 16.828721024448065 18.358086132379757 18.17149194746428 18.07613563498078 PE(40:5) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA PE(40:6) 20.397243602955413 20.132992821972305 20.299031968658714 20.20864054248563 19.858233600795298 19.874038757707442 21.21995347114404 21.145637888134353 20.282989217389115 20.095720592868144 21.094502895318257 21.239983350920692 20.283169645919763 18.736913343118996 19.817662593523764 20.55483892251538 20.468939516727048 20.871709429982676 18.819960559118755 19.76216651249143 20.558504006435808 20.647400173705073 18.86481678331251 19.65263669938397 20.138503419927076 19.62386691547061 20.305892477646715 21.111157279483706 20.472884632982247 PE(40:7) 19.506416789827604 18.55653698267268 18.48272693711619 18.747315230682403 18.307659249603923 18.58649887148294 19.993652291440455 19.795436815126834 18.732265697317775 19.92275117139718 19.359155539266247 19.44475571073752 19.442261917493667 17.244924690477397 19.73165186716372 19.233858454599712 19.576732375292952 18.974413143286945 17.277945271820933 18.172564866663574 20.27357769203458 20.323888797533325 17.642080504245335 18.402383720396934 19.02247038725058 19.100511540589505 19.215901966462717 19.41080687873193 19.37224870228126 Sitosteryl hexoside 14.366190717865821 13.977277324992993 12.147204919084794 12.147204924942232 11.092757135170224 11.784634845517045 13.14720492494162 12.85174904141606 13.250298417906336 13.458406613236532 13.199672344836364 10.983385243586003 11.479778176710434 13.225326454079864 12.88410171609411 13.346513733165635 13.962173031109709 11.915731886883597 12.784634845557523 12.884170519108434 11.09298568590262 NA 10.562242424221083 12.784634794277984 12.39220795326688 13.915879378816218 13.640339847247734 11.562242424188494 13.250296547028363 SM(d18:1(d9)/18:1) 26.11855942215299 26.114568375584682 26.174139241557725 26.150465518861978 26.181936656019804 26.179970067829455 26.10874159321157 26.26186377916953 26.17461424259536 26.088740376906504 26.230673216405602 26.262255173469907 26.17492768 26.008942902212198 26.01035133020401 26.234919697482017 26.165459562502587 26.127818544977124 26.162934937622257 26.17088321421515 26.156313253985953 26.176038873968096 26.12198423840845 26.175142818583755 26.21290034976956 26.161164625495655 26.26179848612328 26.23200041 26.11609293435646 SM(d18:1/16:0) 22.07899524947019 21.556001138426403 21.534684098869242 22.245979865748986 21.289073794108795 22.157407786436814 22.145801565682895 21.906638854886744 21.949397796192528 21.9625682 21.903974557090642 22.036715073453422 21.605551973632302 21.529927085925987 21.662829488034244 22.894206030601115 22.18034013708325 21.728673604427303 21.606918126763013 21.815142997092657 22.264796956531068 22.057477654626144 21.837229232964727 21.633653098025636 22.686243578148506 21.33832121663612 22.161249940256177 21.808182417858177 22.04686003884368 SM(d18:1/18:0) 20.009199133306517 19.37550228086533 19.333894384726722 19.501242505654705 18.808832994981913 19.467252540132343 20.318214068454225 20.13567573737359 19.382744014129027 19.410866236803717 19.985977077415537 20.308049749471838 19.204087738415414 18.186540471419992 18.889262416934685 19.973216908243085 20.034978884440054 19.952693542116858 18.155273578425124 18.840380492834438 19.706576377345616 19.54074926895371 18.545219822125897 19.045639789992524 19.774506660237016 18.570019518871383 19.75164275005162 20.13675237503586 19.948501745067677 SM(d18:1/24:0) 18.655103821605913 18.43298500603938 18.157303866375894 17.256655720423172 17.845638520975825 17.66138906376687 18.79296224369694 18.63190787881432 17.62337042666809 17.652457992246518 18.899602000327963 19.104070768613536 17.78999466474882 17.117885358127374 17.500985396784333 18.264740118784072 18.419186366219908 18.669189117641142 17.077010117908834 17.49967857274827 18.35517761240918 18.18552006470251 16.80577147432702 17.29913949686504 17.80748600052947 16.943775454325166 17.72166347086923 18.984490281904094 18.434579149410823 SM(d18:1/24:1) 20.73911901496357 20.40769239407014 20.334201922161792 20.146973766955757 19.865560111488158 20.256927842504222 21.08578653465816 20.781455037000327 19.981950603106803 20.378309128203288 20.821353429842585 21.158449631987924 20.24705577902872 19.484973910301214 19.86296341321547 20.98782121500304 20.732614035095718 20.82298643584625 19.46583328779904 19.732600980571807 20.67145542829052 20.53327114408522 19.557595833004633 19.484186215301644 20.810978150770296 19.46980900441879 20.59434978406204 20.893410157278463 20.697284 Sphinganine NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Sphinganine 1-phosphate NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Sphingosine NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Sphingosine 1-phosphate NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Sphingosine 1-phosphate-d7 NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Sphingosine 1-phosphocholine NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA Sphingosine(d17:1) 18.109936677486388 18.138419463690305 18.06704326050909 18.027674066055162 17.866553075958723 17.858346589881943 18.07614863726003 18.089143441696745 17.926518827720823 17.992295517664406 18.207399798928066 18.01364090121132 17.851389848023803 17.888192640354422 17.974587470433786 17.78582936 17.892335948125528 17.81896450170762 17.769517793431966 18.035187517503864 17.86994226417355 17.85503674220003 17.945751710945505 17.85281749113984 17.85843863170556 17.931732492686155 17.90313801024336 17.933690575145693 17.92884289183648 TG(15:0/18:1(d7)/15:0) 20.834464985052335 20.44321277520579 21.596204056810837 21.152827115570332 21.465672272700022 22.066622952313246 20.332746111187248 22.502752539299014 21.826659267740837 20.588122802332045 23.427029979506827 22.250027452627066 20.653198345733102 20.40262176 19.17732201 21.64974618167914 20.75490891685795 21.02074902334858 21.047935643953192 21.30136367266243 20.693959372909866 21.473287030122087 21.115034931496048 22.36627750584206 20.789998577363754 20.73094012586498 21.93411689862742 22.042507134643582 20.749594792278263 TG(18:0_36:2) 12.59692024 12.996060675598697 13.931102035486555 12.921938490590852 14.151404679925434 13.202655350912451 13.832276467386443 13.842980733646623 13.57250922 14.05582268969068 13.919693575293419 13.88301481624746 13.763932841713398 13.31910472031938 13.454406329055784 12.764414510261007 13.921966327591655 13.47436751182095 13.369776191011615 13.960124412831888 13.288820613207651 13.856963398417882 13.435081816851017 13.293762683424633 14.163789136437106 14.637440764219724 14.415584653442384 13.807939512330952 14.388041814970954 TG(18:1_34:2) 14.48060084167219 14.356956562263024 14.615152590126268 14.281463322338006 14.772457291839736 14.254024879821547 14.78831622643687 14.416152813305038 14.78518544981738 14.933350209224045 16.16095599508391 14.537173244242547 14.458949834097323 14.069815451688882 14.186181045111667 14.935097008943636 14.682755496610278 14.50492962647119 14.447367059842763 13.95425290313582 14.178446563740465 14.33313282036155 14.693990653180977 14.732189557620378 14.725318225068355 13.908043219257303 14.415944395863226 14.26243866427215 14.681059858011656 TG(18:1_34:3) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(20:4_32:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(20:4_34:2) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(20:4_34:3) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(20:4_36:0) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(20:4_36:2) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(20:4_36:3) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(22:6_36:2) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(22:6_38:1) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA TG(22:6_38:2) NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA NA MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name internal standard Expected RT precursor (m/z) product (m/z) 1-O-Palmitoyl-Cer(d18:1/18:0) Cer(d18:1/16:0(d7)) 8.1 786.8 502.5 24-Hydroxycholesterol 24-Hydroxycholesterol(d7) 2 385.3 367.3 24-Hydroxycholesterol(d7) NA 2 392.3 367.3 3-O-SulfoLacCer(d18:1/18:0) LacCer(d18:1/17:0) 5.2 970.8 548.5 4-beta-Hydroxycholesterol Cholesterol(d7) 2.14 420.3 385.3 7-keto-Cholesterol Cholesterol(d7) 3.1 401.3 383.3 CE HETE CE(18:1(d7)) 7.27 706.6 369.2 CE HODE CE(18:1(d7)) 7.32 682.6 369.2 CE HpODE CE(18:1(d7)) 6.76 698.6 369.2 CE oxoHETE CE(18:1(d7)) 6.65 704.6 369.2 CE oxoODE CE(18:1(d7)) 6.73 680.6 369.2 CE(16:1) CE(18:1(d7)) 8.38 640.6 369.3 CE(18:1(d7)) NA 8.43 675.2 369.4 CE(18:1) CE(18:1(d7)) 8.52 668.6 369.3 CE(18:2) CE(18:1(d7)) 8.31 666.6 369.3 CE(20:4) CE(18:1(d7)) 8.19 690.6 369.3 CE(20:5) CE(18:1(d7)) 7.87 688.6 369.3 CE(22:6) CE(18:1(d7)) 7.94 714.6 369.3 Cer(d18:0/16:0) Cer(d18:1/16:0(d7)) 6.3 540.6 284.3 Cer(d18:0/18:0) Cer(d18:1/16:0(d7)) 6.5 568.7 284.3 Cer(d18:0/24:0) Cer(d18:1/16:0(d7)) 7.52 652.9 284.3 Cer(d18:0/24:1) Cer(d18:1/16:0(d7)) 7.2 650.9 284.4 Cer(d18:1/16:0(d7)) NA 5.71 545.5 271.4 Cer(d18:1/16:0) Cer(d18:1/16:0(d7)) 5.68 538.5 264.3 Cer(d18:1/18:0) Cer(d18:1/16:0(d7)) 6.15 566.6 264.3 Cer(d18:1/24:0) Cer(d18:1/16:0(d7)) 7.27 650.6 264.3 Cer(d18:1/24:1) Cer(d18:1/16:0(d7)) 6.85 648.6 264.3 Cholesterol Cholesterol(d7) 5.18 369.3 369.3 Cholesterol(d7) NA 5.17 376.2 376.2 Cholesteryl hexoside CE(18:1(d7)) 3.87 566.6 369.3 Coenzyme Q10 TG(15:0/18:1(d7)/15:0) 7.6 863.3 197.2 DG(15:0/18:1(d7)) NA 6.19 605.6 346.5 DG(16:0_18:1) DG(15:0/18:1(d7)) 6.4 612.4 313.3 DG(16:0_20:4) DG(15:0/18:1(d7)) 5.91 634.5 313.3 DG(18:0_18:1) DG(15:0/18:1(d7)) 6.76 640.4 341.3 DG(18:0_20:4) DG(15:0/18:1(d7)) 6.36 662.5 341.3 DG(18:0_22:6) DG(15:0/18:1(d7)) 5.94 686.6 341.3 DG(18:1/18:1) DG(15:0/18:1(d7)) 6.4 638.4 339.3 DG(18:1_20:4) DG(15:0/18:1(d7)) 5.9 660.5 339.3 GB3(d18:1/16:0) GB3(d18:1/18:0(d3)) 5 1025 520.5 GB3(d18:1/18:0(d3)) NA 5.51 1056 551.6 GB3(d18:1/18:0) GB3(d18:1/18:0(d3)) 5.5 1053 548.6 GB3(d18:1/24:0) GB3(d18:1/18:0(d3)) 6.77 1137 632.6 GB3(d18:1/24:1) GB3(d18:1/18:0(d3)) 6.33 1135 630.6 GlcCer(d18:1(d5)/18:0) NA 5.78 733.6 269.3 HexCer(d18:1/12:0) GlcCer(d18:1(d5)/18:0) 4.2 644.5 264.3 GlcCer(d18:1/16:0(d3)) NA 5.36 703.7 264.3 Glucosylsphingosine(d5) NA 1.52 467.2 269.3 HexCer(d18:1/16:0) GlcCer(d18:1(d5)/18:0) 5.37 700.6 264.3 HexCer(d18:1/18:0) GlcCer(d18:1(d5)/18:0) 5.77 728.6 264.3 HexCer(d18:1/22:0) GlcCer(d18:1(d5)/18:0) 6.58 784.7 264.4 HexCer(d18:1/24:0) GlcCer(d18:1(d5)/18:0) 6.9 812.7 264.3 HexCer(d18:1/24:1) GlcCer(d18:1(d5)/18:0) 6.54 810.7 264.3 Hexosylsphingosine Glucosylsphingosine(d5) 1.3 462.3 264.2 LacCer(d18:1/16:0) GlcCer(d18:1(d5)/18:0) 5.19 862.6 264.3 LacCer(d18:1/17:0) NA 5.46 876.6 264.3 LacCer(d18:1/18:0) GlcCer(d18:1(d5)/18:0) 5.68 890.7 264.3 LacCer(d18:1/24:0) GlcCer(d18:1(d5)/18:0) 6.82 974.8 264.3 LacCer(d18:1/24:1) GlcCer(d18:1(d5)/18:0) 6.45 972.7 264.3 Lactosylsphingosine Glucosylsphingosine(d5) 1.4 624.4 264.3 LPC(16:0) LPC(18:1(d7)) 2 496.3 184.1 LPC(16:1) LPC(18:1(d7)) 1.63 494.5 184.1 LPC(18:0) LPC(18:1(d7)) 2.55 524.3 184.1 LPC(18:1(d7)) NA 2.04 529.3 184.1 LPC(18:1) LPC(18:1(d7)) 2.05 522.3 184.1 LPC(20:4) LPC(18:1(d7)) 1.64 544.3 184.1 LPC(22:6) LPC(18:1(d7)) 1.57 568.3 184.1 LPC(24:0) LPC(18:1(d7)) 4.28 608.5 184.1 LPC(24:1) LPC(18:1(d7)) 3.6 606.5 184.1 LPC(26:0) LPC(18:1(d7)) 5.06 636.5 104.1 LPC(26:1) LPC(18:1(d7)) 4.27 634.5 104.1 lyso-GB3 lyso-GB3-d7 1.16 786.6 282.2 lyso-GB3-d7 NA 1.38 793.5 289.3 lyso-GB4 lyso-GB3-d7 1.04 990.6 282.2 MG(16:0) MG(18:1(d7)) 2.48 348.3 239.3 MG(16:1) MG(18:1(d7)) 2 346.3 237.3 MG(18:0) MG(18:1(d7)) 3.04 376.3 267.3 MG(18:1(d7)) NA 2.73 381.3 272.5 MG(18:1) MG(18:1(d7)) 2.74 374.3 265.3 MG(20:4) MG(18:1(d7)) 1.96 396.3 287.3 N-Oleoylethanolamine LPC(18:1(d7)) 2.17 326.3 62.1 N-Palmitoyl-O-phosphocholineserine LPC(18:1(d7)) 1.89 509.5 184.1 Palmitoylethanolamine LPC(18:1(d7)) 2.11 300.3 62.1 PC(15:0/18:1(d7)) NA 5.37 754.6 184.1 PC(16:0/5:0(CHO)) PC(15:0/18:1(d7)) 1.95 594.5 184.1 PC(16:0/9:0(CHO)) PC(15:0/18:1(d7)) 2.21 650.4 184.1 PC(16:0/9:0(COOH)) PC(15:0/18:1(d7)) 2.04 666.4 184.1 PC(18:0/20:4(OH[S])) PC(15:0/18:1(d7)) 4.31 826.6 184.1 PC(18:0/20:4(OOH[S])) PC(15:0/18:1(d7)) 4.24 842.6 184.1 PC(34:1) PC(15:0/18:1(d7)) 5.7 760.6 184.1 PC(36:1) PC(15:0/18:1(d7)) 6.1 788.6 184.1 PC(36:2) PC(15:0/18:1(d7)) 5.69 786.6 184.1 PC(36:4) PC(15:0/18:1(d7)) 5.16 782.6 184.1 PC(38:4) PC(15:0/18:1(d7)) 5.59 810.6 184.1 PC(38:6) PC(15:0/18:1(d7)) 4.92 806.6 184.1 PC(40:5) PC(15:0/18:1(d7)) 5.61 836.6 184.1 PC(40:6) PC(15:0/18:1(d7)) 5.46 834.6 184.1 PC(O-16:0/0:0) LPC(18:1(d7)) 1.77 482.3 184.1 PC(O-16:0/2:0) LPC(18:1(d7)) 1.56 524.3 184.2 PC(O-18:0/2:0) LPC(18:1(d7)) 2.54 552.5 184.1 PE(15:0/18:1(d7)) NA 5.52 711.6 570.5 PE(18:0/20:4(OH[S])) PE(15:0/18:1(d7)) 4.28 784.5 643.4 PE(18:0/20:4(OOH[S])) PE(15:0/18:1(d7)) 4.23 800.5 659.4 PE(34:1) PE(15:0/18:1(d7)) 5.8 718.6 577.6 PE(36:1) PE(15:0/18:1(d7)) 6.22 746.6 605.5 PE(36:2) PE(15:0/18:1(d7)) 5.85 744.6 603.5 PE(36:4) PE(15:0/18:1(d7)) 5.3 740.6 599.5 PE(38:4) PE(15:0/18:1(d7)) 5.77 768.6 627.5 PE(38:5) PE(15:0/18:1(d7)) 5.31 766.6 625.5 PE(38:6) PE(15:0/18:1(d7)) 5.07 764.6 623.5 PE(40:4) PE(15:0/18:1(d7)) 6.01 796.6 655.5 PE(40:5) PE(15:0/18:1(d7)) 5.8 794.6 635.5 PE(40:6) PE(15:0/18:1(d7)) 5.59 792.6 651.5 PE(40:7) PE(15:0/18:1(d7)) 5.15 790.6 649.5 Sitosteryl hexoside CE(18:1(d7)) 4.45 594.6 397.4 SM(d18:1(d9)/18:1) NA 5.24 738.7 184.1 SM(d18:1/16:0) SM(d18:1(d9)/18:1) 5.22 703.6 184.1 SM(d18:1/18:0) SM(d18:1(d9)/18:1) 5.74 731.6 184.1 SM(d18:1/24:0) SM(d18:1(d9)/18:1) 6.9 815.7 184.1 SM(d18:1/24:1) SM(d18:1(d9)/18:1) 6.5 813.7 184.1 Sphinganine Sphingosine(d17:1) 1.88 302.2 284.3 Sphinganine 1-phosphate Sphingosine 1-phosphate-d7 1.68 382.3 284.3 Sphingosine Sphingosine(d17:1) 1.68 300.2 264.3 Sphingosine 1-phosphate Sphingosine 1-phosphate-d7 1.45 380.3 264.3 Sphingosine 1-phosphate-d7 NA 1.53 387.3 271.3 Sphingosine 1-phosphocholine LPC(18:1(d7)) 1.12 465.5 184.1 Sphingosine(d17:1) NA 1.52 286.2 250.3 TG(15:0/18:1(d7)/15:0) NA 8.15 829.8 570.8 TG(18:0_36:2) TG(15:0/18:1(d7)/15:0) 8.55 904.7 603.4 TG(18:1_34:2) TG(15:0/18:1(d7)/15:0) 8.14 874.7 575.4 TG(18:1_34:3) TG(15:0/18:1(d7)/15:0) 7.95 872.7 573.4 TG(20:4_32:1) TG(15:0/18:1(d7)/15:0) 7.78 870.6 549.3 TG(20:4_34:2) TG(15:0/18:1(d7)/15:0) 7.94 896.6 575.3 TG(20:4_34:3) TG(15:0/18:1(d7)/15:0) 7.68 894.6 573.3 TG(20:4_36:0) TG(15:0/18:1(d7)/15:0) 8.18 928.8 607.5 TG(20:4_36:2) TG(15:0/18:1(d7)/15:0) 7.95 924.7 603.4 TG(20:4_36:3) TG(15:0/18:1(d7)/15:0) 7.9 922.7 601.4 TG(22:6_36:2) TG(15:0/18:1(d7)/15:0) 7.86 948.7 603.4 TG(22:6_38:1) TG(15:0/18:1(d7)/15:0) 8.29 978.7 633.4 TG(22:6_38:2) TG(15:0/18:1(d7)/15:0) 8.1 976.7 631.4 METABOLITES_END #END