#METABOLOMICS WORKBENCH andrewpatt_20200522_094120 DATATRACK_ID:2018 STUDY_ID:ST001405 ANALYSIS_ID:AN002348 PROJECT_ID:000000 VERSION 1 CREATED_ON June 22, 2020, 2:47 pm #PROJECT PR:PROJECT_TITLE MDM2-Dependent Rewiring of Metabolomic and Lipidomic Profiles in PR:PROJECT_TITLE Dedifferentiated Liposarcoma(DDLPS) Models PR:PROJECT_SUMMARY Dedifferentiated liposarcoma (DDLPS) is an aggressive mesenchymal cancer marked PR:PROJECT_SUMMARY by amplification of MDM2, an inhibitor of the tumor suppressor TP53. DDLPS PR:PROJECT_SUMMARY patients with higher MDM2 amplification have lower chemotherapy sensitivity and PR:PROJECT_SUMMARY worse outcome than patients with lower MDM2 amplification. We hypothesized that PR:PROJECT_SUMMARY MDM2 amplification levels may be associated with changes in DDLPS metabolism. PR:PROJECT_SUMMARY Six patient-derived DDLPS cell line models were subject to comprehensive PR:PROJECT_SUMMARY metabolomic (Metabolon) and lipidomic (SCIEX 5600 TripleTOF-MS) profiling to PR:PROJECT_SUMMARY assess associations with MDM2 amplification and their responses to metabolic PR:PROJECT_SUMMARY perturbations. Comparing metabolomic profiles between MDM2 higher and lower PR:PROJECT_SUMMARY amplification cells yielded a total of 23 differentially abundant metabolites PR:PROJECT_SUMMARY across both panels (FDR < 0.05, log2 FC < 0.75), including ceramides, PR:PROJECT_SUMMARY glycosylated ceramides, and sphingomyelins. Disruption of lipid metabolism PR:PROJECT_SUMMARY through statin administration resulted in a chemo-sensitive phenotype in MDM2 PR:PROJECT_SUMMARY lower cell lines only, suggesting that lipid metabolism may be a large PR:PROJECT_SUMMARY contributor to the more aggressive nature of MDM2 higher DDLPS tumors. This PR:PROJECT_SUMMARY study is the first to provide comprehensive metabolomic and lipidomic PR:PROJECT_SUMMARY characterization of DDLPS cell lines and provides evidence for MDM2-dependent PR:PROJECT_SUMMARY differential molecular mechanisms that are critical factors in chemoresistance PR:PROJECT_SUMMARY and could thus affect patient outcome. PR:INSTITUTE The Ohio State University PR:LAST_NAME Andrew Patt PR:FIRST_NAME Andrew Patt PR:ADDRESS 136 W. Pacemont Rd, Columbus, OH, 43202, USA PR:EMAIL patt.14@osu.edu PR:PHONE 518-366-4293 #STUDY ST:STUDY_TITLE MDM2-Dependent Rewiring of Metabolomic and Lipidomic Profiles in ST:STUDY_TITLE Dedifferentiated Liposarcoma Models ST:STUDY_SUMMARY Dedifferentiated liposarcoma (DDLPS) is an aggressive mesenchymal cancer marked ST:STUDY_SUMMARY by amplification of MDM2, an inhibitor of the tumor suppressor TP53. DDLPS ST:STUDY_SUMMARY patients with higher MDM2 amplification have lower chemotherapy sensitivity and ST:STUDY_SUMMARY worse outcome than patients with lower MDM2 amplification. We hypothesized that ST:STUDY_SUMMARY MDM2 amplification levels may be associated with changes in DDLPS metabolism. ST:STUDY_SUMMARY Six patient-derived DDLPS cell line models were subject to comprehensive ST:STUDY_SUMMARY metabolomic (Metabolon) and lipidomic (SCIEX 5600 TripleTOF-MS) profiling to ST:STUDY_SUMMARY assess associations with MDM2 amplification and their responses to metabolic ST:STUDY_SUMMARY perturbations. Comparing metabolomic profiles between MDM2 higher and lower ST:STUDY_SUMMARY amplification cells yielded a total of 23 differentially abundant metabolites ST:STUDY_SUMMARY across both panels (FDR < 0.05, log2 FC < 0.75), including ceramides, ST:STUDY_SUMMARY glycosylated ceramides, and sphingomyelins. Disruption of lipid metabolism ST:STUDY_SUMMARY through statin administration resulted in a chemo-sensitive phenotype in MDM2 ST:STUDY_SUMMARY lower cell lines only, suggesting that lipid metabolism may be a large ST:STUDY_SUMMARY contributor to the more aggressive nature of MDM2 higher DDLPS tumors. This ST:STUDY_SUMMARY study is the first to provide comprehensive metabolomic and lipidomic ST:STUDY_SUMMARY characterization of DDLPS cell lines and provides evidence for MDM2-dependent ST:STUDY_SUMMARY differential molecular mechanisms that are critical factors in chemoresistance ST:STUDY_SUMMARY and could thus affect patient outcome. ST:INSTITUTE The Ohio State University ST:LAST_NAME Patt ST:FIRST_NAME Andrew ST:ADDRESS 136 W. Pacemont Rd, Columbus, OH, 43202, USA ST:EMAIL patt.14@osu.edu ST:PHONE 5183664293 #SUBJECT SU:SUBJECT_TYPE Cultured cells SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 #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 - LIPNEG17MAR_01.BLANK.1 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_01.BLANK.1.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_02.POOL.1 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_02.POOL.1.mzML LIPNEG17MAR_02.ms2 SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_83.83 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPNEG17MAR_83.83.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_84.39 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPNEG17MAR_84.39.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_07.73 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPNEG17MAR_07.73.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_09.38 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPNEG17MAR_09.38.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_10.111 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPNEG17MAR_10.111.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_11.191 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPNEG17MAR_11.191.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_12.74 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPNEG17MAR_12.74.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_15.118 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPNEG17MAR_15.118.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_16.12 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPNEG17MAR_16.12.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_18.146 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPNEG17MAR_18.146.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_20.BLANK.2 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_20.BLANK.2.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_21.POOL.2 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_21.POOL.2.mzML LIPNEG17MAR_21.ms2 SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_25.110 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPNEG17MAR_25.110.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_27.37 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPNEG17MAR_27.37.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_30.75 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPNEG17MAR_30.75.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_31.46 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPNEG17MAR_31.46.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_32.119 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPNEG17MAR_32.119.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_33.47 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPNEG17MAR_33.47.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_37.154 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPNEG17MAR_37.154.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_38.183 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPNEG17MAR_38.183.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_39.192 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPNEG17MAR_39.192.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_40.190 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPNEG17MAR_40.190.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_42.BLANK3 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_42.BLANK3.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_43.POOL.3 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_43.POOL.3.mzML LIPNEG17MAR_43.ms2 SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_47.1 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPNEG17MAR_47.1.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_51.145 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPNEG17MAR_51.145.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_52.3 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPNEG17MAR_52.3.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_53.109 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPNEG17MAR_53.109.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_56.10 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPNEG17MAR_56.10.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_57.155 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPNEG17MAR_57.155.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_58.156 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPNEG17MAR_58.156.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_59.48 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPNEG17MAR_59.48.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_60.84 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPNEG17MAR_60.84.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_62.BLANK.4 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_62.BLANK.4.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_63.POOL.4 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_63.POOL.4.mzML LIPNEG17MAR_63.ms2 SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_67.181 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPNEG17MAR_67.181.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_69.11 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPNEG17MAR_69.11.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_70.182 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPNEG17MAR_70.182.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_71.2 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPNEG17MAR_71.2.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_72.147 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPNEG17MAR_72.147.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_76.120 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPNEG17MAR_76.120.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_77.82 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPNEG17MAR_77.82.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_89.BLANK.5 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_89.BLANK.5.mzML SUBJECT_SAMPLE_FACTORS - LIPNEG17MAR_90.POOL.5 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPNEG17MAR_90.POOL.5.mzML LIPNEG17MAR_90.ms2 SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_01.BLANK.1 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_01.BLANK.1.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_02.POOL.1 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_02.POOL.1.mzML LIPPOS17MAR_02.ms2 SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_04.83 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPPOS17MAR_04.83.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_05.39 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPPOS17MAR_05.39.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_07.73 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPPOS17MAR_07.73.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_09.38 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPPOS17MAR_09.38.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_10.111 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPPOS17MAR_10.111.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_11.191 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPPOS17MAR_11.191.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_12.74 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPPOS17MAR_12.74.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_15.118 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPPOS17MAR_15.118.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_16.12 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPPOS17MAR_16.12.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_18.146 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPPOS17MAR_18.146.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_20.BLANK.2 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_20.BLANK.2.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_21.POOL.2 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_21.POOL.2.mzML LIPPOS17MAR_21.ms2 SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_25.110 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPPOS17MAR_25.110.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_27.37 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPPOS17MAR_27.37.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_30.75 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPPOS17MAR_30.75.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_31.46 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPPOS17MAR_31.46.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_32.119 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPPOS17MAR_32.119.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_33.47 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPPOS17MAR_33.47.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_37.154 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPPOS17MAR_37.154.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_38.183 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPPOS17MAR_38.183.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_39.192 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPPOS17MAR_39.192.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_40.190 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPPOS17MAR_40.190.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_42.BLANK3 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_42.BLANK3.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_43.POOL.3 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_43.POOL.3.mzML LIPPOS17MAR_43.ms2 SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_47.1 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPPOS17MAR_47.1.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_51.145 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPPOS17MAR_51.145.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_52.3 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPPOS17MAR_52.3.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_53.109 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPPOS17MAR_53.109.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_56.10 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPPOS17MAR_56.10.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_57.155 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPPOS17MAR_57.155.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_58.156 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPPOS17MAR_58.156.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_59.48 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 RAW_FILE_NAME=LIPPOS17MAR_59.48.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_60.84 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPPOS17MAR_60.84.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_62.BLANK.4 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_62.BLANK.4.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_63.POOL.4 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_63.POOL.4.mzML LIPPOS17MAR_63.ms2 SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_67.181 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPPOS17MAR_67.181.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_69.11 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPPOS17MAR_69.11.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_70.182 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 RAW_FILE_NAME=LIPPOS17MAR_70.182.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_71.2 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 RAW_FILE_NAME=LIPPOS17MAR_71.2.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_72.147 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 RAW_FILE_NAME=LIPPOS17MAR_72.147.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_76.120 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B RAW_FILE_NAME=LIPPOS17MAR_76.120.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_77.82 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A RAW_FILE_NAME=LIPPOS17MAR_77.82.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_81.BLANK.5 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_81.BLANK.5.mzML SUBJECT_SAMPLE_FACTORS - LIPPOS17MAR_82.POOL.5 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A RAW_FILE_NAME=LIPPOS17MAR_82.POOL.5.mzML LIPPOS17MAR_82.ms2 #COLLECTION CO:COLLECTION_SUMMARY Cells were collected using 1mL of cold (-20C) methanol and a cell scraper and CO:COLLECTION_SUMMARY then immediately stored at -80C. CO:SAMPLE_TYPE Cultured cells #TREATMENT TR:TREATMENT_SUMMARY DDLPS were plated in 60mm dishes and drug treated with atorvastatin for 72 TR:TREATMENT_SUMMARY hours. TR:CELL_STORAGE All cells were cultured in Dulbecco's modified Eagle's medium (DMEM) and TR:CELL_STORAGE supplemented with 10% fetal bovine serum (FBS), 100 U/mL penicillin, and 100 TR:CELL_STORAGE U/mL streptomycin. These cells were cultured in a humidified chamber delivering TR:CELL_STORAGE 5% CO2 at 37 degrees C. TR:CELL_MEDIA Dulbecco's modified Eagle's medium TR:TREATMENT_COMPOUND Atorvastatin #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Cells were pelleted and processed using a chloroform:methanol homogenization SP:SAMPLEPREP_SUMMARY followed by an isoproponal:acetonitrile extraction. Samples were separated by SP:SAMPLEPREP_SUMMARY reverse phase HPLC using a Prominence 20 UFLCXR system (Shimadzu, Columbia MD) SP:SAMPLEPREP_SUMMARY with a Waters (Milford, MA) CSH C18 column (100mm x 2.1mm 1.7 um particle size) SP:SAMPLEPREP_SUMMARY maintained at 55C and a 20 minute aqueous/acetonitrile/isopropanol gradient, at SP:SAMPLEPREP_SUMMARY a flow rate of 225 ul/min. For electrospray ionization positive mode, Solvent A SP:SAMPLEPREP_SUMMARY was 40% water, 60% acetonitrile with 10mM ammonium formate and 0.1% formic acid, SP:SAMPLEPREP_SUMMARY and Solvent B was 90% isopropanol, 10% acetonitrile with 10mM ammonium formate SP:SAMPLEPREP_SUMMARY and 0.1% formic acid. For electrospray ionization negative mode, Solvent A was SP:SAMPLEPREP_SUMMARY 40% water, 60% isopropanol with 10 mM ammonium acetate, and solvent B was 90% SP:SAMPLEPREP_SUMMARY isopropanol, 10% acetonitrile with 10 mM ammonium acetate. The initial SP:SAMPLEPREP_SUMMARY conditions were 60% A and 40% B, increasing to 43% B at 2 minutes, 50% B at 2.1 SP:SAMPLEPREP_SUMMARY minutes., 54% B at 12 minutes, 70% B at 12.1 minutes and 99% B at 18 minutes, SP:SAMPLEPREP_SUMMARY held at 99% B until 20.0 minutes before returning to the initial conditions. SP:PROCESSING_STORAGE_CONDITIONS -80℃ SP:EXTRACT_STORAGE -80℃ #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY Samples were separated by reverse phase HPLC using a Prominence 20 UFLCXR system CH:CHROMATOGRAPHY_SUMMARY (Shimadzu, Columbia MD) with a Waters (Milford, MA) CSH C18 column (100mm x CH:CHROMATOGRAPHY_SUMMARY 2.1mm 1.7 um particle size) maintained at 55C and a 20 minute CH:CHROMATOGRAPHY_SUMMARY aqueous/acetonitrile/isopropanol gradient, at a flow rate of 225 ul/min. For CH:CHROMATOGRAPHY_SUMMARY electrospray ionization positive mode, Solvent A was 40% water, 60% acetonitrile CH:CHROMATOGRAPHY_SUMMARY with 10mM ammonium formate and 0.1% formic acid, and Solvent B was 90% CH:CHROMATOGRAPHY_SUMMARY isopropanol, 10% acetonitrile with 10mM ammonium formate and 0.1% formic acid. CH:CHROMATOGRAPHY_SUMMARY For electrospray ionization negative mode, Solvent A was 40% water, 60% CH:CHROMATOGRAPHY_SUMMARY isopropanol with 10 mM ammonium acetate, and solvent B was 90% isopropanol, 10% CH:CHROMATOGRAPHY_SUMMARY acetonitrile with 10 mM ammonium acetate. The initial conditions were 60% A and CH:CHROMATOGRAPHY_SUMMARY 40% B, increasing to 43% B at 2 minutes, 50% B at 2.1 minutes, 54% B at 12 CH:CHROMATOGRAPHY_SUMMARY minutes, 70% B at 12.1 minutes and 99% B at 18 minutes, held at 99% B until 20.0 CH:CHROMATOGRAPHY_SUMMARY minutes before returning to the initial conditions. CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Shimadzu Prominence 20 UFLCXR CH:COLUMN_NAME Waters XBridge C18 (50 x 2.1mm, 3um) CH:FLOW_GRADIENT aqueous/acetonitrile/isopropanol CH:FLOW_RATE 225 ul/min CH:COLUMN_TEMPERATURE 55C #ANALYSIS AN:ANALYSIS_TYPE MS AN:LABORATORY_NAME Penn State University Metabolomics Facility AN:OPERATOR_NAME Philip Smith #MS MS:INSTRUMENT_NAME ABI Sciex 5600 TripleTOF MS:INSTRUMENT_TYPE QTOF MS:MS_TYPE ESI MS:ION_MODE NEGATIVE MS:MS_COMMENTS The capillary voltage was set at 4.5 kV, with a declustering potential of 80V. MS:MS_COMMENTS The mass spectrometer was operated in IDA (Information Dependent Acquisition) MS:MS_COMMENTS mode with a 100 ms survey scan from 100 to 1200 m/z, and up to 20 MS/MS product MS:MS_COMMENTS ion scans (100 ms) per duty cycle using a collision energy of 50V with a 20V MS:MS_COMMENTS spread. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS ppm MS_METABOLITE_DATA_START Samples LIPNEG17MAR_01.BLANK.1 LIPNEG17MAR_10.111 LIPNEG17MAR_11.191 LIPNEG17MAR_07.73 LIPNEG17MAR_09.38 LIPNEG17MAR_02.POOL.1 LIPNEG17MAR_16.12 LIPNEG17MAR_20.BLANK.2 LIPNEG17MAR_15.118 LIPNEG17MAR_18.146 LIPNEG17MAR_25.110 LIPNEG17MAR_12.74 LIPNEG17MAR_27.37 LIPNEG17MAR_21.POOL.2 LIPNEG17MAR_33.47 LIPNEG17MAR_31.46 LIPNEG17MAR_30.75 LIPNEG17MAR_32.119 LIPNEG17MAR_42.BLANK3 LIPNEG17MAR_38.183 LIPNEG17MAR_37.154 LIPNEG17MAR_40.190 LIPNEG17MAR_39.192 LIPNEG17MAR_43.POOL.3 LIPNEG17MAR_62.BLANK.4 LIPNEG17MAR_52.3 LIPNEG17MAR_53.109 LIPNEG17MAR_59.48 LIPNEG17MAR_51.145 LIPNEG17MAR_47.1 LIPNEG17MAR_60.84 LIPNEG17MAR_56.10 LIPNEG17MAR_58.156 LIPNEG17MAR_57.155 LIPNEG17MAR_72.147 LIPNEG17MAR_69.11 LIPNEG17MAR_63.POOL.4 LIPNEG17MAR_71.2 LIPNEG17MAR_89.BLANK.5 LIPNEG17MAR_76.120 LIPNEG17MAR_67.181 LIPNEG17MAR_70.182 LIPNEG17MAR_83.83 LIPNEG17MAR_84.39 LIPNEG17MAR_90.POOL.5 LIPNEG17MAR_77.82 Factors Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A Cer-EODS(d18:0/12:1-O-16:0) 137.6805767 96558.92096 654929.0528 179817.8209 79778.55493 299644.3733 314844.0769 0 160610.7426 191302.7557 108068.2207 184410.6611 77633.47143 461351.4943 70355.74191 82188.49149 148546.1575 134655.2038 0 428568.0821 230324.8978 592489.4948 781627.1933 504770.2243 0 270209.276 114593.3076 54838.68417 183653.1635 548899.6019 192098.8294 309092.4869 265611.0052 220956.2724 180566.6242 333726.0274 431112.1229 405246.3178 0 126886.3586 551378.1453 584029.5471 166439.8008 117061.6493 433870.3678 190391.4736 Cer-NDS(d18:0/16:0) 0 6215.214078 224788.9033 9903.320928 15073.60434 106619.2035 353535.2214 0 15468.2276 15705.01084 8863.226978 23239.71624 16277.40716 109715.7436 27365.20773 22410.40607 15793.19744 16542.87597 0 118814.8298 93839.33276 240511.7946 320572.9922 148912.3207 0 313366.4352 6789.517695 38207.1422 35634.47453 551306.5899 63798.61454 282985.4678 138162.8188 74398.15655 20777.50949 313258.2924 160247.9328 441886.6349 0 19891.83388 127636.1279 148998.351 55714.41414 22973.84895 189852.8969 66854.83429 Cer-NDS(d18:0/22:0) 37.20937253 0 0 0 0 22569.3991 35203.9955 15.42238922 0 5586.137273 5415.932923 3744.026719 0 29031.22862 6567.274403 0 0 8274.088219 739.5691899 7571.277518 0 36965.02919 41613.07521 20847.21535 945.4058519 29638.48611 0 7987.784437 0 55012.75773 0 30622.1647 32596.97083 0 0 33529.60728 31962.78547 36747.41277 816.0352383 0 19981.76113 23508.19043 8829.522347 9124.225232 32542.59949 7426.594166 Cer-NS(d18:1/24:1) 408.3638786 374446.0079 1076719.337 370863.464 522133.5839 858427.3883 1703840.807 0 668218.4402 614294.9303 515526.4239 403311.8506 327114.433 1017093.583 420442.5061 365346.7487 361664.8096 946474.4579 0 740326.4362 924272.9661 1094991.738 1268715.001 1015516.287 0 1812342.327 751953.9872 324263.2753 539894.1432 2376770.702 472810.3212 1777035.161 1041905.306 901979.1136 689695.0901 1693683.171 1113735.253 1910749.022 0 938247.1584 905470.215 975949.9196 530261.5373 626363.8386 878850.5145 307877.7118 Cer-NS(d18:1/16:0) 56.25165609 153229.7721 1067468.048 379716.7474 631502.2047 550206.0229 2344848.566 91.49256254 319346.897 321051.0188 169495.754 408506.7113 750372.9901 723174.4609 709331.64 732323.8648 440576.4543 348661.4725 101.7538917 689413.537 671251.9848 1246660.787 1251502.21 885972.2171 452.2817234 2471967.145 258319.9371 790795.8899 339205.1573 3329936.263 687570.1755 2693886.862 736219.7281 733826.3351 346721.5737 3231246.958 914944.0831 2917128.926 115.0693667 442977.5722 959795.0721 970307.4927 780621.306 1120163.59 1052428.091 791381.609 Cer-NS(d18:1/22:0) 0 45105.73333 294941.2886 32133.28399 95492.27642 103474.5374 351730.2387 0 128300.5653 39821.76595 44321.78485 31962.69764 135729.3099 152465.808 37166.67501 83853.07438 19270.91361 58566.16246 0 95713.88963 145049.5239 289682.7098 280163.2178 171318.8531 0 168507.1742 70212.77243 81139.75655 47478.13398 609065.004 68044.97872 413371.8147 156016.5624 86141.94521 52912.29391 459563.9267 124202.6142 501931.3202 152.1195819 78524.30058 119866.2586 139063.6776 47722.88545 120209.1046 220785.1291 70907.58338 Cer-NS(d18:1/24:0) 1201.999235 457219.706 732396.2158 263322.6724 493169.4399 619257.0196 1094863.184 589.5646295 684634.4553 475194.456 396156.6877 340337.6584 796048.9904 829756.4522 408289.8656 552260.6589 334713.7258 946633.2632 92.12999451 647949.6395 558167.4579 939858.9462 745364.81 848048.3505 1359.681946 1193537.541 717507.9038 766043.5482 352851.9957 2494827.943 499574.706 1602523.264 732532.9487 533773.8915 387430.0311 1601215.908 826418.9695 1439683.773 2487.179872 695783.7057 761481.7602 1138345.647 549410.236 936753.0504 794608.5188 591059.8934 Cer-NS(d18:2/24:1) 0 161276.2238 295791.8745 76344.02425 122702.366 226835.3095 564679.367 0 309636.2864 220625.8732 159656.5052 100836.2771 71645.33998 243900.9009 110876.3414 116674.1448 85080.66648 354933.5034 0 200680.533 255330.5493 424948.6594 426890.2175 333370.57 89.27755804 711628.8024 198896.4992 129433.0718 258025.5968 719867.7793 117779.2101 832710.9989 285479.6638 331177.1886 213311.1335 583812.8149 349811.8901 898714.6325 0 361451.8639 198090.8636 233176.4881 129110.0487 92530.14142 444071.0689 112086.6553 Cer-NS(d19:2/24:1) 0 249133.5401 490409.5525 123974.0184 171597.0328 327964.6561 881548.8445 0 485343.1042 374381.4854 215778.8829 155395.8117 178761.8345 493917.3575 141772.4339 172447.8349 132635.6249 455578.2163 0 272265.8818 465910.418 635657.0069 713020.6643 510477.6607 0 1128202.795 341495.3637 194215.5593 333746.9659 1703907.739 160477.563 1066861.938 493718.1432 436018.2334 296669.3409 1243944.029 476168.1141 1438370.256 0 498288.9894 265291.751 358132.6727 148276.4775 216276.9764 564585.2556 177700.7957 Cer-NS(d20:1/24:0) 61.28299676 76920.93593 184928.337 37355.00529 117719.8367 70822.26461 82864.93466 1955.719161 88777.48166 38703.30072 73387.51448 60068.18911 117371.4959 97206.58997 88890.32109 81659.48302 26106.45883 94145.27128 1684.384537 87377.54792 49643.03674 75119.13719 143003.9018 87174.79028 1202.094691 127216.7728 120959.4774 97050.36208 39174.38791 252111.1725 53806.17003 119116.0273 66148.44201 53770.95301 37157.98821 122692.1019 73257.25356 200250.8278 1171.921285 99307.19085 105128.9836 109432.9756 69089.43365 161811.3463 97148.60516 59350.73874 Cer-NS(d18:2/16:0) 0 1525.849285 50522.42431 4142.174 12677.25886 23119.46283 51012.04275 0 3298.106401 20078.76859 2870.474092 23990.17716 14440.16392 30986.54941 17727.54215 13807.39071 19848.72189 9587.542259 0 43497.01779 26019.41204 88751.46225 67979.60109 36890.73572 0 60882.65941 5112.743742 14575.00542 18908.02023 137391.9419 52771.13196 73783.49856 37799.3098 31012.14231 18077.88856 73366.00089 35065.87481 69271.37446 0 9267.560164 59709.00004 57127.54095 34485.3524 23221.87701 43121.0239 34770.15792 Cer-NS(d19:1/25:1) 189.9577822 29106.45366 153307.9969 43029.24225 31266.27289 79235.39344 78137.21535 0 47720.40061 42443.54834 31106.41637 59232.18405 24688.12985 90979.44929 27480.04533 26931.0253 42244.12142 46928.44056 0 94975.35428 52030.80228 156593.3633 241548.546 117770.8458 0 85412.15115 42486.34866 21913.14189 41964.5588 136929.6618 56989.984 102439.771 61181.78918 55893.26522 43970.00332 120714.7926 126509.2719 126367.4211 0 52738.97107 99564.23241 117973.3679 62939.28997 32148.16212 110506.4683 41393.35407 Cer-NS(d18:1/14:0) 0 10407.1487 56074.49563 9675.676039 34837.4348 32295.67424 181165.2203 0 16961.34966 12148.93897 10097.11311 27759.37684 39705.80496 46729.86536 39114.86076 39754.46514 24208.68278 28380.55936 0 34657.20855 21188.16985 68087.1489 74945.46972 60033.79307 0 229270.7125 11389.96906 46191.64479 14866.74348 374109.4261 36402.3052 228864.8112 25729.54366 26238.37023 20927.57226 247778.5138 47601.64854 281241.3307 0 23920.45866 35804.43434 43485.85537 38507.56245 49951.77056 58742.22959 36147.83071 Cer-NS(d18:1/18:0) 0 7912.029783 76887.38461 0 16166.9809 43945.32614 254970.3335 688.9326431 21539.06147 7504.03258 7600.572111 15981.98946 38302.78392 77894.45711 42409.37082 28571.95232 10878.33226 14145.08689 16.72944242 53439.33374 19866.15361 98236.63692 200964.6334 69565.02943 0 184348.5724 8855.490533 55702.32415 10546.23502 364010.2172 31091.72806 257831.2899 29930.03608 39381.49439 15718.71823 189796.7577 55429.54376 159976.7144 0 15341.72639 35515.91651 100115.4159 18465.77839 52935.53735 49672.44734 40177.29991 CL(16:0_18:0_18:0_18:1) 1500.085177 3370494.442 3204592.218 12473488.79 3578523.634 4971450.747 3567440.279 846.5296132 3112156.772 8624022.665 3015243.849 13906513.69 3619126.12 6086671.414 3069898.471 3011175.125 11338780.2 3104170.115 3893.101813 3315187.757 3290992.314 3562127.805 3943411.972 5971512.919 2896.811504 3690583.369 3882488.979 3134994.705 8179951.535 6162934.638 11766880.85 3700822.681 3927483.634 3577972.883 8945080.521 3571445.463 6302832.272 3912870.822 2466.041071 2722905.146 4627167.342 5796786.929 12764111.82 4256788.811 5737721.679 13038596.72 CL(16:0_18:1_20:0_20:0) 4531.222411 11402481.94 8969657.258 21594377.15 9608833.922 12151167.06 14167982.9 5237.812125 9290176.485 16637351.86 10961451.02 24451431.99 9629611.317 13321426.64 7932564.22 7509872.843 23903756.08 9388094.743 5887.825691 11211258.88 10885727.2 9540100.062 10774018.69 13384469.7 9975.018894 14754821.91 13957931.27 8699770.21 14950183.33 19967491.14 22327786.48 14844862.05 11595378.58 11406480.82 16148189.77 14103673.36 13705213.34 15916966.87 6744.899097 8988874.195 13716065.33 14464171.85 25488516.1 10326047.37 12324750.46 23256728.59 CL(16:1_18:1_18:1_18:2) 0 40046.90539 99693.97954 235476.9585 45669.00453 239808.5802 41241.48275 0 39140.53296 469489.5336 48347.42518 392406.5072 41216.14923 430139.8342 28684.67545 29356.92292 366552.7592 30045.52286 0 122150.2244 77748.6421 120840.4017 150685.9659 436035.7345 0 43829.20206 66102.53945 37940.66929 472346.5225 83255.27282 308274.8326 42573.61054 78832.08011 79321.72742 498825.3969 51082.80191 388122.3302 48960.96676 0 26897.61427 179401.014 209369.2802 328603.1086 38583.44056 360918.5289 324227.1593 CL(18:0_20:0_20:0_20:1) 0 638429.2779 263720.7607 901789.0632 624210.1922 718696.9259 529691.7254 0 464561.4889 982382.8457 606415.8241 986174.3802 623326.0293 693323.7491 587802.3106 565015.1258 734311.4984 351969.7602 0 325961.9524 621599.8794 327867.6816 357344.2372 733846.948 0 579007.8619 867291.5546 687023.4055 929334.5048 1063093.567 850446.9364 584682.9887 720971.755 657018.7859 1117418.489 540126.2231 761673.9841 805915.4092 0 474411.9272 392793.0566 476633.62 974597.8302 756743.3138 665712.4623 895884.5819 CL(18:0_20:2_20:2_20:2) 0 40034.16496 32361.79476 43347.90001 31904.77221 76534.20168 29713.12995 0 25110.18384 131455.122 38581.67608 93101.70728 48177.66372 60023.45563 48064.79412 50633.07034 85485.4271 35043.68946 0 43289.49706 20818.27295 46965.40358 42599.56107 66723.05731 0 34190.44584 52902.52478 61777.78628 88472.90703 52783.92224 57883.05494 33357.75887 19280.97332 12390.62943 123291.5313 25870.63772 64271.54395 40449.09479 0 32810.19321 54647.02017 43747.55136 130762.4866 74483.67727 65321.79549 49385.70688 CL(18:1_18:1_18:2_20:3) 0 28105.81334 13530.1986 27352.91786 59309.73776 45999.21864 35087.57272 0 19791.79928 84258.8345 34542.8882 55768.08137 60581.40057 66235.70729 53365.61752 38270.0712 72908.4635 19760.17409 0 35587.42016 16448.23992 21129.07731 20925.90782 68491.21284 0 23238.11293 43609.91854 65564.17371 79333.93069 43568.35236 67009.51637 25172.84498 12418.97569 10988.32377 92860.35891 27918.06515 63333.60754 42408.34845 0 21749.34531 32662.11709 49149.7561 80882.91827 66428.92563 68823.09161 69735.66522 CL(18:1_20:0_20:1_20:2) 0 173731.1361 286013.7269 486648.313 314305.1273 592652.841 432089.7091 0 215761.4091 1042600.284 298753.7828 586132.5885 300638.1694 634874.8814 251235.7082 251003.0868 604511.2604 198415.3583 0 264939.7458 294992.8923 291632.8928 342458.4308 791181.7558 0 428224.6197 350261.2997 265380.7544 772349.3919 544363.7811 425464.0972 410839.8087 408218.6649 318935.2404 1016123.402 389612.1424 791533.9475 452163.4515 0 251856.4899 251265.6685 247186.2641 470884.4166 327590.3406 712498.0484 457611.1429 CL(18:1_20:0_20:1_20:1) 461.7304223 1120867.692 975800.4627 2906724.215 1292811.911 2616270.51 1213960.911 1028.605938 849547.615 4287031.022 927877.4497 3231761.089 1405330.464 2929229.639 1199908.053 1217822.977 2849186.259 860876.6239 0 1087459.434 2103788.983 1138394.624 1205995.302 3001802.194 635.4050735 1486660.218 1323911.401 1302044.923 3623098.624 2064962.18 2343691.464 1466466.245 2169199.533 2298048.081 4448735.862 1318462.36 2968729.857 1723864.913 531.3999582 713439.5476 1358801.642 1631166.469 2569784.482 1584153.973 2899459.099 2577177.327 DMPE(14:0_16:0) 30665.04661 551209.393 407506.6547 943002.2311 397746.8643 536233.7183 376577.8683 36744.91869 630976.8603 811509.9528 437022.7802 1388914.396 346279.2385 670600.2308 246645.2039 292232.5667 1106623.709 492473.5319 34868.88044 508593.2517 227592.5431 465049.4861 351781.1096 618894.1537 31361.5508 314823.1168 551480.1953 311560.2896 629698.4562 555727.8388 883989.0951 369710.315 226930.7428 252347.9776 630664.7766 345988.5232 535174.0259 430514.9511 33409.49942 535202.1885 676891.5189 687483.5468 1227250.585 426272.1145 600365.1328 1117317.012 DMPE(14:1_16:1) 0 16350.09089 63123.30833 361683.4938 33106.04109 374201.5638 9602.775885 0 19153.53752 401016.1443 17167.968 392093.8979 42426.80633 425211.7202 41391.6978 37368.05199 249837.002 17202.71485 0 55430.34098 33559.54775 57416.23416 76224.55699 342749.8418 0 10771.84322 29791.74008 43116.47161 339557.8414 20853.28153 218150.802 14637.26849 40201.49535 37773.88993 324412.8028 14411.90458 360028.8141 15322.42658 21.63295396 18706.95546 76212.79467 87190.30895 182599.287 37465.81836 331367.7832 267079.4067 DMPE(14:0_16:1) 0 42986.56023 50052.79133 343853.8265 16057.74446 118145.8402 55338.38908 0 42120.37343 124590.6309 32285.48032 471349.1283 19151.68445 125045.9137 12942.69277 19450.74714 392598.9165 36086.35341 0 67672.46983 29455.83706 73076.14784 69146.91197 97120.72027 29.42996177 60110.0149 34064.15069 18661.89316 101555.7521 78760.13884 276293.4337 47506.30147 25133.24825 32100.76514 125286.3833 45525.44284 109312.0409 66266.50139 0 49579.32042 104157.5482 80328.76064 290736.0145 17308.25815 55776.14858 344284.9338 DMPE(16:0_22:6) 30.55740837 434272.5355 1128492.377 77516.00301 362528.7279 1109997.608 638526.6032 59.22797337 297654.2278 1627837.479 422219.0101 3915033.622 311368.1542 1244136.113 269338.8387 259580.341 3006207.721 318460.0695 103.5835004 1443531.394 382492.9014 1130382.016 1488199.73 1312644.283 255.7806339 711140.8562 600817.5511 312137.2556 1707366.796 1296430.093 3161498.014 641120.758 555224.6162 476452.2436 1702037.312 615296.0708 1261232.188 885716.4017 199.7285294 324211.0589 2020308.825 2330517.941 3429842.402 393951.4585 1189081.331 3371095.98 DMPE(16:0_20:4) 0 347878.9411 248053.4776 221766.0996 53316.12331 175191.3899 517455.1187 0 351415.7909 136012.3992 380956.0179 226094.6185 118648.2128 177535.4768 140953.499 143005.03 201809.3895 290612.6579 145.5064292 277365.6532 140337.1991 197209.7395 258870.5527 158036.8507 0 441598.1081 452742.9881 108699.4361 158072.9584 869315.3127 259964.9696 634705.3154 145940.9443 123919.0492 150081.3061 630374.9849 141982.3712 677516.766 0 436302.2583 286269.6497 294399.645 235111.0388 117734.5898 126396.7506 153101.8176 DMPE(16:0_24:1) 254.2296021 106765.1599 196941.6617 147262.8118 110993.4773 218121.5525 35879.89097 0 106979.2875 204636.7471 71201.79666 203999.8101 104939.5548 248374.9889 108194.9324 130075.6427 189261.7371 55535.9703 0 118236.8307 102844.5465 147915.7933 156241.5053 220105.3587 0 71296.18481 65894.42698 77022.23286 308564.3954 81777.33932 152072.7395 25741.04217 97662.18881 56678.21803 329710.7747 44407.33074 117654.5441 43408.75993 0 50280.49426 202763.6657 155582.9736 127545.125 146991.2506 225017.6947 194110.1648 DMPE(16:0_22:1) 991.4672771 120115.6841 154167.8524 158650.3731 332621.1795 232724.3277 144234.0575 0 165936.493 319424.3419 183854.4253 358906.0336 328500.4407 234839.08 300714.8629 281789.2656 277058.1977 157222.9874 0 200098.2306 228685.6793 161505.2871 201882.6195 229642.9659 0 171550.3364 197077.7775 292064.4272 314872.6161 268052.4634 297657.2484 160934.7404 268137.9982 114664.9638 182425.6911 153647.7083 268130.8317 214823.1681 0 149848.8736 172643.4164 125714.1023 301811.2064 327264.109 230971.2249 256352.7232 DMPE(17:1_18:1) 9808.355703 102238.9009 249940.4521 797953.1935 152032.2367 475324.3586 197609.2963 718.2121828 74671.62991 717364.0033 124285.0039 957640.7297 143174.4503 553003.1775 160758.0414 162357.2115 727208.7417 60819.77812 344.2870968 307048.7708 324965.7257 309416.6164 360739.3008 502223.0918 233.7938882 250103.275 151032.4198 176646.6174 561263.4108 374740.6412 753011.7571 246772.4923 370478.1231 155959.9872 439076.5316 236781.8381 528880.0746 334141.2462 2076.458878 70500.6487 327053.9237 426777.9208 818408.0594 217242.5531 532208.1122 763885.1829 DMPE(18:0_18:1) 2168.756879 2962056.523 2778877.334 2847439.466 4192624.781 1958326.576 2308572.094 2347.053612 3066837.043 3050703.313 2917101.096 2845542.774 2883775.552 2739791.203 3663344.462 3016634.961 2536301.255 3645122.962 4449.021999 2702935.921 2937502.099 2103585.429 2797308.708 2554342.291 5958.557245 3153746.055 3180031.592 3075949.572 2682224.029 3318177.276 2764924.037 2965243.342 2413690.928 3048266.662 2332924.317 3337081.012 2824471.744 3872984.011 3361.33834 2438448.121 2709905.51 3605034.161 3218977.422 2780150.672 1965515.575 3188125.132 DMPE(18:0_20:3) 8840.529126 592391.9094 508317.8652 307540.5045 317161.1263 334977.8655 171421.6336 471.9656914 509625.79 379882.2956 539853.6498 285396.7497 224516.0157 209589.9134 214585.7465 285675.7343 269652.4133 405914.1607 1530.276383 327716.2756 300237.6641 348687.8929 551511.5849 389586.9586 2062.238586 386525.3003 388786.1963 225338.0394 327366.9299 433133.6029 370889.8393 461717.0741 339356.3567 233643.5099 358373.0392 390503.7452 216295.9418 522074.2763 1178.860342 252835.3184 279677.0037 205764.5986 268907.4641 349486.4779 245486.972 284047.3894 DMPE(18:1_20:1) 8534.758611 553696.7505 755672.0883 590709.7369 925209.086 747756.049 333222.1401 2100.108349 461930.3768 1326072.138 557539.8722 617624.1329 752636.8305 1092887.095 660281.0808 652806.7756 497810.7719 443872.9772 296.5745298 644668.3637 618731.6765 603031.188 653092.4809 1047839.596 1763.794986 452152.2804 580178.5588 753143.9555 1064187.586 613760.0519 487559.8298 412753.3764 503963.3753 692147.4729 1302808.786 442221.1519 1094543.719 556523.1487 0 404428.2334 682928.4312 757375.941 613001.7584 690731.3139 794242.9003 538123.7785 DMPE(18:1_24:1) 0 0 19922.95261 20284.29388 67371.73649 450925.9497 854380.0484 0 568036.6252 505952.8001 279919.6982 447671.1518 731571.0459 648393.6325 1001292.497 924251.8644 823135.685 556869.6162 0 296567.6558 738424.4844 381928.354 420849.1595 618271.9215 0 1044971.089 413568.0115 1097989.748 488226.0941 1212505.257 621769.227 918392.2788 947652.5981 745283.5798 436222.1165 1269230.411 645242.389 1003371.77 204.5372586 623525.6733 402376.7491 418986.2047 750303.2537 1033830.767 849562.025 888322.8966 DMPE(18:1_22:2) 2007.398543 154375.4988 208316.54 407859.8415 347111.4606 333617.1969 235939.3433 1530.401018 116817.8267 563576.2923 161019.1696 472476.14 416126.4129 421324.3974 427777.576 401215.668 375167.8785 90696.44753 1202.883395 168563.1729 172230.3263 180562.3696 287113.5649 406389.1809 750.6661255 318419.8004 171966.3646 369498.7753 524214.8013 567988.5529 297929.1202 266259.7717 138610.2079 149193.7883 616798.0766 258434.4977 328571.2954 401575.5906 1404.267234 85576.2005 244763.2966 266497.9692 324097.6092 470341.9968 249245.1205 326710.0061 DMPE(18:1_26:0) 258.803601 42250.66865 0 0 26840.45474 239242.9701 0 0 56827.71656 147787.0157 40576.33419 114423.976 109986.6351 199528.2561 50620.97315 81434.92285 207194.5791 33383.43069 0 163254.7227 76578.28457 130393.2114 154936.2519 179122.4506 0 11502.357 38051.03927 80869.68911 183996.2288 19643.17396 366839.8631 7524.099225 60483.02543 92559.34966 132168.2273 4558.509162 189599.4791 6884.410077 0 40276.17341 146585.8621 195977.9023 236606.7691 128209.3219 210829.1719 370977.917 DMPE(20:3_22:1) 3661.176046 25197.63981 57189.83776 33688.46748 56988.96567 92462.59249 76716.31049 1450.63893 18012.22275 88274.91322 47560.98814 72289.69164 52340.16507 66506.98074 49520.90236 70574.39801 67799.71451 32192.92856 972.4046482 52639.69586 21939.12504 96034.53965 87462.1883 85585.4403 1976.980183 106089.8601 13914.94203 43472.84336 103984.5684 253353.4251 56741.51513 82741.89474 16774.99638 29160.30589 50098.68412 117154.3218 89395.05001 159737.2895 795.3411145 19335.85517 64308.20071 77074.04882 95735.90651 61997.77224 79222.59648 73547.64154 DMPE(20:1_24:1) 244.0288523 55349.50525 333191.0444 359401.0072 134023.2287 464812.2202 28304.23523 0 82859.73974 645659.0326 55120.11196 386866.2561 146167.2209 591914.1683 87788.89008 71733.75321 342268.8376 62188.3068 0 267880.9767 192078.7506 272484.2976 331920.6406 650227.9009 0 32171.9708 62673.90674 108084.7201 364121.3072 61322.46216 370060.1399 31676.2559 152832.1246 176426.1493 568236.7433 30003.26162 527672.5634 45559.09939 0 59320.2257 376872.5574 366478.1911 387127.9518 169384.6112 493195.6195 474333.1884 DMPE(20:4_24:1) 0 47186.38408 117485.1539 339362.975 21829.64662 131768.8396 18301.40052 0 22104.03669 157071.5932 30044.97428 492384.4702 59035.86617 157774.2308 57319.9952 65528.13907 299321.3447 19729.2365 0 90548.94946 71886.34079 135254.3756 166124.4389 126428.8271 0 13801.85311 33867.13229 102804.8722 136930.5225 55309.94945 307843.3142 26182.77608 44293.86501 49069.97377 143925.8041 18916.8289 120714.4516 24218.68017 0 62547.80564 100728.4317 86605.15563 458217.1915 79443.12798 171091.9398 332142.755 FAHFA(16:0/18:2) 34995.36133 360552.0113 339596.7734 371814.5773 352177.7842 253349.5948 374887.5336 22272.8752 457063.8379 301523.1635 145670.6172 420601.9181 468552.077 417437.0245 350701.6288 342445.8743 228585.0095 334363.395 137405.6383 152968.8756 406364.5136 226976.351 341093.7069 337012.2284 532603.471 288931.3425 310689.01 308425.8601 371494.5164 461229.1726 364183.2976 402948.5097 468515.5665 411933.7347 265292.9935 411194.8898 295017.2283 363355.8912 586529.7559 276058.3436 232161.6652 220401.978 384475.8109 321727.3813 396783.7426 325472.489 FAHFA(18:0/20:2) 155752.4894 447415.6888 611816.7114 536908.8557 570829.6681 246873.2546 574097.1532 656167.1404 504939.344 437381.0621 556956.3612 786419.0883 597685.0775 519237.5399 381646.9347 493610.3832 396141.3021 412015.8056 806988.5318 335351.2659 346543.4785 351596.1425 520001.1026 574592.0987 684711.303 530051.9631 492652.9279 431183.246 510295.7473 683684.4566 512373.9731 437826.5249 547503.3276 375695.413 359058.1393 572856.0754 531489.6138 518498.0458 742759.8878 505897.8981 415646.1084 365653.7474 543696.4371 513097.7867 469250.1143 448374.7677 FAHFA(18:0/22:3) 0 22095.87539 27217.66982 29046.3364 23484.97361 18249.00024 21508.35581 58481.22073 25249.97253 21710.40781 21029.88995 20148.34477 27091.8599 23941.03262 0 18310.98203 17784.93629 17893.49471 78501.58365 13154.52341 25430.0713 16123.06789 23766.72121 21723.81248 1713.604662 23397.30446 16949.27086 19071.9201 18561.29893 15754.72667 18395.6946 18484.82749 22095.09302 20548.88112 16051.63537 19382.74508 20058.93848 17010.9884 21929.07175 11742.43859 19071.96323 9468.869738 12889.59574 18004.25414 16062.00512 15459.86208 FAHFA(18:2/20:4) 37498.55128 212377.9052 120973.3882 127896.2731 215166.869 155518.7896 165599.5852 191053.4086 176445.0709 186781.6608 155952.3578 151714.94 173261.5109 196741.5126 163534.3299 182975.8271 79809.7585 183478.2818 199025.0916 161195.815 147205.7967 121615.0439 171998.8659 223293.9706 203955.6519 162368.4029 237163.2167 217282.6697 168027.7933 184869.7233 123685.5536 144704.5344 189453.8099 145502.3625 175024.758 141645.4888 228897.8743 124608.1823 178964.9854 140421.6348 137085.517 100136.7756 140950.5669 252638.4386 168518.0911 107064.7199 HexCer-NS(d18:1/24:1) 0 24880.09144 37816.56638 0 0 86041.71181 128499.3246 0 59464.02928 50141.65509 40061.9428 91607.1427 45817.96665 71392.50217 59773.93898 42067.85226 85231.90524 52641.73703 0 54089.61218 94968.85702 66295.95655 77786.70882 83244.79727 0 104641.805 63170.09232 61682.40068 41513.11553 105810.7373 98341.8 140446.4022 57171.29509 88716.33111 40878.05865 145779.4981 85094.60059 115485.6777 0 62836.33376 56674.27918 55364.07933 102428.4923 71646.20989 68916.41256 78609.70769 HexCer-NS(d18:1/24:0) 343.6211649 689893.2621 830986.918 1678231.443 2498415.606 1315778.033 1075267.923 0 1320436.391 982645.3688 695215.7154 2021756.842 2929293.034 1634193.538 2081608.755 2714724.091 2033698.412 1062032.349 436.9263746 824487.3406 1596259.505 1026842.517 1048213.316 1328592.358 0 1007921.47 1072449.026 4126820.812 655481.9624 2391523.492 2383889.549 1403788.646 1968415.884 1430609.076 1014874.147 1359532.718 1552094.732 1405298.639 0 1000803.225 1088935.609 1058773.758 2547274.168 4514129.922 1571419.94 2286237.826 HexCer-NS(d18:1/23:0) 0 75826.38339 28549.08848 104905.2252 300078.963 49244.2449 111566.2402 0 85151.68391 17621.63812 52039.62591 157813.4043 303358.1475 69612.23784 224257.5659 233690.5512 134921.9416 75463.18906 0 51163.07834 65882.80247 51726.13145 48826.13814 53669.33903 0 126993.4507 87655.77584 427575.9188 35911.50771 272465.0182 135952.4714 232951.3539 69407.77199 67466.3264 47607.59631 213607.3901 79070.51925 238189.4431 221.1329605 78742.84239 69655.78312 91216.6344 179118.6932 502937.1063 42095.16237 148080.5201 HexCer-NS(d19:1/25:0) 0 70385.55084 104138.7611 155184.2492 350662.7068 159903.7947 74286.16389 0 110579.4149 102927.2398 94352.77521 243802.9301 304948.6282 183779.681 449234.061 261597.8749 278781.8461 110837.9251 0 94340.99801 95285.03314 117086.5907 122279.0512 184545.748 0 88964.84525 127339.336 504106.8651 82686.57711 159999.603 227910.738 88944.58972 87202.0364 107502.2896 85659.10131 93338.69281 110580.3532 119064.038 0 120866.3414 94870.02152 114538.4509 294498.94 314152.6068 191361.1936 337077.8997 HexCer-NS(d18:1/26:1) 0 35681.05836 212577.9497 251501.3202 110709.8954 243435.1376 97728.91415 0 107843.7345 139277.4422 51291.55169 397502.7758 136838.9048 344628.3642 120033.5777 141879.4812 399670.921 73138.97689 0 133812.1299 210877.0089 245111.6131 265661.6029 320687.0931 0 155656.5679 64372.32237 170682.6553 81795.92536 249207.6275 319359.9459 224905.3378 270468.2521 200577.8449 176927.2994 148633.003 370208.4887 231904.6007 153.4740185 53027.79979 184351.329 192098.691 289788.5847 190026.8684 283642.3481 381223.9188 HexCer-NS(d18:1/16:0) 19.34787644 112512.2986 178611.4602 868363.1196 1389862.941 247604.3311 829012.8412 123.687631 190686.8185 224860.078 178842.9565 895729.7214 1361257.773 427074.6668 1160662.02 1499652.606 809552.1475 164090.5105 37.40587573 203072.7779 371057.8084 242296.1301 212418.8699 478019.431 325.8304237 905450.7876 202596.3479 1839166.625 319103.3206 1343202.35 1166524.816 1085776.798 704118.8237 489848.7047 305197.8216 1162223.271 526523.9217 1266318.102 298.1240338 226080.9962 273492.0673 414871.2282 1361107.874 2027304.206 499433.4171 1494647.548 LPE(16:1) 0 9576.839281 16795.01518 75364.22065 5103.228377 18962.1063 15683.02549 0 9612.776144 58656.48763 8583.15755 141352.4868 6465.059556 25057.54794 13437.86098 18308.51866 351192.9262 9396.249367 0 118565.4137 47024.2952 143909.1904 28105.00498 26485.4369 0 14078.13253 16790.88791 16031.0321 42203.50187 16769.26672 119863.2886 10635.36649 24660.88872 33850.78149 72063.16261 14129.93911 30743.87512 15188.16216 0 15209.09149 191097.3771 98675.81285 170088.6477 9368.10882 30137.04155 396743.4823 LPE(18:0) 0 20736.26665 14224.81227 55713.03783 14871.81437 6810.893681 53574.92901 0 21019.89057 9307.023111 16267.32689 74268.65581 11819.09152 9679.844489 16301.48555 22496.9823 140027.4278 15595.02668 0 52021.67986 13407.77353 42913.88173 15473.27312 6191.098429 0 32403.60999 28658.59765 22961.35759 7667.465689 49258.39246 14395.43368 35328.5112 16040.3924 11624.03753 11428.86028 47326.65411 6527.985146 42985.16542 0 23273.99053 75158.93985 40920.64202 72641.55842 22011.23217 5834.791752 232493.5745 LPE(18:1) 0 68771.62279 57753.36017 126788.3666 43406.59741 90750.80885 105156.087 0 97783.02697 182087.9353 67283.57272 261735.3067 52507.48121 87990.30546 72978.12454 82591.16492 483398.104 64451.73526 0 304192.2692 132428.7941 371899.4451 21134.40665 94152.99381 0 115033.5242 130713.16 85911.23241 145412.9045 150657.0171 272758.2625 54625.04431 134932.1034 127101.3153 200917.9765 92424.4886 97735.74078 128673.1024 0 90292.30204 334714.7759 76446.90319 286989.815 61699.94959 95151.56997 478441.8508 LPE(18:2) 0 47107.85264 5364.084507 9466.59355 118227.4516 9785.687836 36432.49457 0 44932.04416 25960.81659 53230.65367 38933.60261 130832.7793 15433.61253 207723.0142 265676.6903 87080.68547 41966.41412 0 37493.26515 21853.66602 42661.15661 8666.222301 15078.20479 0 39734.04222 74732.4021 258170.0412 23382.46852 48091.19866 40328.60313 26838.73739 21341.47615 18159.667 32956.47602 35024.7667 14896.01949 38289.94305 0 57896.24558 54035.16866 26799.03518 55435.71172 143125.5618 19411.82042 83116.60999 LPE(20:4) 0 177558.7656 89483.99503 189071.2208 64669.48995 55169.67404 277020.2343 0 231695.9682 134334.6582 181635.3767 307985.6325 70975.10987 66657.0444 120744.0057 120312.8581 621954.7898 195792.8234 0 335061.0018 82547.20245 537379.1863 144012.4616 77231.35351 0 212057.6039 277194.2035 143847.3812 110702.3612 281654.3947 311078.7557 181007.2477 67513.56153 70914.11561 132632.4377 246346.4893 66896.79669 214075.2789 0 224165.0556 463442.5043 277994.4435 425901.2937 98448.05774 96927.1266 630624.7286 LPI(18:1) 0 17958.44691 64213.31296 11484.67411 12535.82216 47043.46865 46334.45631 0 42733.88345 69173.16906 27674.21044 83197.68583 13720.46409 42819.31534 25364.53321 32430.23987 191552.7025 30356.51949 0 357093.2743 96749.64345 300635.9892 51805.63939 56958.43668 0 33487.20498 30406.54688 34614.49352 37727.5218 53763.64275 47475.58841 35756.96757 39885.31145 53297.70603 64803.28882 50317.4642 60211.60019 50968.91727 0 34109.24808 240766.1236 111541.6947 83028.49923 23424.80655 59079.09826 115450.5582 LPS(18:0) 0 13882.08301 45850.34828 20305.96949 16959.83105 14331.35897 22139.20373 0 20388.53876 17012.68584 18961.69961 37694.81299 18569.97747 21567.91187 7996.840352 24468.81501 110623.7992 14149.12345 0 205949.115 37578.94667 143683.1753 28363.65263 25843.67257 0 16067.27485 32539.08223 22149.82153 13673.01562 22349.8266 28934.97091 17143.50074 20345.18315 13943.4934 14508.87215 22426.69117 14091.15146 18612.26996 0 37047.09536 234129.4065 69954.85376 47152.2097 26275.30266 21003.77566 64850.41788 LPS(22:0) 0 107119.7753 90398.94653 75024.52536 52443.02837 43655.31166 186314.5603 0 155875.9938 152489.787 126311.9902 108322.482 64971.23189 63245.07969 103064.8609 141727.8687 245560.927 117287.7321 0 413419.0828 120147.2934 476311.355 129069.2435 60736.97774 0 181254.917 167573.6325 153787.6322 114385.1929 167387.1987 157395.5631 123477.7381 91716.00095 86546.52968 176213.8878 173677.0824 78653.9025 124136.1253 0 182800.2649 454566.7069 216513.9625 193991.3782 88471.30383 87191.38665 214598.8034 MMPE(18:1_24:0) 0 272306.6906 205143.3604 657085.6072 1141228.435 361705.607 1370377.741 0 360168.0322 255937.8842 267966.651 870160.7302 1208329.268 437719.8638 1027105.453 1048047.763 780286.0147 421314.7528 0 276172.9054 488423.9089 243115.7532 247344.2916 465383.3851 56.22982749 1270187.178 390613.0686 1204827.242 277646.8016 1807439.887 755279.5178 1494773.61 605520.2025 486997.6027 269206.5213 1480734.8 372639.8285 1511313.657 0 414263.7908 354686.1393 381109.5108 843453.6687 1343240.124 445408.2303 893769.7269 MMPE(18:0_20:3) 0 38718.48782 112222.0127 473924.9794 4322.724079 95404.23307 92128.76439 0 62380.47056 121273.1415 34943.46057 511238.2475 28877.18257 102882.1818 21914.70541 7663.612549 430675.6436 39877.36643 0 110612.1423 105649.0119 148304.6427 137697.004 121118.6351 283.0191465 103394.6131 33432.04358 13248.90546 97108.68392 138327.9697 324982.0399 103036.3385 93932.25757 62166.27864 124751.9514 75781.8056 138165.3175 74619.82582 0 22849.53615 147810.3693 219447.4074 396368.5799 18170.32004 108348.1966 368227.9181 MMPE(20:1_24:1) 607.0419355 797716.0218 774823.1762 1632759.549 2612141.569 1431879.509 3140243.939 0 1530057.149 1236190.47 941242.7104 2334407.97 2615505.283 1794724.037 3395804.848 3011457.597 2040344.844 1572919.407 278.7823638 919512.6634 2075897.435 1015997.724 983216.5925 1823065.813 521.3235401 3128473.648 1207692.313 3772130.46 1239628.814 4708601.43 2214113.326 3408166.382 322718.7768 1887619.428 1489912.703 3174912.032 1819181.862 3608288.999 0 1783878.037 1160492.675 1103251.379 2352358.574 2958290.627 1933895.98 2091338.959 MMPE(20:2_24:1) 242.4432469 88469.58412 65605.6829 144919.7156 176765.0598 134777.1682 556990.2775 0 173984.478 106202.6495 135125.3829 176304.4729 198037.6207 136264.9093 281444.0249 320832.1009 217752.8871 245617.912 0 69861.86963 200653.6327 113013.318 122611.553 151812.7091 0 455426.5255 165059.1033 281364.4578 116943.266 108663.1119 182881.9096 704573.847 319910.7907 199113.5835 94349.48247 737837.3421 212594.6723 669298.8529 0 230750.8526 69617.53753 81819.12248 142640.8771 211000.686 162930.483 148912.2255 MMPE(20:1_24:0) 267.1235234 46904.70232 200091.979 185193.224 113321.8087 171805.1267 445886.8741 0 120890.1882 118177.5967 34025.04012 148526.506 85937.93589 407456.1935 68795.12775 160476.5308 96928.39205 116129.7432 0 100105.3872 623287.7335 237343.2683 257403.1812 391655.6359 0 163537.5421 47165.0304 134175.6414 159830.2066 311528.7017 114809.624 474492.2186 795768.2588 518801.8792 145930.756 547428.853 380875.4031 233820.7124 0 154669.1093 116555.39 175750.5677 230928.5321 104022.4043 387809.4796 179110.0797 PC(14:0_16:0) 34326.33151 263776.454 234403.6876 542893.3501 178016.6164 419778.5173 290951.337 17032.43709 206387.5994 342846.3691 217088.5363 559845.477 308445.1355 297920.3874 230661.8581 246523.5336 520028.6854 261684.8963 17948.14573 242250.4314 120191.092 220479.7765 189237.3332 315662.6669 16034.84792 290494.7448 264188.0744 232528.506 357054.7149 365865.5873 450676.0068 267126.9375 119921.3223 110421.5978 330715.1193 274899.966 286249.1509 354419.8165 16131.99406 254864.0132 280720.0422 300662.0511 579004.8009 287277.3203 276258.1429 543488.2653 PC(14:0_16:1) 0 3519.405601 32072.38496 124066.4446 0 111778.3424 23781.36298 0 12223.5559 86027.71619 17651.51012 203573.0899 128064.9839 107805.7944 47567.06824 64828.78753 175064.4865 18494.75595 0 81906.76233 40554.33624 54135.33209 54470.6187 111793.4982 0 32940.4068 42176.75179 90398.1406 102223.2266 47066.13722 154757.0594 29059.71131 37627.61358 37927.87276 123267.5894 24639.3371 120093.3207 29954.6986 0 27398.80107 113588.7419 107607.5817 147728.8783 141204.7319 127505.0661 200148.857 PC(15:0_17:0) 0 56515.24004 248266.4221 300989.1631 73841.45384 186649.1397 79224.38724 249.2055847 65418.69161 76595.98933 66123.2289 284740.3646 79186.75365 188046.2025 59061.29279 72863.99608 305984.591 81070.68065 166.0420824 323422.4059 51921.672 316905.6777 383104.4827 235840.147 133.2026036 83255.09954 68314.40859 73803.53836 88958.327 127045.2358 345592.2325 47184.04195 57218.67544 62789.22104 106304.2709 90730.1125 233452.7533 99323.89781 113.4006702 84654.86793 404766.1694 402310.2481 354789.1902 82660.0522 238719.2766 336966.7712 PC(15:0_15:0) 0 338657.7248 362486.7902 199835.9403 182320.2711 421919.0319 302817.6606 0 308228.1416 768569.3466 277906.8938 669512.3404 141985.5612 484553.729 144192.2652 139146.5555 118266.3865 238783.534 0 280027.8566 227294.4105 354479.8029 383402.3049 491923.2258 0 240659.9284 337415.0189 132987.6155 627334.0154 359424.9894 399861.2611 263453.3033 320019.4623 283269.5739 692206.2109 299680.8819 489451.6464 328428.8711 0 273167.9682 350150.9663 422961.1067 429338.9451 165780.9906 443858.2028 564119.5711 PC(15:0_16:0) 4162.76366 1701069.975 1472321.443 3944963.465 1417134.405 1623751.692 1133606.835 7889.499146 1749709.119 2157438.865 1564898.322 4391977.176 1325005 2034510.705 1025541.523 1087812.513 4100392.698 1936341.533 12583.23546 1975747.465 717657.8814 1659165.728 1866707.078 2228748.665 140042.666 1488276.793 2150619.776 1164053.026 2400066.187 2090956.913 4249305.293 1403768.245 717676.1678 724616.1422 2505873.984 1398914.436 2312036.813 1755377.948 107475.3707 1990070.542 2297545.875 2480446.815 4549458.66 1548307.551 2315420.379 4429851.435 PC(15:0_17:1) 15.21625652 51345.37758 117585.7171 128758.8933 86358.77677 170052.824 35945.38021 42.85653393 58433.36461 92336.4059 36698.51919 330931.0317 52073.11817 150795.8871 47645.54581 60486.71179 257280.809 44015.90737 0 126788.649 25040.73102 122266.4928 142033.1961 180084.9236 0 33732.8941 41411.69715 53714.93181 105598.5515 49354.09391 251484.1577 38236.42082 26611.15186 28598.74168 91793.92545 34321.33827 145011.0989 38507.20432 41.71606594 43223.65525 163933.6834 108222.3282 55547.26272 60597.41363 182528.2112 289381.5488 PC(15:1_18:1) 440.5189344 420869.9751 617936.7661 1586145.925 367714.2567 860238.0145 314665.3054 2752.596921 425273.9136 841482.5378 440162.3231 1761042.153 417761.232 1134717.781 389026.7 392982.6538 1517368.808 451115.4494 1314.846729 644533.1657 161325.5651 831508.6771 820252.499 1073417.996 1334.991057 347330.4501 583826.5725 374022.6843 1031435.39 497588.4981 1528316.059 383164.1028 144136.7174 163503.5897 809534.1803 365646.6339 1098601.651 420737.4012 1853.165917 440392.3299 804633.8137 839786.3581 1761025.982 508578.1423 1158128.258 1529795.162 PC(16:0_16:0) 411.6874471 403308.1391 622097.9644 857967.8431 359915.4511 541409.0789 251594.5184 136.9274473 290476.5633 527156.2858 386457.4472 860783.9827 324802.8978 422329.2258 265412.1696 279629.52 784387.6066 398730.106 81.22155356 524054.3328 124817.842 598602.8911 750862.1611 425526.0804 131.3642096 249671.9323 419891.0489 295760.2309 489298.9645 346024.5051 570851.3806 253410.4829 141498.7715 129785.2223 519463.9362 248482.0583 368419.8418 288551.7208 285.3803558 399920.2477 570835.0332 629673.6018 752585.0661 362573.5857 463637.8408 530295.7544 PC(16:0_17:1) 841.5233153 1076292.907 2106688.352 4121954.803 507203.2858 1617492.028 1463282.182 784.9611781 473881.8423 1795215.466 313233.5657 4833257.627 172954.295 1887174.108 121846.0864 137551.4303 4221042.375 1135527.591 2786.686056 3122375.681 1086909.173 2448576.023 2823882.733 2001546.676 4551.671893 1379103.736 344173.3447 178392.5594 1906197.613 1894516.929 5002639.769 1777278.491 752389.099 1143318.759 1917098.114 1523875.881 2033521.457 1832484.121 3184.189214 502702.7488 3718806.972 3848541.358 5210983.421 203279.2144 1888401.295 5088717.918 PC(16:0_16:1) 1194.19232 385099.1598 609676.7538 1275778.697 355714.2367 1423751.316 287241.5486 99.00656007 400750.9938 1072075.675 320038.0644 1462352.068 421937.3189 966553.5214 363228.4257 313586.5413 407876.9085 358943.194 148.017266 653539.9512 341219.3957 597897.3047 654093.2138 973898.4854 77.47184805 89647.68605 102898.1869 206131.9772 348190.5264 41943.02668 1105691.351 201694.2101 362540.0776 377355.2545 120792.7186 310622.7712 993480.0533 188342.1893 454.7998987 116571.8808 728938.8736 758889.0386 1124348.82 663516.2838 765942.6518 1189075.359 PC(16:0_17:0) 1911.773233 2234664.53 3612604.017 4281024.809 2058918.177 2250441.379 1437270.638 2843.833952 2615293.509 3421178 2267056.405 4808860.62 2195608.2 2828083.179 1783881.389 1848695.862 4426373.049 2590639.508 3638.92365 3271887.373 781131.8769 4192299.563 4444841.261 2952593.658 5132.207166 1614703.111 2697762.28 2002035.967 3415799.102 2167662.005 4117446.517 1660431.237 875311.3153 817104.3042 3460897.428 1709307.451 3022982.951 1959195.164 6215.251498 2748330.032 3750345.155 3949351.109 4551389.293 2545739.334 3181727.087 3866999.997 PC(16:0_18:1) 2761.660249 1733458.994 1264689.698 1675652.388 1452370.571 1919401.71 1387248.735 2974.303097 1697636.01 2357866.3 1608787.872 1961346.775 1357817.806 1322617.214 1291304.358 1015527.981 1930752.367 1637856.956 3944.170877 1490085.354 1155287.149 1862022.341 1393849.108 1396678.42 4484.666653 1127336.026 1864203.523 1335664.822 2293909.922 1737120.57 1770632.065 1287358.195 1288006.314 932741.9346 2314253.275 1287044.657 1870625.023 695285.7112 6279.16774 717398.0629 2187206.809 1840697.084 1644023.954 1699080.819 1164261.049 2135895.122 PC(16:0_20:4) 12.56140549 144743.989 65225.49699 87634.6596 19810.8101 53827.24738 143889.1933 0 124701.4875 50458.04962 130645.1678 43621.26815 10482.2844 44513.45585 37806.34195 22748.8184 56762.35752 122061.5405 0 71882.07339 38473.63604 76537.83168 58013.19368 50073.82321 0 103159.6564 88905.53896 22448.77376 38535.82114 150735.4468 65351.01191 93675.21719 28394.53405 37854.08134 30088.49893 88705.78683 34485.31684 123188.8085 0 98022.07781 78652.10341 89023.19675 51603.47214 28207.1409 41440.80907 43981.46118 PC(16:1_18:1) 112.6947534 218904.9649 266557.8959 474161.6815 349813.12 1092222.318 121118.4259 247.4808003 206592.0462 687751.3632 172075.1611 513055.4111 165492.0005 697297.671 162449.4442 151920.9968 405691.964 235667.6298 232.1035135 251748.9701 167855.4061 121708.2314 368791.4288 765453.1093 261.4002186 173425.6606 316335.3161 191710.4124 736738.6896 198847.131 315327.7514 184005.3935 186881.5311 177581.0329 732377.9252 116737.1968 731822.3899 150457.1539 260.2361967 194825.6251 313867.6031 377429.3447 369516.1019 190598.8822 678361.3077 391039.7064 PC(17:0_17:0) 0 57592.49654 143007.7784 127205.9523 105875.0851 119995.4841 70315.94854 0 58793.80041 77621.72422 56467.59702 191466.3857 122657.4407 156086.3449 106852.5646 101331.069 178620.3703 55186.05425 0 163963.7913 56271.92866 132205.9298 225112.2228 99821.00625 141.9571019 63458.04754 82812.77123 124725.566 76991.34468 14962.80557 224669.7399 71994.42399 52187.04839 56901.8461 83434.36897 69570.24319 156302.1647 75002.15993 0 56665.94309 309194.3633 282980.6511 141610.7985 152105.8915 181165.3098 229472.2676 PC(17:0_18:1) 11486.82824 10231266.98 7675899.455 8984258.386 8460473.806 7268544.713 9352936.863 21266.6514 9501999.894 14635057.7 10013616.27 10663636.95 8807769.714 8563727.375 8106060.477 6385991.427 9609943.131 10115391.07 27962.16433 9052457.817 6365175.502 12321072.86 9827340.4 10216853.99 37380.94123 9061143.75 13326508.27 9428269.97 11552384.42 13351453.28 10477621.59 8405145.606 10509422.73 8935063.244 14962719.15 9437077.412 12829359.12 10240981.91 46017.3644 10909346.58 9873347.798 11705473.66 13929696.82 11406501.69 12894067.35 13859437.38 PC(17:0_20:1) 1643.975304 6102703.829 4038250.017 5306950.994 5843683.111 3884051.638 6098046.858 2079.045163 6081093.778 5056214.318 6144610.719 6068992.752 6922284.389 4932941.87 5776587.929 5607523.245 5075665.939 6160783.673 4232.424216 5200729.381 5634050.059 4619338.448 5502447.553 5227927.978 4973.399695 5864496.156 7409497.019 6299176.867 5464870.014 7615989.493 6220534.672 5878156.055 5893624.005 5817370.985 5719238.492 5753289.639 4907792.736 6159327.718 4664.967275 6687565.344 5858954.551 5901285.55 6709717.028 8028132.169 5340392.288 6332035.949 PC(17:1_22:2) 266.5543342 544975.3869 324977.3266 264863.8577 613232.5389 385444.8956 160715.6488 518.2454872 307040.0689 809880.7711 382867.9516 254855.2766 572154.7517 640538.4522 451148.7138 514123.6372 230670.4416 276074.3701 0 391701.3741 126755.5382 532442.5476 424120.8221 590259.288 1316.772459 218396.8025 683840.4236 519057.583 745064.8754 346753.4069 118030.2191 508131.0339 91987.19459 222228.2914 917757.4782 260579.2876 508204.5009 334110.4924 1369.868621 77402.9616 583008.9585 370110.373 215257.0923 759691.1412 495737.3536 185856.4173 PC(17:1_22:1) 3193.667854 977268.0909 990852.1172 1004715.407 1370928.407 1442729.822 674217.283 22265.89111 906994.8943 2235626.283 900949.5737 1249283.098 1465511.912 1831511.089 1150724.71 1225542.616 1018408.918 977261.3809 10251.64745 1207341.635 1240708.284 1214758.438 1354788.717 2001001.146 12884.24952 799121.3502 1217407.424 1326594.795 2380191.086 982796.7579 1076104.288 703736.5976 1288296.565 1290223.989 2703993.142 678845.6341 2071034.087 889021.4297 6247.566903 898801.0101 1396292.909 1467445.191 1184183.908 1721321.678 2081664.434 1108055.975 PC(17:1_18:1) 678.0259011 3818122.515 2194525.239 2900285.335 4144667.226 1927148.944 3073023.396 1448.655957 3624437.559 2998234.208 4110235.75 3319073.854 3851956 2392917.721 3442069.021 3527713.986 2879246.16 3733370.408 2758.898599 2276384.005 939096.8014 2316608.013 2532736.944 2462677.336 2762.282958 2809428.378 4856965.683 3774875.451 3355849.949 3620308.173 2554965.044 970880.6923 881103.4099 876956.942 2656064.23 3218744.335 2376051.392 3326661.504 4014.140601 3884888.909 1033347.356 3186391.414 2218126.738 4855062.533 2310829.861 2596765.101 PC(18:0_20:1) 154.5247391 119894.1751 128927.3937 93423.61638 179285.1201 149245.8458 111274.8357 38.47907974 133542.404 144993.5749 146526.076 184873.0498 201843.7729 210482.4243 125439.7776 187985.191 125623.7811 138970.7908 0 182774.2476 151835.7022 187066.3416 236634.998 155075.9873 0 105144.0992 144096.4288 158155.7038 171757.8824 142947.4264 178344.9933 107933.6725 163430.8493 168456.4832 165908.8427 103572.4011 176347.9921 132046.44 0 113570.1354 257711.17 226499.4775 129974.9237 159308.7989 189063.1615 162607.9886 PC(18:0_18:1) 0 597125.3804 737921.9565 634693.4048 642916.9246 369784.4639 640850.5832 0 478278.284 494297.9179 543923.0197 892741.2243 489467.1519 619322.0179 445851.478 383414.5272 832724.4595 575455.2432 369.3363413 1093323.737 532501.245 962134.4882 1024725.306 788964.3778 585.5361191 479089.4305 710603.944 730471.5344 551999.1863 627910.2201 925410.6993 767870.4618 558417.9628 528595.7269 553475.4348 689107.7113 851086.5133 928786.8596 421.6317938 541876.0588 821349.4386 1316986.97 912428.3163 949115.4255 803087.3588 993891.4838 PC(18:1_22:1) 0 37078.46605 87580.06227 63847.37315 93761.60404 206192.2823 41581.04001 475.0036472 74546.76885 196445.2653 83380.01802 143523.5594 126303.7138 151274.4144 78269.11178 91875.76188 92118.24241 86781.00049 0 80287.17327 106345.7537 106796.1711 127755.5755 169577.6682 0 38891.80974 80443.40471 132818.4719 176914.8706 86520.0436 115872.1298 52747.48081 99934.29217 102019.0491 196082.9416 50468.12854 185553.9961 65983.37096 122.2124131 69073.68225 113981.0847 100891.445 144708.328 150789.9821 180324.9863 134374.2503 PC(18:1_20:1) 0 242579.1483 252861.2493 289504.0093 261501.0699 268930.3946 224153.7324 2601.769289 265748.0248 307218.6982 232621.913 385815.9081 290743.3004 291102.4603 202557.0566 281181.2979 298464.97 212041.0956 0 343008.0724 189074.2284 340061.2485 410575.3425 311445.9793 302.8115481 290603.8167 283752.6589 306062.9191 312165.5795 211165.8445 275567.7411 270350.9865 201548.5035 209440.9846 330416.6642 249701.2805 332121.1251 303767.6855 416.7449112 225576.028 397819.4197 430006.2757 358438.7404 341147.4421 304988.2058 346225.9397 PC(18:1_22:3) 0 27043.68344 42154.80692 0 0 41870.5092 81521.05475 0 56666.25979 26960.37617 48505.44489 23552.05765 15201.18689 44910.74425 22850.35855 0 36575.73597 53182.67876 0 42744.89825 26997.1407 47904.80192 92228.81042 57233.88644 0 59517.93121 37160.09618 7958.18314 92296.81843 144297.5837 40900.74526 65280.39609 29759.04269 34673.99386 28594.8518 47852.74036 33828.473 46795.27765 0 30464.83895 45969.41919 59317.40015 22945.37396 11239.94753 31038.33789 52384.88189 PC(18:1_22:2) 0 21101.36642 131468.953 34240.05959 97147.38235 113533.1916 73107.54061 0 101673.0111 161129.7163 97437.90563 121502.2635 72003.41216 152918.5706 86645.45303 85963.57241 92813.14987 94253.62674 0 102105.6255 93956.32902 141806.8724 162009.6221 145353.8857 523.8374239 127914.4485 84976.54513 105575.4865 136862.3886 106950.6499 88312.60522 94910.67455 91341.91364 87133.27355 179274.7527 99335.40977 148406.233 105777.5543 0 116056.692 95043.82141 108241.9804 134161.8649 107368.4202 147031.151 95591.50326 PC(18:1_24:0) 0 101360.9956 221661.6222 317941.5289 130408.6672 424565.9592 18070.94638 0 102493.9376 286149.0065 84473.11768 373349.9238 124978.6391 235585.2977 87731.77821 98005.06425 202035.1116 94047.44644 0 198665.1435 112593.0364 200239.5607 291056.5278 222186.4695 0 28040.39005 129927.5392 113025.0248 251256.0403 51120.44182 375245.3385 20726.06745 127818.429 125160.2694 233069.3511 25285.83151 324480.2711 23903.11023 0 95676.48299 258148.1209 325720.9222 448528.1138 154781.3216 284698.8287 381620.2171 PC(18:1_19:0) 0 85937.62721 116554.6237 204598.807 77971.40859 101864.9287 86307.42887 0 105254.7106 141730.1544 70909.36616 234580.0444 189446.155 151057.4985 158566.4113 57555.10051 49726.55285 35284.91658 0 157598.8828 115238.2172 92398.05982 56307.67837 152270.6335 90.81328057 11944.60881 69005.2781 148814.9715 106425.5578 129064.1847 144579.9107 100840.032 91261.53489 100401.165 96597.20652 91933.22007 98685.9481 79686.22436 301.1558388 33967.40298 197415.3071 219170.4246 242452.0749 226869.6214 108283.3309 223240.9406 PC(18:1_20:2) 493.3322192 119435.8139 76502.82419 76775.49053 148489.9093 135271.3347 93454.73563 0 83681.70938 135722.4989 125587.5312 86691.30023 119576.3306 108417.9415 81888.55246 100599.5119 89200.51473 92483.41279 423.9390551 117994.1685 64610.47328 74556.2058 137185.7831 76315.29322 0 88810.6688 133477.7349 108370.9939 118534.742 124022.7372 60603.20818 106053.5295 70231.67427 53536.92686 128624.3745 91113.32248 123330.4146 104714.2183 0 90546.34741 158890.8726 93970.84528 83301.30638 112846.8061 91354.74664 72183.72951 PC(18:2_24:1) 251.6000235 21518.19406 93352.61491 48488.89823 75442.64854 150045.4764 78146.13444 0 61741.66753 187004.5975 42139.29862 114469.6371 97334.85626 161407.1677 78279.79458 95197.70537 126863.3768 52339.04438 0 87422.26753 62127.30305 103115.0285 123345.1968 185106.6826 0 97004.38326 58411.6791 117494.9622 159259.9438 155199.7114 113188.8842 88928.9768 54841.00864 57490.5273 136548.2906 110921.896 151291.2607 104960.3876 0 57405.91951 87361.70251 95916.25699 141085.1446 130559.7217 131212.0902 142915.7264 PC(18:2_19:0) 0 133891.7707 176052.0662 191344.4032 157120.1896 166539.9274 181766.95 1102.697786 116816.5767 262096.9591 104659.4786 253836.9097 143853.4269 219475.0658 132518.9175 153105.3606 224265.3906 125239.0383 0 226078.7076 149309.3346 216340.4669 211159.8751 253473.7505 396.5777023 143783.0286 144943.5727 143749.5938 203786.5632 239534.6618 210677.1654 178081.1841 180932.2931 136218.7084 298853.8233 242158.3496 255802.4218 184904.9117 254.8136818 105685.1273 261495.0247 248408.8608 217804.6104 116413.6562 198319.5384 239909.7715 PE(14:0_16:0) 0 33120.60746 10021.84656 121821.2185 33703.57757 36473.02976 18495.96087 0 30427.97277 50512.73402 29610.78771 184904.571 48114.6813 59064.96228 23972.73822 21117.08995 264219.4597 30874.42136 0 21742.10394 13830.81512 15362.82889 10652.14437 55944.43103 15.84066685 11786.05941 27970.23763 25768.79581 46968.84536 46522.19363 127650.7266 28092.11127 18653.30316 21109.61864 65472.97305 16983.65451 76831.51466 31022.35496 64.94116688 44999.00388 32758.63852 41133.34934 142394.1929 40882.17465 59096.43142 180121.7425 PE(16:0_16:1) 5.581894024 347985.9606 507787.2254 3160787.924 364826.2472 1217971.094 268466.4601 77.32296726 283656.3575 1824906.171 20730.48015 3252277.133 397603.6348 1753380.167 329743.5784 381856.3172 2475587.654 297421.3296 36.66175053 769081.1811 533849.4461 604330.4089 686758.5418 1583709.451 291.157184 340016.8739 208873.4669 376771.649 1673268.567 506119.9086 2878372.701 225405.7816 601242.8945 488288.5204 1717544.813 297927.2015 1480716.827 342482.7059 264.0638584 233356.4739 896587.2536 1123696.159 2832180.919 418814.0417 1529659.07 2869498.293 PE(16:0_18:0) 0 296409.5845 273585.7721 453393.768 251246.0014 588687.683 155050.8543 0 366394.7918 910973.6697 256385.2582 508091.2712 262599.8685 626853.9011 179193.9047 157774.9346 324108.2239 252932.0444 0 193156.5755 134280.3079 405001.1991 322588.5902 493517.3561 0 172578.6442 400112.3549 223433.1279 736262.2093 373723.5082 553908.0392 230307.2085 160728.9273 133101.2031 971635.7839 210170.532 660117.799 304433.2413 157.4599122 366198.5832 199336.9651 234913.4587 598245.4777 281408.3425 586455.8776 540940.1957 PE(16:0_22:6) 38.38230456 54764.40257 387300.6844 1461007.975 34777.23823 295106.3735 158300.5431 0 44032.01163 560656.4822 49739.72039 1566491.465 36359.59857 339152.3948 32221.41889 26849.8001 1073875.187 44864.62017 79.80107991 300006.7524 124067.1028 313345.6402 432366.2303 347614.9934 16.97170559 145562.6045 71065.26644 31161.99659 482477.4471 215484.811 1278944.875 186244.2503 160743.6175 131209.3868 488072.7124 199287.1206 382673.4334 169661.7768 22.39209745 41296.40511 421838.1795 549712.743 1378469.666 49891.63546 382865.3203 1508228.608 PE(16:0_22:4) 0 360005.228 206685.7097 1422790.737 247669.4046 237132.895 1023447.323 23.25319614 487162.7477 364513.1594 388194.7047 1727087.438 171814.8051 218257.869 177832.1103 193535.7233 1317799.994 393868.789 42.87345257 614847.409 309664.8214 518680.7738 389279.1863 247524.9374 274.9628758 1145116.923 536994.1192 165858.0598 371466.3914 1828682.699 1484312.801 1241828.236 293581.7291 132697.976 377419.2354 1099276.428 269226.6923 1460933.24 170.2773098 433426.621 410798.9458 438032.8945 1718308.448 229461.221 220004.7748 1650034.735 PE(16:0_17:1) 0 18411.04653 48671.24427 124923.3221 19591.14432 73082.73268 17778.60499 43.44445181 14028.16351 56755.06093 14146.0768 207404.6157 26541.48769 75566.13607 25728.02167 14518.45376 169671.5991 12196.56128 17.13741814 45095.23811 26466.33463 62716.19599 65342.68475 82119.29509 23.10265901 21376.66703 23170.46456 19928.54337 75669.01262 32384.61277 167191.4361 23701.08771 43527.61214 34474.7316 71431.85884 23537.7827 80094.61813 27059.65901 0 14512.77788 53961.32179 91793.57232 187337.1177 29876.12664 107255.2743 224751.6652 PE(16:0_20:3) 0 53916.8502 198783.23 612736.0559 57865.90015 402922.925 67595.94534 0 43168.75653 532194.7701 51281.68855 803431.1308 60413.83203 436369.4557 45158.81011 49793.80761 544279.0723 44395.19234 0 191025.2202 118282.4043 215971.8134 256189.4513 411473.9023 0 73702.99444 77213.70777 50681.59204 548399.7727 147827.5914 585774.6039 65507.41614 162284.4708 34713.11264 618927.6624 79778.15365 449433.6494 112780.3765 0 38367.98462 310154.8731 474115.9128 624161.0142 68801.1 431119.3053 635120.584 PE(16:1_18:1) 107.9442636 229518.2756 90965.52316 2713823.493 549392.7214 3562211.251 233693.2147 0 203029.1703 2970135.821 288025.1315 2654485.727 714174.4614 1639883.067 656906.4784 108664.9521 2219851.047 246718.9216 193.079697 956295.5345 490039.6681 221151.6023 712291.2442 2475175.212 205.5900429 233597.932 326768.5282 767181.3288 2643583.583 408032.7452 2153588.049 263292.9431 806126.6048 939443.7691 3411269.738 274173.1338 3147071.899 311950.714 594.3110646 270295.2993 1060997.574 1152977.608 2375255.073 823476.3534 2898445.891 2362675.09 PE(16:1_22:6) 0 792.2266823 39793.41668 138688.2077 0 98700.40802 0 0 5411.189514 89749.49746 690.8016406 158058.0808 1489.231997 91053.27766 2439.147971 2307.475898 106806.7839 2794.171127 0 29386.15737 9365.972784 35987.55049 51368.47309 89474.55828 0 9049.715359 4000.246434 2600.815664 100232.2142 13826.17133 77983.13899 9622.295204 8467.01968 8055.237507 107716.8408 8871.231436 101395.2108 11073.86744 0 2022.752065 41966.2186 45085.05539 96219.21621 1375.677738 76172.75944 103333.9874 PE(16:1_20:4) 0 43338.13541 128784.0141 315609.6075 23297.16625 256490.1952 55898.11846 0 54791.59529 326849.18 34424.54946 278878.1341 21370.7644 249892.7262 30550.07703 28416.58954 281275.0984 61806.06464 0 82322.94881 21527.75937 96908.04666 113513.3415 227155.3889 0 57749.98551 62455.49496 26157.70484 257799.4832 89849.76354 185525.7937 66945.67009 24288.91069 17585.10923 210619.0146 49010.48884 173524.6301 67968.47566 0 56476.72617 118971.8658 143990.0803 183927.5724 28739.30868 218710.0218 173838.5315 PE(17:0_20:4) 0 79959.93021 78374.77277 74102.02345 74666.26673 28454.25633 86325.98854 0 54701.82585 35678.03749 69375.48038 172908.7499 68725.64013 61572.11089 64294.42336 61591.53122 146080.427 73468.48567 0 56573.18222 4370.883534 69347.23164 78726.16095 63943.2183 0 73609.11094 94425.40829 39509.44548 46609.45989 129229.9593 130329.4233 81349.48518 21602.83911 19164.59678 40913.75552 86672.60229 50693.80316 94923.7521 0 56202.55277 98051.67326 94322.75395 132635.2642 77414.8825 49474.23745 166050.4547 PE(17:1_18:1) 0 41484.33453 158301.82 442913.4924 55559.74748 291982.8508 70311.66833 0 38094.78765 416467.361 42852.66144 484100.0358 52533.65647 382418.1789 51738.8809 45962.19631 401732.4604 25420.80868 0 167173.7801 129383.1603 143362.779 200568.5899 404237.6591 0 74484.44117 63849.54647 37596.30822 350721.2802 110880.3944 352350.8774 68498.7209 149130.5307 129153.7722 400339.2546 79905.37252 335891.4124 99355.96508 0 43836.43743 230887.8524 251346.314 393736.7875 94226.85457 352026.7686 319869.3505 PE(18:0_20:5) 0 212113.7169 215113.2759 89815.49413 485488.2348 268241.3747 290352.2686 0 149160.5171 211929.5694 192685.2377 616452.8361 491166.4275 198111.9661 496216.9141 485034.3544 552846.974 164285.2385 0 196221.9109 61397.99325 210975.7846 239039.9581 231645.9502 0 331630.9795 243700.2139 517869.1891 221155.4763 582245.5363 593266.2287 339909.3422 94060.5013 90566.15527 218956.0915 296090.0165 249865.7563 391633.3143 0 176727.4412 266434.2262 384321.7835 605242.5812 700997.3054 259460.9129 668516.9016 PE(18:0_20:4) 4312.243284 11912779.1 6524579.281 15340163.07 8712028.208 3584986.29 10743988.35 1809.981056 10441883.45 4174469.855 11078000.41 17492654.04 7777845.332 3966406.108 6974628.762 6994244.873 15822251.18 9647092.88 3676.658091 7611776.597 1598396.273 7099939.531 8108477.939 4016790.278 1707.647229 10714914.55 14399869.74 7663401.311 4119321.121 15517835.34 15516496.77 11635667.6 1993138.126 1658869.146 4430338.141 9804295.922 4048041.82 13451620.53 3249.540807 9345803.546 9565380.833 9969967.387 16124482.69 9572548.021 3611047.493 15015532.42 PE(18:0_20:3) 676.1160675 1558897.16 646688.114 7033364.562 1158036.71 4436153.379 3749797.218 227.7740393 2831243.245 4830739.902 1629367.546 8975452.064 1230668.67 2999404.292 793753.4778 943165.94 6225275.809 1547618.173 0 3798278.495 1625234.139 3397784.581 3178272.065 3834037.858 1067.5845 3064114.52 2932114.921 1023501.3 3373451.039 5028213.446 6798113.914 3210782.454 2348365.368 2645822.003 6359269.072 3113592.316 5065331.775 3844088.021 1392.018156 1725071.032 3697197.634 3953769.495 8290106.41 1095958.368 4624128.582 6811152.727 PE(18:1_18:2) 14.67939552 1245126.598 455637.6342 1178904.507 3338537.719 1170961.448 773704.7166 0 894199.2298 179451.8747 1152422.966 1394379.066 3716784.45 1257114.589 2881700.561 3042074.126 1027834.457 826081.763 25.40414458 163188.9892 364464.656 58737.57992 367175.1821 1298060.275 78.75651872 922306.2757 1445884.909 3227665.862 1516448.56 1297338.327 936762.1026 898100.7486 480257.208 458484.6501 1596843.199 776585.4004 1197024.589 1043849.097 86.26195536 777004.6317 592582.2997 501487.3367 878737.4826 4099874.115 1220182.589 1007597.198 PE(18:1_20:5) 41.23993701 305529.4529 297790.4031 782551.8242 457813.0996 785799.6615 236394.668 70.18809181 213167.1045 1277074.948 260513.5868 1258254.587 361642.907 1063515.026 273697.4096 288067.912 1066389.487 243475.9402 40.15410365 441269.1675 254901.2404 412084.2316 555606.1088 1078673.007 41.04765305 271292.3417 307141.1674 300245.7428 1182245.297 240219.2254 970952.7601 263218.0454 271576.3586 265013.1884 1245497.251 242402.6628 1092785.561 196398.0496 167.0554564 230635.6438 747591.92 943342.1301 1081966.012 383296.119 850613.1908 1040463.344 PE(18:1_20:4) 146.6573169 2139941.034 1951744.607 3905587.236 859198.6538 2432750.648 2288759.79 299.4159603 2084481.264 3476156.315 2088467.235 4555534.782 1033544.525 2370413.484 1018670.886 891793.2148 4007859.01 2091741.943 312.5501919 1790953.587 697813.2518 2295623.567 2588157.099 2648542.005 329.080395 2327359.196 2851348.558 1045118.664 3470533.168 3550085.863 3476595.91 2172339.135 857124.5686 753909.7878 3953993.941 2263986.578 2552571.445 2596003.753 338.3293442 1914133.398 2379114.185 2742952.56 3767247.538 1113802.611 2547059.787 3926167.221 PE(18:1_20:3) 692.8138199 250724.0968 147784.1088 347610.7825 235890.7128 480054.0281 393628.4762 0 272018.803 781496.9881 313141.6365 865143.8857 249274.6118 304023.6382 224369.3179 241558.802 474340.2122 299361.9724 43.29274471 360742.5126 246332.815 245290.7573 308173.3677 633594.0928 17.56647901 534582.1513 278347.3244 266084.5987 783974.333 824672.6626 611539.1149 524239.8664 247026.6766 242234.3399 884289.8949 488141.451 600524.4533 684878.8839 0 299723.5945 241358.2482 416106.4751 760925.0479 301255.6382 566430.8562 610479.4715 PE(18:1_22:6) 110.1143451 215911.9667 1121276.101 2229810.737 166265.0454 1354649.96 501470.5801 550.1385085 208336.5507 2245284.624 188804.8326 2626992.034 118451.559 1672809.164 119574.9204 120044.8225 1919523.107 195943.2112 448.5053759 826383.6832 385517.5325 1146479.058 1544857.725 1571617.362 951.0188792 492460.914 264295.7951 116758.8219 2449285.161 1027484.656 1901524.862 575703.4346 566283.2411 446793.7134 2522234.721 545308.1872 1749772.893 709341.106 996.5362797 201292.9532 1175903.858 1578140.863 2212613.888 143094.2439 1719624.721 2334754.879 PE(18:1_22:0) 267.4271774 306818.6246 338232.4698 922565.2178 561554.8282 581159.4209 347344.8355 0 225216.7087 802919.7329 317011.6344 1085607.667 575191.9086 577849.7211 580389.6436 555841.6034 927800.481 215301.9279 0 361656.031 399606.0524 392252.5126 393360.4091 627734.1683 0 433416.5359 389717.3974 599682.9978 638442.6572 695705.8011 702606.6598 408297.7113 421725.865 373106.6668 855644.746 378896.1934 571121.1095 505132.3113 0 200262.1393 488259.4588 544380.2994 902521.548 758957.3511 564380.7796 815235.7484 PE(18:1_24:1) 0 309387.5457 767007.2704 1249175.588 806127.9286 1555614.318 312030.5424 755.9208982 267340.7157 2328787.708 379930.1653 1472217.043 948171.0843 1649754.63 754747.4009 739139.6487 1243622.91 232623.6339 125.6126522 655795.5698 633314.0776 920389.2497 980561.4115 1651882.07 634.3469282 473998.6984 486268.558 771729.3125 2008224.457 859571.9265 994538.4532 416245.367 665643.2357 618602.1787 2499825.63 363437.4998 1708316.293 575065.8256 308.3257825 297149.1735 849336.8942 992382.0157 1157525.813 1462473.201 1614356.602 1040405.027 PE(18:1_24:0) 271.105357 738500.3781 611506.0482 1449052.117 1373987.87 1184542.133 412600.8282 0 441383.4955 2128167.754 661180.026 1886754.798 1402645.718 1304306.83 1273611.259 1347735.854 1672740.6 378093.7119 0 719790.4631 625060.6322 631523.9583 687054.806 1275158.012 388.5033337 600575.1561 894224.3961 1464837.089 1807796.365 1167258.312 1690666.238 485375.6561 527770.7522 700023.4596 1945472.032 396018.3155 1318072.502 740497.6645 0 451429.3926 852158.0961 1176158.204 1604253.381 1548115.13 1066863.083 1310917.152 PE(18:1_19:0) 275.5118935 78536.34705 119377.143 426728.9347 0 220959.7973 158234.2179 0 44299.93189 106608.3202 19674.53639 453158.0117 5857.528572 131211.3152 0 0 555037.5667 19088.44318 0 181444.2617 124410.7358 118316.8163 202854.8998 214213.1169 0 154190.6406 82539.66246 0 102693.5574 253910.7468 473407.4336 131442.5283 86293.75414 139109.7643 239649.1296 148098.5605 167823.1511 166985.7484 0 50662.94322 135523.4633 177177.3992 493049.6691 0 233193.2135 536029.6735 PE(18:1_22:5) 0 208373.5156 402156.0045 575211.4834 101208.2288 385231.5597 289425.6454 150.7131998 217614.1938 654226.7718 176327.8631 865822.0038 118355.0532 497573.6789 111654.8781 106886.3937 618400.6035 203927.2098 43.91153237 348515.3333 232016.1685 61333.72338 482260.4776 603050.7472 235.9920503 235365.9493 257759.248 135092.834 640301.0902 387700.7626 617365.1383 290938.3541 40444.55941 269691.6257 684390.8719 204256.6411 579268.3277 254381.6804 82.67994382 202004.0133 413314.5973 463342.9269 658940.9785 137763.324 592004.1452 677714.0536 PE(20:1_22:3) 7162.956309 174704.2297 221364.7506 178028.0351 140764.1219 175375.7775 384764.5767 2556.941574 185018.6623 294498.6957 220192.514 521744.6449 164013.1401 270116.8501 149290.0601 125189.2814 205825.7389 161721.1007 4766.168669 245991.6629 118111.9062 224345.4017 259244.1356 287883.8591 6879.294025 141780.8327 189745.885 135932.9286 311551.8504 775242.5835 292264.3834 430365.7119 148258.559 166397.7118 387484.6937 388179.0647 213823.9004 545842.8124 5575.713062 141611.0781 239124.8704 283717.9318 360665.9494 149700.1274 287945.164 321430.9621 PE(22:1_22:1) 65.07713778 224336.3021 998366.5897 1275604.691 362873.2778 2022968.582 140904.1772 208.044772 195246.6262 2898845.304 234171.5962 1723891.334 467384.0301 2423104.627 356496.4631 467848.4033 1524599.386 173611.1433 0 823908.8541 458361.8187 965488.1703 1237015.165 2310324.668 0 305109.9624 322624.6392 434756.439 2351393.738 537644.4845 1804841.215 174220.7302 446074.7419 526650.4383 2835439.867 174240.6223 2316091.119 391062.2845 758.6318863 210987.5542 1065822.663 1487725.09 1543787.043 487878.8947 1922481.145 1034797.681 PG(16:0_18:1) 0 23207.4357 36979.17471 109348.6599 337984.8241 171031.1805 19957.15248 0 66197.34432 207449.3606 60792.84443 181242.4405 381770.1519 228059.087 175794.1967 212134.6231 153296.7256 69828.22773 0 184706.5895 110538.633 106541.1816 115510.0451 185835.4617 0 28453.5522 103922.7994 186468.9954 217534.3307 72739.9616 88406.81544 42912.02404 125238.4413 125271.9007 257145.4262 43182.11441 196171.6305 51646.0339 0 97800.02923 307162.9263 156580.6974 130586.0568 352038.2043 258020.2837 215232.6299 PG(16:1_18:1) 0 14070.97673 10041.93311 22994.13981 93894.84275 126646.1633 8267.8396 0 14885.56738 103794.4422 22324.57674 49297.04061 181188.4919 253287.5922 92220.12207 93936.84257 25881.6453 10951.82082 0 43734.06378 11355.27405 26400.78468 32888.55216 226209.1476 0 12453.32132 36722.36288 173290.2564 120733.7484 28293.42617 28464.70329 16826.68718 17553.05278 19573.86337 125588.804 8647.928514 187424.815 17223.88087 0 36735.64052 73509.14255 58854.66459 54262.07784 223846.1345 194040.2089 46327.42267 PG(18:0_18:1) 0 79691.38442 71063.6031 125414.7708 454159.1717 191524.0501 53042.25686 34.22665095 95224.40479 231105.2757 132211.4525 232308.0803 743537.0689 196059.226 389853.5444 441982.4793 135297.482 131098.3302 18.12575832 77685.7415 127594.9527 158634.3535 161477.0078 201431.5036 0 82704.2065 207005.9017 403309.988 208725.6719 166320.3241 177880.3239 95387.07909 65537.88375 218989.2286 229550.2018 87933.6367 206598.3052 120788.188 0 136394.7756 314548.4985 313040.8015 236335.7537 845062.8279 260636.0827 54949.25196 PG(18:1_20:3) 0 190825.5914 139894.5107 201453.2736 160648.2316 246204.4414 82312.08479 0 118025.4268 294157.5802 145770.9464 331999.9231 158202.6137 414442.7633 144289.0454 132779.3155 257715.8783 289663.4347 0 203857.2814 99794.9547 115961.8091 323823.4919 358097.5086 0 17747.41806 484034.7015 80805.93837 311664.4911 399113.1045 262841.6819 191397.7571 112554.4818 109376.1161 440144.5595 219425.1827 392133.349 235040.1333 0 305913.8914 255112.1983 284937.5639 268896.1413 217408.8268 356440.9658 235701.0778 PG(18:1_22:6) 0 72820.74827 272729.9445 141664.5928 81992.65559 245389.5496 205458.292 135.1374746 75786.27004 319564.9638 74871.6922 393927.2417 294440.7231 456935.2766 208385.3139 230897.6111 326471.6922 82104.99106 0 427685.7695 14498.35101 358342.3753 425075.6992 414316.6464 0 189204.4147 104136.0846 235681.819 286715.2279 439559.7596 300802.6362 232526.9984 87662.9737 162855.3505 374549.6867 221679.3977 411720.9224 236679.0863 0 73440.39758 548428.2367 554040.5818 365672.7153 335265.3054 358364.8179 416286.2415 PG(18:1_22:5) 0 10555.58208 109810.6154 0 22475.7915 71358.65142 79725.39337 0 21880.47572 100705.9386 43742.06683 102395.3001 18212.48935 121919.8519 14700.47797 19536.50231 83969.03059 40372.13642 0 160829.0324 63135.01682 177135.7398 208209.3517 96060.22336 0 212324.3306 98203.82656 35305.60173 90280.321 549975.8082 104005.2972 212358.2202 73056.9533 74035.87426 122255.1337 231471.532 97102.61846 262961.6 0 58704.22087 175194.6557 223251.8477 111596.4816 44104.10702 101906.4754 107898.075 PI(16:1_18:1) 0 155638.7769 907653.6137 1160533.92 167787.0836 870792.6209 150302.8681 112.306244 216584.6961 689221.2386 248443.2746 1475958.831 97298.37644 1674030.554 219812.3613 219435.8286 1117702.711 190654.0315 0 971644.6075 391196.9357 1312448.278 1440871.313 1815760.333 480.0407349 327302.2488 367741.2524 536941.0272 603719.9212 156965.831 1080034.928 108935.422 389647.7788 396867.6325 646533.3081 376084.2977 1678793.633 414835.3088 126.7468489 29888.29692 1245176.267 304538.9022 1171544.893 547010.4155 1518839.031 1259401.244 PI(16:1_18:2) 0 0 0 0 0 7736.43252 0 0 1689.813883 3278.06452 0 0 0 9394.918872 0 0 5448.651042 0 0 4804.367585 0 7123.36895 7231.329587 9855.749918 0 2495.606802 0 60.63643287 4120.01353 0 5362.099787 2284.460552 1860.056346 0 4809.684094 0 10630.0406 2797.857705 0 2059.753741 6827.428812 7027.893151 0 0 12599.11744 4307.654305 PI(18:0_20:3) 0 2964397.873 1019540.593 389180.1027 3405243.426 1800983.033 1687384.919 377.0600237 3854035.819 1771183.914 3123310.637 3585869.262 3919178.407 1681028.772 4287579.233 3907931.364 662473.5196 4234597.062 443.377718 1253199.555 2425526.266 470957.0949 1288215.476 1880700.955 294.5118996 1336845.404 183265.0049 4666191.511 1362961.718 3103416.293 4082032.857 1919758.657 3545437.175 3045168.431 3932944.25 2283671.615 2274413.487 2205209.411 228.0844945 5164400.391 1887031.898 2108092.537 4818524.186 6097920.333 2279504.122 4920862.144 PI(18:0_22:4) 19.83464592 269033.4726 297252.4304 192889.7936 249619.2506 300126.5787 1129114.237 0 600899.1947 623180.7698 752545.7245 884157.1727 513848.6851 572586.8345 402051.5205 448749.5346 970290.6945 1011072.044 46.59956414 530723.9413 1179045.302 518039.0007 600417.9884 565771.2299 29.59957173 1207678.884 1032732.622 430967.3874 615858.3835 1926647.174 1472805.478 1556589.429 1244618.185 1138906.641 718545.1526 1597339.44 609051.2482 1322331.736 41.78207522 930423.4433 681457.6442 730891.3828 1619618.853 638858.9758 567364.9973 1493784.569 PI(18:0_18:2) 12.85672969 36701.37527 356339.6311 302602.3574 194709.9117 949022.7238 61651.9643 0 54651.72249 547956.3652 41402.84062 838241.8774 235110.0731 637342.9136 153071.5445 152668.0326 627544.8964 52518.3335 23.46537199 611605.9623 469116.1728 502547.2528 548659.0294 599289.4217 0 56519.77381 58139.34541 172391.9907 488843.4184 110920.3411 698354.9021 64101.43908 422575.5508 399029.6196 628490.1785 65235.4332 576284.0936 72867.69405 6.806500709 45455.09038 812932.6983 834946.0103 743207.5938 267154.6133 641112.8718 850599.6704 PI(18:0_20:1) 0 22256.56824 47990.95266 338524.4794 500199.2055 198206.688 38182.59921 0 51319.4732 76384.10644 28111.94149 472847.9048 449935.5113 182468.1881 294845.893 199139.5197 322332.5522 19377.69384 0 98421.85501 347390.9842 54058.39439 64760.21592 180978.4014 0 47227.21364 42556.31915 282532.6792 89606.4633 78711.22514 554214.8447 54331.72974 370965.6846 317530.6358 83782.76146 49360.25564 153185.7627 51386.77493 0 36057.93932 101242.8267 113372.4995 628298.7744 525692.5269 111681.3877 535625.4573 PI(18:0_18:1) 0 3086.875447 5736.445916 4647.261066 95679.14637 176880.9171 37168.47255 0 19511.67876 72949.3934 30273.11271 54985.15486 829916.8684 137076.164 447616.8221 498975.3575 95385.57254 24214.84619 0 64349.74711 419638.2901 34049.95002 24983.33064 142443.4482 0 13917.04954 53041.33314 528372.8064 84974.84159 25265.91958 128409.3199 16336.32623 381829.933 379789.0893 147437.9496 10136.13167 140618.9236 22595.43613 0 38238.82511 93208.82519 93098.59756 157470.5633 958822.7565 120931.1324 147814.946 Plasmanyl-PS(O-20:0/22:5) 0 0 0 0 0 47385.81129 12463.34496 0 58504.96307 70809.78063 80398.95917 8034.167803 20274.62999 92785.99233 35018.8553 20313.70099 27754.99048 86950.6246 0 61834.53091 170665.5396 114134.9263 115576.1477 78474.37394 0 22222.98425 89911.44308 23190.42066 58951.93141 38800.83479 32621.87888 30417.74415 223997.9536 158795.7387 66647.55849 27735.69275 85808.62862 36046.85079 0 77123.10687 52256.15491 80748.70238 23730.3885 27539.95848 84782.02521 32942.06406 Plasmanyl-PS(O-20:0/18:2) 0 227012.4631 27849.11191 14406.06407 534272.2379 42288.54339 187810.4475 0 218660.1925 41662.42888 256713.8414 13626.68971 538766.7932 44557.52446 567260.601 548321.3713 12528.17587 250068.4877 0 26777.83474 42208.93536 25490.05337 29538.67841 41690.25592 0 186321.1834 311007.0205 577545.3801 44159.36859 188947.316 15644.41454 198470.3624 62631.95017 57560.92547 42802.89432 219768.7064 40765.00597 26189.40936 0 281124.9352 48321.65109 39218.58086 15800.72614 756137.3013 45011.71188 22766.81098 Plasmanyl-PE(O-18:0/20:4) 0 92865.45157 62786.96245 0 6834.773419 35860.16405 46411.05906 0 114767.6767 16282.85076 92899.02261 0 14441.5464 31548.40611 19905.16792 25666.57107 3338.376021 95017.67046 0 27375.83122 27820.9188 76042.36232 101324.5248 30888.25435 0 30701.95527 62005.74225 26224.85334 11869.06961 65724.69608 7817.779471 51434.14107 34881.01924 37053.61736 5594.0568 31205.39185 17149.71364 78877.2175 0 106706.4188 43797.23072 101368.386 4113.914178 15951.98436 33455.44106 7963.195233 Plasmanyl-PS(O-20:0/17:0) 5904.461481 989615.9097 906520.7103 377873.3151 1223361.037 1436242.758 453579.9089 11519.13095 878617.5298 986309.7663 867426.6578 389628.7408 1238264.272 1003775.917 1106755.586 1059707.9 358262.7464 881510.5389 11547.20566 1101177.967 875929.1763 1028589.045 1070402.119 1071932.91 5223.702623 422287.2115 1007345.621 1159756.319 932657.5977 512203.8153 354728.6588 423524.3286 957093.7841 863211.0828 859125.16 473198.7955 1071819.243 458665.1726 13460.40553 787654.0825 1249707.587 1209900.297 337841.0498 1244901.069 1155947.95 357867.747 Plasmanyl-PS(O-20:0/22:3) 465.80451 287002.9624 210997.4376 0 53831.38675 135246.3763 132154.1426 0 239423.8684 139565.7363 230205.3755 0 32566.36504 184749.705 49081.64271 58636.05943 13689.84499 317373.8858 0 89666.95895 79396.7858 261511.7 306683.5295 141788.0062 0 104620.5226 327239.7205 41729.54598 176847.1668 145921.5145 6338.629891 99768.98203 157850.2823 185510.4112 156675.216 157035.4977 178368.3096 152902.5813 445.2322456 267336.1575 191115.8218 204944.0328 21204.40217 37594.16401 186869.214 21992.11384 Plasmanyl-PS(O-20:0/18:1) 0 552367.9375 628646.6427 315132.6269 678157.7396 560787.946 285530.2216 0 544625.5307 958792.0717 538211.6947 401101.5537 691416.1238 1060756.664 683002.5929 635087.9311 202331.464 559994.0851 0 842206.4926 1367568.362 767092.5797 782098.2397 1015864.05 0 253070.8245 659068.3851 736186.2411 968922.3169 313090.8146 357676.0457 246250.9226 1312596.617 1274677.056 1047561.258 253334.7764 1193095.636 291936.5732 0 528232.2411 991937.1204 976686.4996 403103.4801 873631.0304 1174230.823 445966.8797 Plasmanyl-PS(O-18:0/20:0) 0 2616459.473 2455993.064 940296.1668 3462374.171 2752912.867 1248073.435 1201.233006 2436734.91 3282494.032 2539671.588 1079483.606 3690964.33 3456464.972 2928212.485 2999677.554 966071.9358 2679034.068 1164.359759 3379413.309 2687028.715 2904995.972 3290556.253 3616507.488 796.8319667 1133128.842 3317787.3 3330828.861 3465970.724 1499263.053 883408.192 1227815.275 2797314.427 2694160.585 3398567.006 1272626.905 3675321.381 1313449.184 1442.080065 2539636.871 3923121.34 4195308.217 1015811.183 4330026.619 3332839.631 952517.3256 Plasmanyl-PS(O-20:0/20:3) 31.83306099 490952.8561 332026.3975 40053.55531 83816.15234 220223.4962 222508.556 0 442435.0902 156740.4987 477509.1415 35807.7099 106886.5093 207964.7547 116518.8502 115348.2355 57260.48787 528669.5732 20.6758561 333209.803 209055.2214 427651.6006 464157.3032 225906.1596 0 253395.4454 684110.5652 128540.222 157183.8092 335521.9136 20418.67055 301560.9982 217770.2855 210993.1318 149699.8101 290192.8771 220819.1082 284836.9825 0 548378.6426 434794.5374 435150.5893 26011.96382 131331.7375 245437.1357 45739.42024 Plasmanyl-PC(O-16:1/18:1) 590.625 150732.6565 233346.1248 94367.70802 215702.3843 362035.4894 112279.2406 224.0018731 211304.8997 293636.2216 190348.8807 146852.6515 191941.8385 303298.7045 200874.1842 224832.2226 90981.2858 199455.3128 0 282564.7663 440927.1346 274183.3323 253305.6391 363210.2578 0 66360.76781 220364.0192 198170.9281 307568.6861 47183.40819 116702.2638 73702.04007 455546.8755 419842.7306 279664.107 102193.3379 423037.697 90340.26201 1344.63665 193455.1811 265168.5554 310100.1769 85823.49705 177694.5373 312822.9434 135068.8487 Plasmanyl-PC(O-18:1/18:1) 0 45130.64315 106242.9845 43890.14815 150750.5954 125481.5938 32244.88638 0 84581.64973 128626.475 43601.98208 38843.9525 147150.3261 160913.1213 177042.9293 127890.5913 53093.8785 0 0 97569.77599 194606.8545 65460.02536 104083.2732 164679.4984 0 8917.112702 37360.79408 149674.8493 104560.9539 24063.97789 0 30925.46698 208276.4731 173790.2275 147773.8242 15735.79472 157610.6258 20171.88025 0 50934.85803 150137.4492 166320.4365 0 150510.9973 159007.1613 0 Plasmanyl-PC(O-16:0/20:1) 0 387702.6045 223148.3668 123322.5756 1045507.494 491721.0287 101908.2251 0 319068.5307 330357.089 374925.2047 109897.9014 1083842.47 381395.2727 866145.982 870923.44 80149.27982 354095.2877 0 353431.4084 394748.8883 242675.3822 250234.1386 404265.3066 0 94197.63218 496010.445 917185.6226 387639.4193 106965.1443 100202.6446 92350.22241 289771.1602 401137.6008 343951.3221 89790.00467 332974.424 90735.87866 0 325406.9911 333448.3742 387249.0872 108212.6864 1191899.164 343798.9481 119781.1148 Plasmanyl-PC(O-16:0/16:0) 1092.900989 136329.4314 162919.6606 157406.8739 116375.9313 285281.6337 45528.21542 673.0413275 127630.5668 141932.4031 103526.162 142274.6254 143686.5897 271609.1884 104921.4306 110589.2915 76820.31943 132873.6929 265.761238 378694.6173 85617.32522 283915.5533 313172.9468 202038.218 0 25613.6609 115046.2278 93671.03619 232349.5598 60425.75844 118391.1193 42233.39158 43915.31427 79628.43445 220187.208 50993.0036 234505.0702 29159.57723 0 118622.0624 315866.9229 291144.1542 74360.19438 118839.6407 207827.5348 169925.6234 Plasmanyl-PS(O-20:0/22:2) 0 70566.31353 53818.26251 7630.543387 76858.82464 95070.43328 8377.057356 0 80086.38117 73720.91281 65449.13592 22989.28727 56672.71677 107209.1033 50464.31564 66740.57502 24105.86256 81349.21062 0 93357.53995 203214.5037 74311.15471 78192.72579 131046.4111 0 8805.401182 87065.68456 58191.84066 132820.374 7447.484901 14446.55038 0 140996.2869 175310.2041 125361.7161 17241.96802 130471.975 10209.93046 0 85527.69198 107509.3087 97342.21035 42415.23491 67352.64782 186895.1632 20381.46586 Plasmanyl-PS(O-20:0/16:0) 0 35758.29831 75780.66695 11526.76509 24271.40838 77128.59053 24048.99687 0 38498.55309 75478.06228 66643.61444 22914.56951 42871.99877 96699.48572 51748.38558 38587.95248 19608.80787 45208.40721 0 35961.8154 13108.47113 43588.53981 0 87386.25667 0 32738.4526 59902.68472 62530.81543 60632.60655 40744.4073 13996.26936 14185.28239 26884.47409 34290.67934 77904.82025 27695.66922 53071.60611 25330.27686 0 38628.99733 61064.16052 63596.73931 15491.89187 61966.56335 102587.5819 19035.14973 Plasmenyl-PE(P-18:0/22:3) 0 0 0 0 9510.293595 77189.86632 15820.25803 760.9845969 13618.65796 115041.3808 28223.19961 27240.01674 13102.58233 90086.58552 4048.471865 10112.42821 53492.00462 15854.18372 0 36397.64313 81934.51106 33082.93097 31254.11851 96338.14698 261.6261288 6881.052446 24481.01875 14429.32838 140694.2279 38637.06612 57655.69135 20379.6851 103193.4616 71763.17268 186333.7175 46366.68412 131939.0503 18980.64467 0 15652.43517 21013.05363 61312.25711 58376.64339 19033.48872 94208.30551 60665.7165 Plasmenyl-PE(P-16:0/18:2) 0 430332.3913 224936.5024 188293.9458 3750919.971 987250.5575 226594.7238 0 321458.1215 1523659.841 401335.3705 798512.6516 3770143.589 1035595.382 2871787.182 1214424.713 38450.76399 338279.5799 49.24730858 279950.1604 631848.8563 272206.0338 354943.2481 1103213.659 0 289615.3448 565531.5291 3223249.09 1276978.406 389928.1172 410597.1315 301763.5532 777524.1833 706873.6996 1706237.691 277296.6066 1053565.274 271503.6391 0 309057.3382 518122.3522 722105.8827 506209.3343 4680128.698 1020238.322 507124.9186 Plasmenyl-PE(P-16:0/18:1) 1088.843954 2088826.003 3508864.216 4818299.749 4589803.083 10525924.89 1672335.808 908.252827 2209467.29 12560953.4 1954358.478 6081202.307 4115889.231 11519333.6 3356412.162 3785124.385 5452873.553 2068357.616 391.3206794 4449744.391 10514312.75 4130454.291 4253845.685 11539478.64 715.3491324 1667024.74 2547479.642 4004297.913 11685022.2 2529793.108 5796985.79 1831693.066 11640397.84 12014431.53 13642280.75 1763723.678 11852021.63 1766292.368 1284.60897 2023265.029 5681203.552 5556086.122 6015459.654 5180024.583 10252841.1 5860681.857 Plasmenyl-PE(P-16:0/20:5) 0 85619.78214 456589.9744 613894.8262 352681.9541 991427.9878 95868.25208 0 19277.30942 989249.6463 24379.80373 726404.1173 560674.3226 1025556.187 427550.6653 478589.8232 511741.4824 107670.4961 0 527698.822 298550.8487 415325.697 502530.8788 1010488.213 0 97725.41901 242743.5284 419693.8263 904484.243 182764.7684 565696.8709 120463.3861 304290.4371 329097.6859 941024.2012 112107.6548 975096.0834 134515.5971 0 142535.7039 726508.0059 910509.3297 608547.9553 502480.5349 1021053.666 672405.4767 Plasmenyl-PE(P-16:0/20:4) 499.8133493 3424493.827 1496099.634 4795920.842 2266768.459 3641433.807 4117879.896 299.475975 3356935.906 5778412.477 3282104.596 5654017.615 2325405.823 4923593.69 2015970.461 2147289.812 5001898.176 3591724.999 553.8766094 5315026.693 3300562.128 5191229.767 6066589.145 4634686.29 619.8045421 4109943.028 4733642.469 2367074.927 5581579.166 6153624.43 3965485.519 4486816.645 3529576.59 3417975.714 6082724.704 4775647.626 4690051.178 4821312.321 572.4579634 3326686.931 5858855.042 6743086.674 5321185.6 2850453.435 4639411.943 5095329.271 Plasmenyl-PE(P-18:1/22:5) 0 420146.6735 758624.7109 1022148.239 174184.3278 954916.1087 314555.5264 0 114215.7908 1607718.848 321306.0926 1304031.15 154377.4464 1167643.205 149096.4347 149425.8536 1007472.462 344983.8758 24.60228328 514984.8413 574066.6432 859947.9711 1032187.959 1217535.809 0 193380.7493 461530.5254 164200.8408 1507841.229 396487.5505 936047.7146 261441.0357 701784.2315 614404.9166 1758671.2 205537.3891 1170701.419 298724.8473 16.22886433 302037.9559 705764.8842 829039.986 1100916.635 197157.2827 1246706.195 1086548.991 Plasmenyl-PE(P-16:0/20:3) 0 272673.9915 163825.4485 603753.735 919780.3904 505438.4109 344273.7904 0 231888.1788 841592.3097 225845.9483 377494.4435 812006.3978 689736.6567 666306.1233 718447.2831 258380.6272 439787.3642 0 305787.3435 548565.9892 195451.835 249379.1977 618435.8763 0 364100.5654 385789.0937 760009.0189 733836.2177 306221.5404 267043.92 334009.4791 564796.4362 525704.6737 934481.3365 344223.8189 617791.3345 263532.8931 0 166564.8242 475100.6706 783034.6207 286226.3228 1091415.41 700780.9431 362490.4174 Plasmenyl-PE(P-18:1/18:1) 1093.037055 2058384.437 1446804.663 2403746.479 13786310.1 7674607.593 1052663.34 443.1335559 1718421.824 9291263.752 1845168.816 2821451.22 13383018.92 8324137.27 11653141.08 10828098.44 2327444.592 1841606.579 942.8593529 2109299.869 7778862.51 1655205.279 1779583.734 8487181.874 700.2072837 1141685.812 2493976.634 11434764.6 8046089.44 1638880.64 2526524.739 1171730.077 8507402.528 8063608.388 10101802.11 1197673.807 8458581.138 1335353.852 1583.427277 1617164.825 2521013.58 2658551.659 2716121.408 14064343.86 7513539.767 2744534.944 Plasmenyl-PE(P-16:0/20:1) 1332.165709 2398392.806 1316356.291 2520165.205 7576883.116 6021405.867 1229312.203 489.4257547 2219366.693 8125466.338 2486484.841 3017359.45 7971035.682 6541809.585 6124531.081 5892963.135 2487909.084 2206820.499 902.6129254 1904879.261 6856836.739 1542204.956 1604909.03 6409486.063 641.5217102 1291559.785 3233697.43 6480213.633 7222339.972 1765481.389 2397911.161 1156695.048 7334861.099 7074347.431 9019013.634 1139912.867 5979484.617 1398033.78 408.5302353 2117488.416 2367475.16 2486792.589 2480011.351 7972372.53 5848927.364 2605285.702 Plasmenyl-PE(P-20:0/16:0) 0 1450794.677 1445128.35 365693.0351 1835076.093 1316076.03 430330.7154 0 1339372.329 1704757.29 1267544.413 383314.53 1962142.24 1528751.521 1624252.039 1155195.914 519894.9186 938424.0755 0 1714771.095 968832.1004 1029422.855 1406561.051 1474595.877 0 543263.5233 1111178.58 1576083.092 1115055.024 435003.7494 95601.27367 495030.1938 979578.6715 1313558.873 994196.8301 282185.7836 1262434.277 368223.0954 0 794466.4173 1916985.88 1184411.836 163103.4174 1782256.955 1416468.27 91326.06935 Plasmenyl-PS(P-20:0/20:3) 0 167101.3605 145951.1251 12390.60595 57802.52918 67827.66865 112447.3568 0 177780.0112 77943.4456 177993.3699 27087.43622 32350.21157 84413.59383 56093.02863 52983.89057 28703.14031 183507.588 0 95316.38359 181851.4401 224253.2073 155465.2969 111894.8537 0 109517.522 226353.7004 80991.49037 60368.6083 128290.0279 33963.65308 119932.0366 279625.7585 189410.559 69599.12831 146834.4069 112718.466 131146.6756 0 205291.4901 107429.1248 94985.16254 38800.03604 60834.01723 120852.0764 40740.33443 Plasmenyl-PE(P-16:0/22:6) 15.28239583 421902.6361 2280705.365 2583578.066 281954.0087 1073013.917 451922.4741 45.77722317 318058.1749 2586918.065 351769.2581 2876590.981 197058.6161 1842745.435 183238.0821 162609.528 2058656.03 322807.7446 0 2319014.044 1296501.384 791495.8138 2582392.288 2037367.223 82.48419359 444976.9574 436924.3091 160732.9383 2165536.675 587687.9895 2045469.7 393051.3487 1635291.471 1592585.15 2465124.494 117581.6687 2002995.981 486848.4397 88.87974277 315382.7427 2683329.912 3003324.029 2151999.406 222324.2089 2046547.454 2368942.02 Plasmenyl-PE(P-18:1/20:5) 0 125689.8904 209559.2688 437027.1895 299262.6884 497786.818 135123.9802 0 141295.0944 728363.3364 147280.8926 435220.4985 272434.8533 721993.7207 242508.1128 318069.2316 364603.0175 119607.343 0 443071.3883 308527.8336 417042.8576 416818.5041 748339.0346 0 105946.2043 176061.4942 267825.8954 676611.0253 212924.936 406360.9121 139673.4015 379765.8558 280057.8366 772253.4689 125510.7566 750388.4483 144423.2507 15.884032 121354.5013 530051.6705 570323.0876 483945.4909 355180.8052 747857.5073 481810.0541 Plasmenyl-PE(P-18:1/20:4) 185.0529744 3059163.148 3948896.775 4915746.155 1651559.295 3736896.471 2888325.407 36.9596107 2724039.999 7106245.019 2820692.412 6937692.923 1669561.511 5013018.353 1558058.348 1439873.683 4094861.436 2963055.489 17.22478746 3520483.271 3242623.281 4394590.026 4732220.724 5003885.006 221.0771479 2711212.016 3706881.543 1706672.67 5971374.482 4013155.02 943332.2224 2987738.419 1436931.111 3562253.668 6993969.091 3016209.77 4765578.533 3331748.095 77.40823541 2597856.178 4422391.642 4727885.178 994932.5428 1043825.181 4788624.055 5082080.265 Plasmenyl-PE(P-16:0/22:2) 517.2490407 2036202.569 642534.8113 1870148.63 2407441.903 2852095.12 374999.5745 435.6930785 1636396.659 4341713.035 1977369.209 2014556.885 2516607.359 3171359.374 1893414.479 2054030.809 1750204.357 1669646.45 203.3630585 939879.6552 2726627.372 839941.2657 961254.4644 3204617.032 459.5141284 446476.9571 2616253.008 2195184.69 3800820.411 706411.3556 1552787.088 472932.0887 2894855.657 2925673.092 4339249.305 373166.4719 3005739.146 552221.8025 1220.729569 1562059.514 1188500.413 1264163.648 1600843.133 2782091.174 2767943.051 1699171.148 Plasmenyl-PE(P-16:0/22:1) 181.5779326 1752299.973 511160.5698 1661504.978 3372574.464 2011604.587 259599.1286 285.8646927 1508851.938 2585082.576 1781176.463 1989722.987 3186276.109 1931104.202 2549844.397 2601530.795 1650090.67 1530097.964 226.7452031 812494.9667 2147157.23 641965.1393 734620.6467 2113365.177 0 316098.9251 2381824.796 2944997.716 2146235.275 529208.8131 1479231.529 293901.3554 2136847.592 1855665.483 2902143.465 277276.9983 1919258.255 410312.9389 117.1778193 1307987.08 1121240.179 1168183.664 1765457.077 4027783.487 1963448.6 1561908.521 Plasmenyl-PE(P-18:1/22:6) 0 131235.4096 905678.7975 984541.7564 44204.03852 1143110.206 145599.2642 0 121994.8905 1347475.112 122311.7485 1081175.124 60577.98509 1287831.364 68535.21047 68793.29222 793786.401 114104.4247 10.73261514 519656.9797 911337.9354 791313.7677 1051580.559 1203776.262 0 150895.1951 154447.3533 69176.94669 1476546.442 236646.7538 805961.7759 163817.5897 1083317.071 1002317.134 1498531.179 164531.2842 1208131.789 182266.1023 0 104464.5019 668934.3412 780210.6073 891004.8667 62757.06251 1150368.734 928258.2895 Plasmenyl-PE(P-18:0/22:5) 361.6727285 2804316.336 1715351.454 2352679.898 1541681.321 1852845.963 2951779.468 0 2532815.751 2297475 2597448.919 2691206.496 1629890.489 1890411.548 1127778.292 1307069.322 2322828.059 2433799.744 0 1920608.71 1689170.471 1678722.47 2009774.473 1975691.876 0 2468871.748 3393792.799 1444973.855 1965485.159 3887778.997 2516601.248 3068274.198 1993271.356 1703033.371 2176300.568 3169478.385 1889855.858 3221897.766 0 2412794.393 2254131.17 2316145.186 2530278.93 1642503.636 1646426.009 2762383.822 Plasmenyl-PE(P-18:0/22:6) 725.7087368 635585.4882 1608548.557 1401823.589 597197.9918 1673422.978 561362.0958 591.4839854 495319.8828 2554847.646 614875.952 1488447.785 538883.0291 2031328.501 425661.1299 461738.5778 1372253.745 510198.2624 0 1729100.362 2346433.418 1938888.534 2036511.016 2042047.879 531.6080823 605199.3963 742361.559 477878.9522 2273155.356 871590.0081 1609149.156 620150.9168 2677780.758 2303542.302 2490534.963 590267.7675 2241167.69 586370.1212 997.9387267 467752.0471 1983486.158 2132853.247 1654022.552 618943.9773 1983225.483 1679369.992 Plasmenyl-PE(P-18:1/22:4) 0 3485065.631 1650056.765 1730823.765 622102.8668 1540929.001 3335344.261 0 3053598.844 2000396.935 2644167.077 2121319.334 530182.8333 1636263.236 574804.9642 518816.1429 1954943.347 3339055.578 346.7965929 1351485.06 1618073.37 1886156.138 2123169.472 1475179.165 0 3334103.886 3757738.537 671144.3146 1593294.521 4298090.588 1738770.974 3570669.95 1579408.731 1237162.639 1907825.249 3137147.529 1541412.304 3989703.735 770.2354593 2969162.157 1473182.699 1618558.164 1983094.581 693042.2507 1586784.672 1787939.256 Plasmenyl-PE(P-18:1/22:1) 382.1593244 1335281.366 346974.2618 1004136.227 1431758.23 1410625.576 250175.0688 135.8430656 1087268.195 1860532.481 1287922.765 1212510.067 1470052.391 1393417.063 1236496.815 1181048.842 1050185.488 1153696.44 0 418906.9554 1453991.571 430711.7614 405057.5005 1433722.761 366.0415707 306064.1842 1851948.053 1317589.513 1563288.274 531719.6811 907331.4995 258786.8405 1467927.562 1257203.233 2184599.117 240439.186 1453400.808 306092.9007 497.5484497 1000096.956 567839.9021 620945.5942 1095620.974 1827351.716 1353912.353 925083.5309 Plasmenyl-PS(P-18:0/22:0) 0 1104310.104 461743.5781 239675.8982 2531333.264 883893.5794 330527.4673 67.45371668 895587.3515 1123705.833 1090876.043 126520.2019 2723263.377 1182575.851 2218432.486 2249942.899 200136.9973 882650.7337 0 774518.3783 940966.2426 659988.7241 710314.0697 1130228.335 0 301393.6185 1204980.349 2346219.525 1116485.659 431195.5784 119509.5383 338316.4629 882646.1017 968480.8203 1268209.428 321091.1728 1146376.72 341355.4403 310.3215529 849141.0508 913144.2625 906579.5408 202090.0647 2305585.291 1091560.709 125133.578 Plasmenyl-PE(P-20:0/22:6) 538.1801202 399057.4216 226803.5833 474331.6916 78905.14357 259285.8465 582170.7445 130.7758146 198900.9097 275287.2 226128.3375 491856.483 75385.10518 244661.8002 108431.7103 148555.7816 426996.7558 414174.8988 0 202775.3799 168265.0449 224574.3621 217023.3087 208862.6058 0 694328.9258 52929.6024 109932.4802 201838.9811 1047576.763 656174.7919 560939.672 237925.7439 308054.3803 262291.4044 632704.4704 264120.5413 857166.7331 0 363031.0614 385803.1721 265842.8943 421921.7666 125438.5165 180027.7751 630710.2366 Plasmenyl-PS(P-20:0/24:1) 0 270336.0783 129164.1874 40774.20121 89346.18199 138048.6201 77414.28834 0 247635.4382 142469.5269 199774.819 97259.85982 115158.1975 190106.8066 104715.9893 107359.6705 72841.33537 204861.0534 0 161905.0567 147377.7757 211939.6494 201795.6147 181452.2186 0 92252.4709 301660.7545 99835.92852 140357.8565 129583.8162 98745.44731 93323.64573 171814.9389 152896.4515 84485.992 111086.971 189005.5654 121379.9177 0 283232.0346 205641.1621 201262.189 79625.38879 139741.597 235472.7096 89516.98512 Plasmenyl-PS(P-20:0/20:1) 0 176506.3525 334764.451 184863.8108 445845.2009 514584.7014 115842.8431 0 351707.144 705942.371 356951.7329 180603.7811 465240.9386 733377.8378 355118.9889 390661.6192 141268.1769 354930.5618 0 483582.1149 879769.2831 444413.5059 440042.2126 710528.4767 0 117027.8452 493907.5356 373442.1312 685289.3838 125104.7663 168142.0938 108792.0235 784819.7099 912516.5331 701497.124 108101.0219 777368.8574 121577.723 0 329571.346 537533.758 528071.9231 166825.8637 460081.8489 637627.6773 181398.1893 Plasmenyl-PE(P-20:1/18:1) 0 221302.9138 170544.2637 20103.96082 288926.6404 317566.3474 99023.33311 0 236374.4661 310627.3127 243419.0508 69348.20061 251031.1308 392351.8871 220289.8009 250557.4957 21188.99305 136001.0506 546.7475039 162778.739 455478.5968 65349.80794 221447.604 302482.9982 0 91792.19338 247618.7929 279954.3042 219445.3114 86308.25963 25209.81555 54297.9311 494747.6965 424423.2622 214903.3663 37600.21693 371189.0177 65125.46119 255.1745038 148810.9345 244006.4008 104665.7579 26870.38179 373495.6426 194781.6399 88326.79124 Plasmenyl-LPE(P-18:1) 0 26214.59975 25769.03085 36631.54086 12490.25016 41948.38321 42294.99321 0 23166.91357 70179.87917 22267.62773 42658.86098 11699.28482 44682.52985 25146.01863 24804.98097 119029.4988 29322.64017 0 44617.65712 113323.955 133586.366 42697.91492 53775.11634 0 34289.27962 30460.1067 16614.81154 67435.45347 41329.12323 46163.39489 31963.6639 216879.5852 189390.5299 104302.8933 23265.32918 50779.47933 38366.49971 0 25874.34841 66786.54525 63409.23781 70851.75701 16883.76929 68085.55711 156339.7533 Plasmenyl-PE(P-18:1/17:1) 0 37776.44602 8953.000941 1655.167633 249403.0473 29403.23047 20801.19939 0 27894.99841 36015.94706 28855.87721 22474.40416 249225.5518 46361.42069 202694.69 212144.9384 19640.11587 30172.34926 0 13267.29062 42698.78593 11513.23693 11624.85401 36106.46768 0 14557.63424 36712.93092 268404.4696 30618.59336 49008.0475 14386.93356 39201.85218 35248.77422 30461.16879 35683.19462 25932.31691 40553.06883 15563.08724 0 29053.78738 22864.0904 29109.7737 21724.96705 370240.4098 41142.92887 15959.87275 Plasmenyl-PE(P-18:1/17:0) 140.3339272 161173.4912 146765.6066 232961.7836 519628.0052 438010.2098 105599.0065 0 134890.1807 566767.3528 140279.055 286445.504 513262.7022 523522.3654 441147.4222 188081.7756 231375.9712 161088.4613 0 243883.5164 511318.7985 215175.2654 218413.174 532084.2327 0 130517.3974 198868.4117 473879.0191 493622.1606 182772.0423 246057.0604 136099.3045 566510.6608 558311.1848 646567.3982 151397.8627 586898.1606 139499.9265 0 147514.0357 294838.0317 311032.8253 292400.2438 580027.2565 492754.7514 250315.2497 Plasmenyl-PE(P-18:0/18:1) 0 223709.7083 319376.6535 177839.1304 342745.62 472640.9561 110463.1431 0 279678.8659 494849.334 211960.8876 152972.5454 377246.3624 607055.5582 364799.1128 280416.3663 113363.7224 180682.6751 0 315510.6429 621772.787 345856.8888 393431.9181 457951.5747 0 132943.5267 356415.4471 263814.3761 347382.1292 72967.92856 178877.417 115681.7145 636563.4478 724607.7013 488196.1581 71007.83141 404332.6599 105022.3345 0 210509.7228 404005.8092 347049.0319 136452.0272 343439.5248 349023.5437 154644.6723 Plasmenyl-PE(P-20:0/18:1) 0 508464.6177 231055.3852 22458.32097 885015.9863 501855.5701 99815.52052 0 303556.848 296584.6424 344643.843 0 995268.7339 352352.158 558406.5492 602982.4838 15336.27696 354112.4611 0 305985.2655 99002.61973 216745.272 199107.2509 446031.9419 0 82275.18296 515219.5618 1057515.919 187234.0742 123498.9732 6736.551797 64901.34352 290846.3646 354448.8822 232064.7655 88815.59578 304545.5611 118072.0186 273.6652767 412310.3181 395298.879 289028.6303 11808.16215 626139.0508 253447.1999 21051.3351 Plasmenyl-PC(P-16:1/21:0) 0 210833.4946 220846.119 142449.679 455360.4309 322640.1155 73145.49888 0 219455.8757 473322.2342 255411.7124 155149.9959 435096.0105 509354.0897 403871.2386 385237.3646 93083.46011 237655.5877 0 305536.8418 607902.0843 233668.0155 293177.4774 515693.0045 0 51537.46551 241977.478 431811.838 421084.183 78154.22734 92806.94528 39673.94765 631583.3682 584925.3894 516628.0638 64391.3395 511973.1916 45189.3499 0 202493.9383 385197.5442 417099.1941 141998.2317 547128.5942 452543.5531 133670.4475 Plasmenyl-LPE(P-16:0) 0 68572.32197 67226.80633 114761.2993 41718.42613 85992.92493 104296.1559 0 74910.97924 122852.6625 62350.39211 169302.3696 43484.04071 93833.03856 59064.07992 76050.99873 347927.3238 59698.94979 0 249975.7459 291715.532 331389.0751 99035.41822 95702.86955 0 85143.24892 99091.15811 70041.84279 89449.3365 112812.6038 180393.7144 75765.88068 302498.2751 284947.7331 138384.7408 88563.76614 110972.813 78653.58404 0 76821.97377 487490.2747 261704.3101 212600.9817 61359.55823 111088.2614 363136.0165 Plasmenyl-PS(P-20:0/26:0) 0 0 19948.8697 10468.11767 83855.31374 113023.7978 13765.52326 0 91332.0802 132715.5648 77717.16258 93805.96698 61807.64289 131228.3506 48100.70202 46421.4616 55145.80278 89872.44551 0 74545.46753 173504.22 58868.38445 70689.25227 152205.7921 0 41369.96643 128235.5747 54198.36053 181214.6233 66550.25281 71848.10744 35611.64891 130890.6595 135166.093 216551.1977 19808.00832 161809.5853 17261.28381 0 90611.04029 77481.91563 90374.39209 57663.90097 81883.63364 170122.7653 65133.36207 Plasmenyl-PE(P-18:0/20:3) 0 321892.0095 485798.6209 125512.1769 712605.5672 1663041.465 180431.0017 0 337625.0775 3258685.416 282141.3623 618952.5965 459425.8519 1940040.313 436412.5351 655946.3926 540060.6836 248336.6309 513.9703106 734363.183 1370257.941 579001.2181 609724.1869 2019038.528 0 188879.6133 375543.0627 424388.1311 2538413.309 264854.6332 517049.9121 174662.8088 1411190.978 1536712.411 3229086.967 203147.1922 1908422.383 277269.3292 0 202288.5881 834558.9754 892752.2051 549118.6749 523927.6876 1829413.123 479566.2298 Plasmenyl-PS(P-20:1/22:5) 0 103173.6647 63468.73214 36538.59106 36062.38904 30954.66023 233231.4598 0 214526.6215 57270.26878 236829.3149 86320.95323 94463.80813 41899.33351 108536.0793 109948.0675 67402.43505 280232.2681 0 69479.65399 50262.03795 82660.81227 76438.39379 49683.26434 0 237599.4329 313131.7915 86172.44751 45786.80272 181403.7372 42193.73761 267248.6001 55044.16009 68729.51904 65364.04339 240594.8712 67637.69001 279912.6142 324.7818959 323058.3737 74291.53203 78202.46771 73506.99024 118263.3555 58499.12058 63480.32215 Plasmenyl-PE(P-16:0/16:1) 0 34624.77495 129835.3187 237905.1208 122505.7434 434540.9583 30486.41486 0 39566.12499 399754.162 40621.15321 335494.3625 144785.8995 469120.2962 127410.0951 127200.5796 229044.6651 40356.27192 0 154666.4946 272847.0328 139734.1008 160342.5487 462065.1989 0 35923.17762 50713.48382 145573.2904 456859.4809 43456.54727 309560.392 32414.95602 308335.4756 269214.6339 507626.9576 32298.61126 464336.7649 44574.33586 0 34590.84867 196051.2453 262405.167 312079.1021 118582.906 478350.0947 352227.6841 Plasmenyl-PE(P-20:1/22:3) 0 0 0 0 0 311873.2741 244585.2958 600.2735297 514677.4966 487386.15 601060.4064 177241.224 226742.7196 363963.132 167372.012 184093.6225 315275.0848 554742.6761 0 177880.8019 317263.3878 213460.2528 188270.2911 389243.7705 0 445707.51 913425.3999 193292.5394 396201.4244 600396.315 351131.6278 409006.0037 378152.3158 304334.956 552616.8219 308528.3403 406748.7503 558668.1003 0 471384.5951 188012.2819 246076.8394 419385.0088 278133.3048 331797.2971 365521.9322 Plasmenyl-PE(P-16:0/16:0) 0 93967.51093 202048.1705 282679.8507 38720.80246 258038.3688 58858.43025 0 107578.7731 310343.8865 110539.9378 293228.3034 78687.13928 380208.0952 65294.31023 51206.96186 278319.7217 54383.83401 0 126574.0282 174592.3552 227239.5968 281816.6023 367200.8611 0 43990.30505 143237.2079 58237.2468 166266.772 102411.2749 375310.3095 63521.20481 272052.0102 184214.9001 320520.4663 44079.52914 288086.3924 47470.66898 0 113284.6119 246401.0709 263208.4713 350547.6394 87225.28537 355681.6274 274377.0885 Plasmenyl-PE(P-18:0/16:0) 0 236010.9901 144502.0948 314847.5659 112205.9295 236546.6141 150564.091 0 274288.9221 293735.69 283930.4934 427663.7339 184463.9283 221961.1891 206477.674 211477.3449 291335.0012 282802.8021 0 176168.0684 209139.7406 196467.5546 177519.365 249266.9767 0 232658.3408 391103.5049 160861.8843 265656.4573 282955.4021 353439.8532 137239.6325 361367.6859 213684.7032 280193.1552 177673.3443 220150.3071 237885.1696 0 257963.8851 170849.1912 242000.6667 376642.6986 193189.5203 205048.2609 301703.7065 Plasmenyl-PE(P-18:1/20:3) 0 188860.1562 103874.6492 101258.3644 223803.0366 270338.877 187336.8993 0 210253.914 354973.8492 126733.9121 221045.5994 207603.738 247803.076 185002.2663 179928.632 146790.6365 129841.4797 0 286206.3248 378107.6145 187746.0977 166856.5083 170498.7849 0 129457.7536 255397.8496 201762.4811 298402.7695 260782.8062 187085.187 233155.703 266358.2753 320771.7619 409128.5779 175719.2531 249279.9392 173124.2528 0 211230.3701 244430.2776 236283.7999 176131.5461 302096.7959 244754.4911 147426.9611 Plasmenyl-PE(P-20:1/20:5) 8.78698209 62014.44385 147221.3504 336230.3473 42910.83545 129070.519 100082.7733 0 54662.36323 187263.9706 67647.9809 392075.6248 35754.10077 183712.7991 37272.84024 33466.39259 291977.4707 57529.15715 0 219000.4374 103523.3939 172851.1318 185271.5632 198349.297 0 93788.19937 99677.05423 36438.66692 197982.583 169284.1241 376641.8943 91888.58933 136289.352 126773.7442 163135.3393 118832.543 177973.5106 149195.8095 0 62300.88069 298422.8292 335285.0942 363967.2723 83798.66576 223927.0212 403742.9103 PS(16:0_20:1) 3234.177497 6704267.185 2730953.796 5353114.205 2598621.041 7363004.606 4149179.497 5621.539271 4648894.074 6508467.039 5068836.498 5933381.582 3564426.486 5696762.925 2457206.665 2822917.13 4583400.92 5092600.801 4719.937349 7966094.89 1181405.476 6685132.958 5954712.59 7174092.501 5716.487067 4499583.834 8225836.632 2767547.389 5817647.759 7853038.361 4676709.722 5021163.674 5649408.866 423056.0009 8132084.207 4854683.582 6565241.417 680263.7362 8804.255391 4172876.066 8115682.282 10591630.31 5234694.131 4348482.694 5857211.261 4851849.122 PS(18:0_22:4) 0 828752.8976 236595.4941 203441.4151 141314.4403 97244.66741 1039439.675 39.37762315 886524.1986 235830.0372 982894.4956 787035.6411 173518.3743 205838.3902 122045.5345 150635.1644 508371.8694 996930.3474 0 407197.4474 176037.8487 340793.3887 283033.8749 229327.375 34.95811336 861714.546 1332086.408 149416.9403 197237.1766 1908906.763 461893.0323 1259021.201 233226.0547 179364.8546 252976.7342 993296.8272 237556.1588 1208096.816 86.50518076 873369.9714 527105.3008 526748.6495 546988.8529 203031.9516 220018.3058 612733.4858 PS(18:0_20:3) 15.61984946 50515.97014 156464.9891 383808.012 166686.2758 194333.8536 218127.2888 26.40730502 267609.3404 194513.4221 199004.9555 373238.0775 116244.4674 181797.2985 75772.80032 81515.40755 176977.0055 136713.4085 0 177577.693 92225.31185 166348.4116 171552.5049 132577.8272 0 141275.5312 205049.9409 56549.77139 88961.05341 201523.1421 138058.894 141764.2604 83215.8912 70006.60826 124787.8842 128665.523 125121.8273 169780.3215 6.354575741 103100.5171 181539.8125 183278.899 123632.4034 82670.11125 99467.42554 149745.3509 PS(18:1_24:1) 1560.096935 50553.66163 225511.3395 379326.9577 159391.5866 509434.0987 30666.29168 1065.920329 156629.6717 778697.7745 104204.5281 584039.4875 231820.4585 711633.6418 198114.6271 175837.1573 468696.0179 290664.439 0 477934.7309 427876.4261 608694.0155 399486.4211 777195.6118 354.2819022 57781.98562 226375.7709 172440.2494 568131.9145 80306.92745 657420.5669 38120.5131 369232.0923 163437.0433 839083.8188 30229.85769 728205.832 59936.1452 789.0637473 88659.41312 619072.545 545504.5491 728815.054 237014.4075 683123.1581 588360.3918 PS(18:1_22:1) 1648.861992 427930.7173 277661.3641 278813.126 312981.8276 1111281.132 273786.3374 533.4752676 408366.702 1338761.979 156838.1051 920574.6515 440520.4989 1021307.525 281437.7456 309235.117 668171.6442 393673.1651 400.2808782 730482.5692 662482.8662 616533.4128 691305.0765 1031878.305 1258.321396 215736.4005 725061.4437 298877.2249 819907.0699 548798.6862 728611.6055 287482.534 762254.6044 639243.4862 1253994.207 280869.7969 999114.5891 345177.4169 0 234382.7721 900472.4237 899552.5452 780166.9684 463321.2061 899272.9607 708316.3431 PS(18:2_24:1) 2545.934778 131861.4678 114469.9008 220254.4091 109338.0026 197745.8899 85147.04801 580.7496685 108295.3468 272244.0967 94031.74779 260683.8978 114196.9832 190028.6164 125208.668 108732.1694 206069.0256 128856.4651 887.7336046 176776.2403 112894.2752 193419.4496 170822.0163 197501.4035 212.0816725 105056.8104 183181.4736 110179.949 207310.8459 199930.4902 214398.4949 99799.8458 113590.8119 123520.1619 262341.9132 110714.8859 254473.4455 112624.0045 458.8637454 55604.10023 194932.6661 228032.3303 258986.917 135145.7472 177396.079 199971.1792 SM(d16:0/18:1) 0 176093.581 156872.6819 0 285176.9974 241135.9957 148506.1344 44.11795007 212012.3412 242566.6607 224466.6949 245153.396 206413.7048 288988.1996 158361.5523 244575.037 229784.0652 197725.6635 17.71403911 223979.142 351531.954 281501.3738 290862.2565 293011.6078 16.57501173 168491.8949 308536.6632 193462.7747 257342.3084 220762.8816 252082.9926 191330.4755 320026.4308 296239.2041 298954.2948 196905.3372 325149.0304 195606.6642 62.3051518 235268.8007 224026.2326 226001.5801 300468.7245 139456.2485 364339.9899 289097.366 SM(d17:1/18:0) 2424.36585 2363337.79 2066647.459 2901971.362 2973402.136 2406753.689 2177207.856 3161.963951 2367445.612 3903786.132 2525608.651 3289429.401 3338739.747 3345557.492 3003086.564 3067832.964 2827980.431 2434423.35 4088.126474 2599317.78 3132392.438 2826178.562 3024855.622 3537452.026 4167.93692 2266826.88 3216643.441 3473447.597 3974934.878 3030957.438 2996125.829 2452184.166 3322103.435 3218579.906 4169365.817 2633969.16 3586237.197 2655877.363 6309.289739 2504128.657 3010602.083 3251083.739 3260753.443 4083312.627 3706164.785 3214370.023 SM(d17:1/24:1) 41.871593 124939.2861 167273.3886 58503.93739 0 109819.4932 0 0 5064.010409 58826.73651 60579.34757 60519.77039 24955.99073 167009.5226 0 0 0 0 0 123537.8659 62983.89042 79141.4651 90893.72292 88538.15119 163.0552572 0 72208.40636 0 0 0 26667.99455 0 105779.827 66612.24587 86986.12174 0 87858.04048 0 0 104623.4146 81834.61345 86719.3155 0 0 99170.77082 0 SM(d18:0/16:1) 980.8136469 593448.5488 570335.079 612687.4147 724226.694 752095.388 418456.4004 164.1020184 507166.5929 770228.6624 550858.0742 593556.8521 557108.0609 626579.7121 544553.2978 557131.466 553416.3983 485268.9028 302.308492 505082.1878 644619.9434 623773.1809 658302.1861 711531.3295 428.1303959 532172.1969 804844.2213 768440.2734 831775.3802 593679.6239 606781.3088 515458.9895 611152.1426 740656.8838 845543.5958 580991.9676 710040.9136 579937.3293 295.3770761 591930.1748 638339.8685 536313.1295 674932.6758 907587.6876 804057.5757 630913.0044 SM(d18:1/24:0) 2523.729675 1389497.197 1160876.165 534108.6996 837942.7274 1967190.056 617063.983 892.1790827 1228622.994 1428201.776 1436012.323 584762.2206 760266.8119 1466393.047 581165.1531 713932.8358 443903.7146 1311612.751 1119.584443 1434264.739 1669124.949 1366224.88 1482011.358 1565702.507 730.8819229 479394.4424 1834980.28 805195.4328 1569746.726 760833.6427 552981.7053 586478.9432 1849428.43 1583505.597 1643225.581 635645.3583 1630772.425 644603.8316 879.0776628 1386197.174 1578758.935 1614432.302 445553.8093 896299.3518 1622705.659 554518.4371 SM(d22:0/18:1) 4992.157066 502501.3364 184411.1936 126621.0983 242501.9429 349395.5862 277499.496 1394.213123 509793.54 344099.8453 365604.0858 147118.1682 322544.5243 395040.5361 267980.5197 243249.3931 124243.0816 373617.7463 1116.827349 418532.0448 500525.9994 323265.6 370823.9483 281850.9182 4090.443175 215465.2143 453535.1868 264624.2492 333808.0509 320175.8798 279950.7991 329963.8305 383286.0067 510251.9123 354989.5156 331496.9477 340081.4598 314192.9339 1337.949265 398223.5513 334615.4189 380574.9325 176515.2896 348169.9928 407736.5161 259330.5281 SM(d22:1/22:1) 0 101682.1356 211197.3704 47920.16104 71359.97424 172313.2174 46499.37654 0 98136.24065 229318.1975 190542.2739 15301.09097 41668.41379 264105.5934 56122.01554 37168.35918 59102.26148 107304.7396 0 196956.8116 185180.8691 192912.9222 232844.0483 196605.7839 0 35106.702 216705.7229 68010.97774 211939.9456 68105.41126 69994.13322 57916.72896 154975.9224 200236.122 231866.9021 44298.5346 236103.5859 56015.71791 44.46970136 162875.3617 194647.6218 212157.4283 90703.05866 55298.20704 307202.9864 70500.4514 SM(d25:0/18:1) 8500.04823 37034.44705 613753.9105 45033.1985 507160.0391 2518947.798 993562.4737 5705.193767 2139687.89 2403391.839 2663519.873 416810.3219 1280147.098 3157699.462 1215807.213 1315334.458 767449.2797 2458286.415 7326.984632 2761740.574 3166385.941 2581456.314 2742250.584 3139792.845 5475.668914 954100.3387 3419617.804 1441827.551 3045777.06 1227976.61 930195.248 1012932.772 3496704.421 3261650.779 3347024.932 1065295.828 3241834.98 1154911.054 6182.393388 2683920.734 2979812.125 3555740.722 986615.3188 1611175.367 3342510.446 827012.4083 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name quantitated m/z retention time ID_Ranked Intensity_Ranked Class_At_Max_Intensity Adduct_At_Max_Intensity Only_One_Class Cer-EODS(d18:0/12:1-O-16:0) 734.6648657 16.10201838 1_Cer-EODS(d18:0/12:1-O-16:0)-H | 1_Cer-EODS(d17:0/13:1-O-16:0)-H 198.79073 | 125.30264 Cer-EODS [M-H]- Yes Cer-NDS(d18:0/16:0) 584.5242623 14.04894134 1_Cer-NDS(d18:0/16:0)+HCO2 11884.47928 Cer-NDS [M+HCO2]- Yes Cer-NDS(d18:0/22:0) 668.6167841 15.85255212 1_Cer-NDS(d18:0/22:0)+HCO2 | 1_Cer-NDS(d16:0/24:0)+HCO2 941.158091 | 877.255804 Cer-NDS [M+HCO2]- Yes Cer-NS(d18:1/24:1) 692.6180213 15.66677201 1_Cer-NS(d18:1/24:1)+HCO2 | 1_Cer-NS(d20:2/22:0)+HCO2 | 1_Cer-NS(d16:1/26:1)+HCO2 | 1_Cer-NS(d27:2/15:0)+HCO2 | 1_Cer-NS(d18:2/24:0)+HCO2 | 1_Cer-NS(d19:2/23:0)+HCO2 | 1_Cer-NDS(d18:0/24:2)+HCO2 32047.4101 | 20507.5691 | 18392.46882 | 18254.80222 | 18227.33251 | 18086.849954 | 15752.79397 Cer-NS [M+HCO2]- No Cer-NS(d18:1/16:0) 582.5087571 13.32092967 1_Cer-NS(d18:1/16:0)+HCO2 | 1_Cer-NS(d19:1/15:0)+HCO2 11677.545 | 6670.2424 Cer-NS [M+HCO2]- Yes Cer-NS(d18:1/22:0) 620.5967802 15.69416303 1_Cer-NS(d18:1/22:0)-H | 1_Cer-NDS(d16:0/24:1)-H | 1_Cer-NS(d16:1/24:0)-H | 1_Cer-NS(d17:1/23:0)-H | 1_Cer-NS(d25:1/15:0)-H | 1_Cer-NS(d27:1/13:0)-H | 1_Cer-NDS(d18:0/22:1)-H 35649.549 | 22987.94602 | 21049.6351 | 15811.07747 | 15605.3369 | 15254.8685 | 12315.79386 Cer-NS [M-H]- No Cer-NS(d18:1/24:0) 648.628169 16.13729675 1_Cer-NS(d18:1/24:0)-H | 1_Cer-NS(d26:1/16:0)-H | 1_Cer-NS(d27:1/15:0)-H | 1_Cer-NS(d20:1/22:0)-H | 1_Cer-NS(d19:1/23:0)-H | 1_Cer-NDS(d18:0/24:1)-H | 1_Cer-NDS(d26:0/16:1)-H 84276.599 | 44084.571338 | 31042.76173 | 30169.80365 | 30024.450882 | 24048.1254 | 23314.28627 Cer-NS [M-H]- No Cer-NS(d18:2/24:1) 690.6023 15.23307286 1_Cer-NS(d18:2/24:1)+HCO2 | 1_Cer-NS(d16:1/26:2)+HCO2 | 1_Cer-NS(d18:1/24:2)+HCO2 | 1_Cer-NS(d20:3/22:0)+HCO2 | 1_Cer-NS(d20:2/22:1)+HCO2 | 1_Cer-NS(d27:3/15:0)+HCO2 | 1_Cer-NS(d19:3/23:0)+HCO2 20623.8518 | 17509.398314 | 13992.5938 | 13863.9941 | 12523.346 | 12458.962236 | 12354.73215 Cer-NS [M+HCO2]- Yes Cer-NS(d19:2/24:1) 704.617958 15.23056883 1_Cer-NS(d19:2/24:1)+HCO2 | 1_Cer-NS(d17:1/26:2)+HCO2 | 1_Cer-NS(d19:1/24:2)+HCO2 | 1_Cer-NS(d21:3/22:0)+HCO2 | 1_Cer-NS(d20:3/23:0)+HCO2 | 1_Cer-NS(d28:3/15:0)+HCO2 | 1_Cer-NS(d21:2/22:1)+HCO2 | 1_Cer-NS(d28:2/15:1)+HCO2 | 1_Cer-NS(d19:3/24:0)+HCO2 29034.62812 | 18270.26553 | 6330.00462 | 3834.78612 | 2747.897917 | 951.267067 | 684.06512 | 661.99042 | 245.6457 Cer-NS [M+HCO2]- Yes Cer-NS(d20:1/24:0) 722.6647264 16.32221321 1_Cer-NS(d20:1/24:0)+HCO2 | 1_Cer-NS(d19:1/25:0)+HCO2 | 1_Cer-NDS(d20:0/24:1)+HCO2 5821.67343 | 5219.949 | 3065.678262 Cer-NS [M+HCO2]- No Cer-NS(d18:2/16:0) 580.492826 10.54070263 1_Cer-NS(d18:2/16:0)+HCO2 1855.21126 Cer-NS [M+HCO2]- Yes Cer-NS(d19:1/25:1) 720.6489785 15.89078355 1_Cer-NS(d19:1/25:1)+HCO2 | 1_Cer-NS(d18:1/26:1)+HCO2 | 1_Cer-NS(d28:2/16:0)+HCO2 | 1_Cer-NS(d21:2/23:0)+HCO2 | 1_Cer-NS(d20:1/24:1)+HCO2 | 1_Cer-NS(d20:2/24:0)+HCO2 | 1_Cer-NS(d29:2/15:0)+HCO2 | 1_Cer-NS(d22:2/22:0)+HCO2 6333.2473 | 3445.4367 | 1520.40613 | 1392.2672 | 1336.9256 | 1325.2358 | 874.63907 | 740.4754 Cer-NS [M+HCO2]- Yes Cer-NS(d18:1/14:0) 554.4772333 10.1039658 1_Cer-NS(d18:1/14:0)+HCO2 | 1_Cer-NS(d16:1/16:0)+HCO2 1130.10725 | 1033.19409 Cer-NS [M+HCO2]- Yes Cer-NS(d18:1/18:0) 610.5395936 14.55734545 1_Cer-NS(d18:1/18:0)+HCO2 | 1_Cer-NS(d16:1/20:0)+HCO2 2276.27984 | 1584.149116 Cer-NS [M+HCO2]- Yes CL(16:0_18:0_18:0_18:1) 716.5223374 13.84042581 1_CL(16:0_18:0_18:0_18:1)-2H | 1_PE(16:0_18:1)-H | 1_DMPE(16:0_16:1)-H | 1_DMPE(14:0_18:1)-H | 1_MMPE(16:0_17:1)-H | 1_CL(18:0_18:0_16:1_18:0)-2H | 1_PE(16:1_18:0)-H | 1_MMPE(16:1_17:0)-H | 1_PE(17:0_17:1)-H 194993.20684 | 176531.4587 | 113296.48 | 84926.55173 | 75859.7173 | 72516.88874 | 62239.3292 | 37912.71217 | 7282.505635 CL [M-2H]2- No CL(16:0_18:1_20:0_20:0) 744.5533591 14.60043252 1_CL(16:0_18:1_20:0_20:0)-2H | 1_DMPE(16:0_18:1)-H | 1_CL(14:0_20:0_20:0_20:1)-2H | 1_PE(16:0_20:1)-H | 1_PE(16:1_20:0)-H | 1_PE(14:0_22:1)-H | 1_DMPE(14:0_20:1)-H 111082.2223 | 87262.927 | 28766.2646 | 22505.61969 | 15475.2995 | 15263.4347 | 4946.9693 CL [M-2H]2- No CL(16:1_18:1_18:1_18:2) 712.4904609 9.363656494 1_CL(16:1_18:1_18:1_18:2)-2H | 1_PE(16:1_18:2)-H | 1_CL(16:1_18:0_18:2_18:2)-2H | 1_CL(16:0_16:1_18:2_20:2)-2H | 1_CL(16:0_18:1_18:2_18:2)-2H | 1_CL(14:0_18:1_18:2_20:2)-2H | 1_CL(16:1_18:0_18:1_18:3)-2H | 1_CL(16:1_16:1_18:1_20:2)-2H | 1_CL(16:0_16:1_18:1_20:3)-2H | 1_CL(16:0_18:0_18:2_18:3)-2H | 1_CL(14:0_18:0_18:2_20:3)-2H | 1_CL(16:0_16:0_18:2_20:3)-2H | 1_DMPE(14:1_18:2)-H | 1_CL(16:1_16:1_20:3_18:0)-2H | 1_CL(14:0_16:1_20:2_20:2)-2H | 1_CL(16:0_18:1_18:1_18:3)-2H | 1_CL(14:0_18:1_18:1_20:3)-2H | 1_PE(16:0_18:3)-H | 1_PE(14:0_20:3)-H | 1_CL(14:0_16:0_20:2_20:3)-2H | 1_PE(14:1_20:2)-H | 1_CL(14:0_18:0_18:3_20:2)-2H | 1_CL(16:0_16:0_18:3_20:2)-2H | 1_DMPE(14:0_18:3)-H 37698.525099 | 35944.3702 | 35252.953479 | 34714.968209 | 26280.169902 | 25458.286512 | 24273.286977 | 23661.781607 | 23585.292197 | 22612.738482 | 22435.987082 | 22415.424502 | 21950.62927 | 20639.482177 | 19987.782207 | 11980.3174 | 11008.4245 | 8533.18647 | 8318.0756 | 8024.86761 | 7947.95478 | 7917.72089 | 7897.15831 | 7806.0796 CL [M-2H]2- No CL(18:0_20:0_20:0_20:1) 772.5845404 15.13097489 1_CL(18:0_20:0_20:0_20:1)-2H | 1_CL(18:0_18:1_20:0_22:0)-2H | 1_CL(16:0_20:0_20:1_22:0)-2H | 1_PE(18:0_20:1)-H | 1_CL(18:0_18:0_20:1_22:0)-2H | 1_PE(18:1_20:0)-H | 1_CL(20:0_20:0_18:1_20:0)-2H | 1_DMPE(18:0_18:1)-H | 1_DMPE(16:0_20:1)-H | 1_CL(14:0_20:1_22:0_22:0)-2H | 1_CL(16:0_18:1_22:0_22:0)-2H | 1_PE(16:0_22:1)-H | 1_CL(20:0_16:1_22:0_20:0)-2H | 1_DMPE(16:1_20:0)-H | 1_MMPE(17:1_20:0)-H | 1_CL(18:0_16:1_22:0_22:0)-2H | 1_DMPE(14:0_22:1)-H | 1_PE(16:1_22:0)-H | 1_PE(14:0_24:1)-H | 1_DMPE(12:0_24:1)-H 63468.239771 | 58962.086371 | 58374.4281 | 56101.87187 | 53301.443271 | 52517.13917 | 49887.1446 | 47969.316 | 47186.338 | 44384.5582 | 42680.1846 | 27584.37793 | 26852.3075 | 26521.9576 | 26054.6979 | 25136.960671 | 23203.9686 | 17098.93583 | 16541.75287 | 15502.39637 CL [M-2H]2- No CL(18:0_20:2_20:2_20:2) 767.540913 12.93091688 1_CL(18:0_20:2_20:2_20:2)-2H 3367.03678 CL [M-2H]2- Yes CL(18:1_18:1_18:2_20:3) 738.5062204 9.666911688 1_CL(18:1_18:1_18:2_20:3)-2H | 1_CL(16:0_18:1_20:3_20:3)-2H | 1_PE(16:1_20:3)-H | 1_PE(18:2_18:2)-H | 1_DMPE(16:1_18:3)-H | 1_PE(18:1_18:3)-H 6262.7152 | 4695.28519 | 2386.388615 | 1754.303205 | 1231.8085 | 1170.174945 CL [M-2H]2- No CL(18:1_20:0_20:1_20:2) 769.5562597 14.13628766 1_CL(18:1_20:0_20:1_20:2)-2H | 1_CL(18:0_20:1_20:1_20:2)-2H | 1_CL(18:2_20:0_20:2_20:0)-2H | 1_CL(18:0_20:0_20:2_20:2)-2H | 1_CL(18:1_20:0_20:3_20:0)-2H | 1_CL(18:1_20:1_20:1_20:1)-2H | 1_CL(18:0_20:0_20:1_20:3)-2H | 1_CL(18:2_20:0_20:1_20:1)-2H 38006.05982 | 27137.193 | 26805.78112 | 26790.44012 | 23321.62102 | 23045.5131 | 13350.52752 | 13060.90422 CL [M-2H]2- Yes CL(18:1_20:0_20:1_20:1) 770.5687079 14.62491008 1_CL(18:1_20:0_20:1_20:1)-2H | 1_PE(18:1_20:1)-H | 1_CL(18:1_20:0_20:2_20:0)-2H | 1_CL(18:0_20:1_20:1_20:1)-2H | 1_CL(18:0_20:0_20:1_20:2)-2H | 1_CL(18:2_20:0_20:1_20:0)-2H | 1_DMPE(18:1_18:1)-H | 1_DMPE(16:1_20:1)-H | 1_MMPE(17:1_20:1)-H | 1_CL(18:0_20:0_20:0_20:3)-2H | 1_PE(16:1_22:1)-H | 1_PE(16:0_22:2)-H | 1_PE(18:0_20:2)-H | 1_DMPE(14:0_22:2)-H | 1_PE(14:1_24:1)-H | 1_DMPE(16:0_20:2)-H | 1_PE(18:2_20:0)-H | 1_DMPE(14:1_22:1)-H | 1_DMPE(18:0_18:2)-H 164369.13244 | 156987.8339 | 96642.95633 | 91721.16591 | 90161.60624 | 88201.358166 | 73090.48 | 72731.036 | 69176.78041 | 19481.29618 | 9421.85515 | 8135.63745 | 4839.83717 | 3746.61544 | 3032.6306 | 2932.64 | 2859.82868 | 2840.9198 | 533.51225 CL [M-2H]2- No DMPE(14:0_16:0) 690.5062531 9.688586179 1_DMPE(14:0_16:0)-H | 1_MMPE(15:0_16:0)-H | 1_PE(16:0_16:0)-H | 1_DMPE(15:0_15:0)-H 37177.567 | 24588.843 | 24261.2374 | 7178.633 DMPE [M-H]- No DMPE(14:1_16:1) 686.4747209 8.470747863 1_DMPE(14:1_16:1)-H | 1_CL(14:0_16:1_18:1_18:1)-2H | 1_PE(16:1_16:1)-H | 1_PE(14:1_18:1)-H | 1_PE(14:0_18:2)-H | 1_DMPE(12:0_18:2)-H 26536.167 | 26254.9259 | 25736.359676 | 9746.586316 | 5578.101246 | 5194.10115 DMPE [M-H]- No DMPE(14:0_16:1) 688.4905834 7.95283141 1_DMPE(14:0_16:1)-H | 1_PE(16:0_16:1)-H 9926.993 | 8322.215225 DMPE [M-H]- No DMPE(16:0_22:6) 790.5375057 13.33144424 1_DMPE(16:0_22:6)-H | 1_PE(18:1_22:5)-H | 1_PE(20:3_20:3)-H | 1_MMPE(17:1_22:5)-H | 1_DMPE(16:1_22:5)-H 30213.2694 | 15760.125949 | 15437.08048 | 14596.8563 | 14502.56162 DMPE [M-H]- No DMPE(16:0_20:4) 766.5370945 10.3045141 1_DMPE(16:0_20:4)-H | 1_DMPE(16:1_20:3)-H | 1_DMPE(18:2_18:2)-H 11612.769 | 4506.1793 | 4253.01204 DMPE [M-H]- Yes DMPE(16:0_24:1) 828.6462778 15.50135855 1_DMPE(16:0_24:1)-H | 1_PE(18:0_24:1)-H | 1_DMPE(18:0_22:1)-H | 1_DMPE(18:1_22:0)-H | 1_PE(18:1_24:0)-H | 1_DMPE(16:1_24:0)-H 3833.651 | 2362.165174 | 1639.9066 | 1586.613 | 1232.383014 | 199.34735 DMPE [M-H]- No DMPE(16:0_22:1) 800.6128558 15.03100491 1_DMPE(16:0_22:1)-H | 1_DMPE(18:1_20:0)-H | 1_PE(18:0_22:1)-H | 1_PE(18:1_22:0)-H | 1_PE(20:0_20:1)-H | 1_DMPE(18:0_20:1)-H | 1_PE(16:0_24:1)-H | 1_DMPE(14:0_24:1)-H | 1_CL(20:0_18:1_22:0_22:0)-2H | 1_CL(20:0_20:0_20:1_22:0)-2H | 1_CL(18:0_20:1_22:0_22:0)-2H 21587.684 | 20038.986 | 19741.1753 | 17930.03189 | 17576.446 | 16136.353 | 15692.72795 | 12607.7862 | 8019.85749 | 5557.31749 | 4117.22449 DMPE [M-H]- No DMPE(17:1_18:1) 756.5532065 14.31451748 1_DMPE(17:1_18:1)-H | 1_MMPE(18:1_18:1)-H | 1_CL(18:0_18:1_20:1_20:1)-2H | 1_PE(18:2_19:0)-H | 1_DMPE(17:0_18:2)-H | 1_MMPE(18:0_18:2)-H | 1_PE(17:0_20:2)-H | 1_MMPE(16:0_20:2)-H | 1_DMPE(15:0_20:2)-H | 1_PE(17:1_20:1)-H | 1_MMPE(16:1_20:1)-H | 1_PE(15:0_22:2)-H | 1_CL(18:0_18:0_20:1_20:2)-2H | 1_CL(16:0_20:1_20:1_20:1)-2H 22215.0483 | 21617.015 | 13482.2562 | 12653.67022 | 12641.3279 | 12521.5188 | 12489.38312 | 12297.9291 | 11858.52371 | 10397.13192 | 9786.8588 | 9287.44004 | 3701.2922 | 1027.2865 DMPE [M-H]- No DMPE(18:0_18:1) 772.5842609 14.4513126 1_DMPE(18:0_18:1)-H | 1_PE(18:1_20:0)-H | 1_CL(20:0_20:0_18:1_20:0)-2H | 1_PE(18:0_20:1)-H | 1_CL(18:0_20:0_20:0_20:1)-2H | 1_DMPE(16:0_20:1)-H | 1_PE(16:0_22:1)-H | 1_MMPE(17:0_20:1)-H | 1_DMPE(14:0_22:1)-H | 1_DMPE(16:1_20:0)-H | 1_MMPE(17:1_20:0)-H 125581.27 | 95826.831 | 84187.55861 | 71442.4728 | 68059.60736 | 36092.125 | 29427.94808 | 26479.6976 | 18699.9217 | 18419.79466 | 18367.49647 DMPE [M-H]- No DMPE(18:0_20:3) 796.5844185 14.12018943 1_DMPE(18:0_20:3)-H | 1_PE(18:0_22:3)-H | 1_DMPE(16:0_22:3)-H | 1_DMPE(18:1_20:2)-H | 1_DMPE(18:2_20:1)-H | 1_PE(20:1_20:2)-H | 1_PE(18:1_22:2)-H | 1_DMPE(16:1_22:2)-H 15354.98 | 14686.18496 | 13603.052 | 8246.0602 | 7982.8563 | 7976.70144 | 7965.853106 | 7424.04199 DMPE [M-H]- No DMPE(18:1_20:1) 798.5993841 14.48862428 1_DMPE(18:1_20:1)-H | 1_PE(18:1_22:1)-H | 1_DMPE(18:0_20:2)-H | 1_PE(20:1_20:1)-H | 1_DMPE(16:0_22:2)-H | 1_PE(18:0_22:2)-H | 1_MMPE(17:0_22:2)-H | 1_DMPE(16:1_22:1)-H | 1_PE(16:1_24:1)-H | 1_DMPE(14:1_24:1)-H 33242.746 | 28302.708786 | 23891.776 | 20798.838686 | 19421.89 | 19153.072096 | 15836.00966 | 15720.072 | 13972.639616 | 12555.9102 DMPE [M-H]- No DMPE(18:1_24:1) 854.6688918 15.1634 1_DMPE(18:1_24:1)-H | 1_PE(20:1_24:1)-H | 1_DMPE(20:1_22:1)-H | 1_DMPE(20:0_22:2)-H | 1_PE(22:1_22:1)-H 5647.7894 | 5280.144991 | 2770.5008 | 2375.04377 | 2234.464191 DMPE [M-H]- No DMPE(18:1_22:2) 824.6151019 15.2111248 1_DMPE(18:1_22:2)-H | 1_PE(18:2_24:1)-H | 1_PE(20:1_22:2)-H | 1_DMPE(18:2_22:1)-H | 1_PE(20:2_22:1)-H | 1_DMPE(20:1_20:2)-H 30607.013 | 19462.452239 | 18353.900459 | 18248.0573 | 17616.654969 | 17237.4381 DMPE [M-H]- No DMPE(18:1_26:0) 884.7084386 16.34544498 1_DMPE(18:1_26:0)-H | 1_PE(20:1_26:0)-H 34313.661 | 22370.62758 DMPE [M-H]- No DMPE(20:3_22:1) 850.6308996 15.29216423 1_DMPE(20:3_22:1)-H | 1_PE(20:3_24:1)-H | 1_PE(22:1_22:3)-H | 1_DMPE(20:1_22:3)-H 6321.7145 | 6286.443811 | 5637.208781 | 5243.7195 DMPE [M-H]- No DMPE(20:1_24:1) 882.6937283 15.93206453 1_DMPE(20:1_24:1)-H 18582.30125 DMPE [M-H]- Yes DMPE(20:4_24:1) 876.6474209 15.61990563 1_DMPE(20:4_24:1)-H | 1_PE(22:4_24:1)-H | 1_DMPE(22:1_22:4)-H 8058.81863 | 228.623187 | 58.44797 DMPE [M-H]- No FAHFA(16:0/18:2) 533.45331 3.148206707 1_FAHFA(16:0/18:2)-H 31650.05 FAHFA [M-H]- Yes FAHFA(18:0/20:2) 589.5158632 4.350122358 1_FAHFA(18:0/20:2)-H 46188.29 FAHFA [M-H]- Yes FAHFA(18:0/22:3) 615.5368612 4.364461814 1_FAHFA(18:0/22:3)-H 9936.9926 FAHFA [M-H]- Yes FAHFA(18:2/20:4) 581.453432 2.583405691 1_FAHFA(18:2/20:4)-H | 1_FAHFA(20:5/18:1)-H 19083.6752 | 19083.6752 FAHFA [M-H]- Yes HexCer-NS(d18:1/24:1) 854.6705491 14.91986329 1_HexCer-NS(d18:1/24:1)+HCO2 | 1_HexCer-NS(d26:2/16:0)+HCO2 | 1_DMPE(18:1_24:1)-H | 1_PE(22:1_22:1)-H 3944.757112 | 3897.70538 | 2205.07844 | 2180.12039 HexCer-NS [M+HCO2]- No HexCer-NS(d18:1/24:0) 810.6811183 15.66918249 1_HexCer-NS(d18:1/24:0)-H | 1_HexCer-NS(d26:1/16:0)-H | 1_HexCer-NDS(d27:0/15:1)-H | 1_HexCer-NS(d27:1/15:0)-H | 1_HexCer-NS(d16:1/26:0)-H 18102.7427 | 16709.4904 | 16434.34526 | 16413.76119 | 16409.31095 HexCer-NS [M-H]- No HexCer-NS(d18:1/23:0) 796.6652801 15.43929295 1_HexCer-NS(d18:1/23:0)-H | 1_HexCer-NS(d17:1/24:0)-H | 1_HexCer-NS(d25:1/16:0)-H | 1_HexCer-NS(d26:1/15:0)-H | 1_HexCer-NS(d16:1/25:0)-H 7753.6368 | 7527.34771 | 7373.4508 | 7331.96718 | 7299.15587 HexCer-NS [M-H]- Yes HexCer-NS(d19:1/25:0) 884.7166222 15.88392061 1_HexCer-NS(d19:1/25:0)+HCO2 | 1_HexCer-NS(d20:1/24:0)+HCO2 | 1_HexCer-NS(d18:1/26:0)+HCO2 | 1_HexCer-NS(d26:1/18:0)+HCO2 1863.49957 | 1820.44895 | 1794.67578 | 1775.35163 HexCer-NS [M+HCO2]- Yes HexCer-NS(d18:1/26:1) 836.6964004 15.6276171 1_HexCer-NS(d18:1/26:1)-H | 1_HexCer-NS(d28:2/16:0)-H | 1_HexCer-NS(d20:2/24:0)-H | 1_HexCer-NS(d29:2/15:0)-H | 1_HexCer-NS(d19:2/25:0)-H | 1_HexCer-NS(d28:1/16:1)-H 45879.4262 | 41368.311 | 40927.9966 | 40169.09134 | 40112.93232 | 40104.98059 HexCer-NS [M-H]- Yes HexCer-NS(d18:1/16:0) 698.5560928 10.57549248 1_HexCer-NS(d18:1/16:0)-H | 1_HexCer-NS(d19:1/15:0)-H | 1_HexCer-NDS(d19:0/15:1)-H | 1_HexCer-NDS(d18:0/16:1)-H 13525.1168 | 11222.559575 | 11197.65098 | 11177.50758 HexCer-NS [M-H]- No LPE(16:1) 450.2611318 1.735549567 1_LPE(16:1)-H 1907.010262 LPE [M-H]- Yes LPE(18:0) 480.3084813 2.921436147 1_LPE(18:0)-H 888.830384 LPE [M-H]- Yes LPE(18:1) 478.2927022 2.213420346 1_LPE(18:1)-H 10206.73289 LPE [M-H]- Yes LPE(18:2) 476.2767728 1.857646753 1_LPE(18:2)-H 885.445472 LPE [M-H]- Yes LPE(20:4) 500.2768101 1.775593506 1_LPE(20:4)-H 1948.1673 LPE [M-H]- Yes LPI(18:1) 597.3027657 1.658765152 1_LPI(18:1)-H 6133.13116 LPI [M-H]- Yes LPS(18:0) 524.297896 2.179664719 1_LPS(18:0)-H 1492.75966 LPS [M-H]- Yes LPS(22:0) 580.3601177 2.121414069 1_LPS(22:0)-H 91.42379 LPS [M-H]- Yes MMPE(18:1_24:0) 842.6705436 15.18863205 1_MMPE(18:1_24:0)-H | 1_MMPE(18:0_24:1)-H | 1_DMPE(18:1_23:0)-H 481.5694 | 443.1678 | 305.93037 MMPE [M-H]- No MMPE(18:0_20:3) 782.5695689 14.63020556 1_MMPE(18:0_20:3)-H | 1_PE(19:0_20:3)-H | 1_DMPE(17:0_20:3)-H | 1_PE(17:0_22:3)-H | 1_MMPE(16:0_22:3)-H | 1_DMPE(18:3_19:0)-H 8211.263 | 7034.906177 | 6465.61047 | 5700.119347 | 5610.20343 | 5482.72906 MMPE [M-H]- No MMPE(20:1_24:1) 868.6867905 15.16565979 1_MMPE(20:1_24:1)-H | 1_MMPE(22:1_22:1)-H 8329.79483 | 133.3911 MMPE [M-H]- Yes MMPE(20:2_24:1) 866.6707196 14.70050513 1_MMPE(20:2_24:1)-H | 1_MMPE(22:0_22:3)-H 545.5536 | 416.27587 MMPE [M-H]- Yes MMPE(20:1_24:0) 870.699217 15.32650855 1_MMPE(20:1_24:0)-H 150.31576 MMPE [M-H]- Yes PC(14:0_16:0) 750.52718 9.688999593 1_PC(14:0_16:0)+HCO2 | 1_PC(15:0_15:0)+HCO2 | 1_OxPE(16:0_18:0(2O))-H 18408.63146 | 8511.91724 | 6629.88697 PC [M+HCO2]- No PC(14:0_16:1) 748.5156359 7.998754566 1_PC(14:0_16:1)+HCO2 | 1_PC(14:1_16:0)+HCO2 8140.32124 | 7825.333602 PC [M+HCO2]- Yes PC(15:0_17:0) 778.5587234 11.0945249 1_PC(15:0_17:0)+HCO2 | 1_PC(16:0_16:0)+HCO2 4456.027602 | 4381.013372 PC [M+HCO2]- Yes PC(15:0_15:0) 750.5332937 12.50995855 1_PC(15:0_15:0)+HCO2 8418.321638 PC [M+HCO2]- Yes PC(15:0_16:0) 764.5435043 9.68872622 1_PC(15:0_16:0)+HCO2 51554.44677 PC [M+HCO2]- Yes PC(15:0_17:1) 776.5428905 8.771199167 1_PC(15:0_17:1)+HCO2 | 1_PC(16:0_16:1)+HCO2 | 1_PC(14:0_18:1)+HCO2 8492.91085 | 7121.53309 | 2954.886439 PC [M+HCO2]- Yes PC(15:1_18:1) 788.5432058 8.23872439 1_PC(15:1_18:1)+HCO2 5185.085719 PC [M+HCO2]- Yes PC(16:0_16:0) 778.5583541 12.69514533 1_PC(16:0_16:0)+HCO2 | 1_PC(14:0_18:0)+HCO2 | 1_OxPE(18:0_18:0(2O))-H 35842.52161 | 13764.40619 | 215.65348 PC [M+HCO2]- No PC(16:0_17:1) 790.5584613 10.49861728 1_PC(16:0_17:1)+HCO2 27753.90814 PC [M+HCO2]- Yes PC(16:0_16:1) 776.5438567 10.03537215 1_PC(16:0_16:1)+HCO2 | 1_PC(14:0_18:1)+HCO2 | 3_PS(35:0)-H 46778.37148 | 24030.46713 | 4352.53633 PC [M+HCO2]- No PC(16:0_17:0) 792.5747826 12.69371931 1_PC(16:0_17:0)+HCO2 | 1_PC(15:0_18:0)+HCO2 81594.076305 | 8496.453715 PC [M+HCO2]- Yes PC(16:0_18:1) 804.5744435 13.12409858 1_PC(16:0_18:1)+HCO2 | 1_PC(16:1_18:0)+HCO2 78799.2015 | 26536.70511 PC [M+HCO2]- Yes PC(16:0_20:4) 826.5585853 10.29622479 1_PC(16:0_20:4)+HCO2 | 1_PC(18:1_18:3)+HCO2 | 1_PC(18:2_18:2)+HCO2 7937.4509 | 4877.85949 | 4710.82786 PC [M+HCO2]- Yes PC(16:1_18:1) 802.5594724 10.43783618 1_PC(16:1_18:1)+HCO2 | 1_PC(14:0_20:2)+HCO2 | 1_PC(16:0_18:2)+HCO2 | 1_PC(17:1_17:1)+HCO2 38799.84549 | 17600.703153 | 17452.9107562 | 17282.020308 PC [M+HCO2]- Yes PC(17:0_17:0) 806.5893113 13.77805406 1_PC(17:0_17:0)+HCO2 | 1_PC(16:0_18:0)+HCO2 5940.71595 | 5705.25448 PC [M+HCO2]- Yes PC(17:0_18:1) 818.5906353 13.12125061 1_PC(17:0_18:1)+HCO2 | 1_PC(17:1_18:0)+HCO2 95626.07947 | 9439.6925 PC [M+HCO2]- Yes PC(17:0_20:1) 846.6214696 14.45720285 1_PC(17:0_20:1)+HCO2 44563.70944 PC [M+HCO2]- Yes PC(17:1_22:2) 870.6213435 13.90499609 1_PC(17:1_22:2)+HCO2 4907.522606 PC [M+HCO2]- Yes PC(17:1_22:1) 872.6369138 14.49036118 1_PC(17:1_22:1)+HCO2 14665.3709 PC [M+HCO2]- Yes PC(17:1_18:1) 816.5747383 10.72977256 1_PC(17:1_18:1)+HCO2 31959.32961 PC [M+HCO2]- Yes PC(18:0_20:1) 860.6356255 14.71501392 1_PC(18:0_20:1)+HCO2 5352.60673 PC [M+HCO2]- Yes PC(18:0_18:1) 832.6055067 14.11235042 1_PC(18:0_18:1)+HCO2 | 1_PC(16:0_20:1)+HCO2 | 1_PC(17:1_19:0)+HCO2 20042.59287 | 5763.722502 | 4097.33638 PC [M+HCO2]- Yes PC(18:1_22:1) 886.6529584 15.04044599 1_PC(18:1_22:1)+HCO2 | 1_PC(16:1_24:1)+HCO2 | 1_PC(18:0_22:2)+HCO2 28003.18855 | 24345.71087 | 21310.20083 PC [M+HCO2]- Yes PC(18:1_20:1) 858.6204105 14.15257 1_PC(18:1_20:1)+HCO2 | 1_PC(16:1_22:1)+HCO2 12173.39292 | 771.924692 PC [M+HCO2]- Yes PC(18:1_22:3) 882.6212292 14.20186256 1_PC(18:1_22:3)+HCO2 | 1_PC(18:0_22:4)+HCO2 | 1_PC(20:1_20:3)+HCO2 | 1_PC(18:2_22:2)+HCO2 | 1_PC(20:2_20:2)+HCO2 8166.23596 | 5869.52605 | 5644.684927 | 5433.911851 | 5387.47351 PC [M+HCO2]- Yes PC(18:1_22:2) 884.637753 14.63628419 1_PC(18:1_22:2)+HCO2 | 1_PC(20:1_20:2)+HCO2 | 1_PC(18:0_22:3)+HCO2 | 1_PC(18:2_22:1)+HCO2 | 3_PS(43:2)-H 13446.94766 | 11946.23793 | 9993.490547 | 9784.32983 | 1631.4231 PC [M+HCO2]- No PC(18:1_24:0) 916.6994854 15.91564276 1_PC(18:1_24:0)+HCO2 | 1_PC(16:1_26:0)+HCO2 | 1_PC(18:0_24:1)+HCO2 22208.877401 | 17751.97359 | 17147.698877 PC [M+HCO2]- Yes PC(18:1_19:0) 846.616547 14.68990781 1_PC(18:1_19:0)+HCO2 | 1_PC(17:0_20:1)+HCO2 | 1_PC(15:0_22:1)+HCO2 | 1_PS(18:0_22:0)-H 7557.613285 | 7336.379075 | 6883.309595 | 1069.34817 PC [M+HCO2]- No PC(18:1_20:2) 856.6054118 13.93286793 1_PC(18:1_20:2)+HCO2 | 1_PC(18:2_20:1)+HCO2 | 1_PC(18:0_20:3)+HCO2 | 1_PC(16:1_22:2)+HCO2 | 1_PC(16:0_22:3)+HCO2 10654.297459 | 6894.726421 | 6656.99824 | 6234.400211 | 6063.457606 PC [M+HCO2]- Yes PC(18:2_24:1) 912.6683671 15.14219935 1_PC(18:2_24:1)+HCO2 | 1_PC(20:2_22:1)+HCO2 | 1_PC(20:1_22:2)+HCO2 15910.04233 | 15908.32676 | 15892.92123 PC [M+HCO2]- Yes PC(18:2_19:0) 844.6033989 14.15621021 1_PC(18:2_19:0)+HCO2 | 1_PC(17:1_20:1)+HCO2 | 1_PC(17:0_20:2)+HCO2 5234.63541 | 5171.17144 | 4778.93304 PC [M+HCO2]- Yes PE(14:0_16:0) 662.4749934 7.387656962 1_PE(14:0_16:0)-H | 1_DMPE(14:0_14:0)-H | 1_DMPE(12:0_16:0)-H 11854.914141 | 10606.222 | 3528.5228 PE [M-H]- No PE(16:0_16:1) 688.4908157 10.6670624 1_PE(16:0_16:1)-H | 1_DMPE(14:0_16:1)-H | 1_CL(16:0_16:0_16:0_18:1)-2H | 1_MMPE(15:1_16:0)-H | 1_DMPE(14:1_16:0)-H | 1_PE(14:0_18:1)-H 87064.69788 | 60645.568 | 48147.10313 | 37107.78452 | 37101.80693 | 27489.05628 PE [M-H]- No PE(16:0_18:0) 718.5374153 14.52528611 1_PE(16:0_18:0)-H | 1_MMPE(16:0_17:0)-H | 1_DMPE(16:0_16:0)-H | 1_DMPE(14:0_18:0)-H | 1_PE(14:0_20:0)-H | 1_PE(17:0_17:0)-H 64422.36302 | 45613.95271 | 45596.58 | 25241.0906 | 11182.28779 | 10977.99113 PE [M-H]- No PE(16:0_22:6) 762.5071283 10.15466564 1_PE(16:0_22:6)-H | 1_CL(16:0_18:1_22:5_22:5)-2H | 1_MMPE(15:0_22:6)-H | 1_DMPE(14:0_22:6)-H | 1_PE(16:1_22:5)-H | 1_PE(18:2_20:4)-H | 1_CL(18:1_18:1_20:4_22:5)-2H 19106.33198 | 12194.22256 | 11562.97236 | 11560.9574 | 7210.162032 | 7177.273372 | 6917.34512 PE [M-H]- No PE(16:0_22:4) 766.537534 13.22463395 1_PE(16:0_22:4)-H | 1_DMPE(16:0_20:4)-H | 1_PE(18:1_20:3)-H | 1_CL(18:0_20:2_20:2_20:3)-2H | 1_DMPE(16:1_20:3)-H | 1_CL(18:1_20:2_20:2_20:2)-2H | 1_DMPE(18:1_18:3)-H | 1_PE(18:0_20:4)-H | 1_PE(18:2_20:2)-H | 1_PE(16:1_22:3)-H | 1_CL(18:0_18:0_20:2_22:5)-2H | 1_DMPE(18:2_18:2)-H 15680.296036 | 8503.6817 | 8270.147826 | 7234.0186 | 7141.0601 | 6960.468895 | 6855.39851 | 6098.183856 | 6085.912056 | 6071.0395951 | 5939.04688 | 5912.4427 PE [M-H]- No PE(16:0_17:1) 702.5071962 12.2020525 1_PE(16:0_17:1)-H | 1_MMPE(15:0_17:1)-H | 1_CL(16:0_16:0_18:0_18:1)-2H | 1_CL(16:0_16:1_18:0_18:0)-2H | 1_MMPE(16:0_16:1)-H | 1_DMPE(14:0_17:1)-H | 1_PE(15:0_18:1)-H | 1_DMPE(15:0_16:1)-H | 1_PE(16:1_17:0)-H | 1_CL(14:0_18:0_18:0_18:1)-2H | 1_MMPE(14:0_18:1)-H 7002.665496 | 6016.1812 | 5641.4398262 | 5586.2974102 | 5420.504 | 5301.34219 | 5039.841266 | 4779.2442 | 4443.485616 | 4284.503366 | 4053.38919 PE [M-H]- No PE(16:0_20:3) 740.5220218 13.26578355 1_PE(16:0_20:3)-H | 1_CL(18:0_18:1_18:1_20:3)-2H | 1_CL(18:0_18:0_18:2_20:3)-2H | 1_DMPE(16:0_18:3)-H | 1_PE(18:0_18:3)-H | 1_CL(18:0_18:0_18:1_20:4)-2H | 1_MMPE(17:0_18:3)-H | 1_PE(18:1_18:2)-H | 1_MMPE(17:1_18:2)-H | 1_DMPE(16:1_18:2)-H 25700.90235 | 19625.0575 | 19601.4548 | 11839.7138 | 7148.850128 | 6921.92476 | 6879.11348 | 6850.57592 | 6592.80361 | 6588.63553 PE [M-H]- No PE(16:1_18:1) 714.50651 11.02382284 1_PE(16:1_18:1)-H | 1_CL(16:0_16:1_18:1_20:1)-2H | 1_CL(16:0_18:1_18:1_18:1)-2H | 1_CL(16:0_16:0_18:1_20:2)-2H | 1_CL(14:0_18:1_18:1_20:1)-2H | 1_DMPE(14:1_18:1)-H | 1_CL(14:0_16:1_20:1_20:1)-2H | 1_MMPE(16:1_17:1)-H | 1_DMPE(16:1_16:1)-H | 1_PE(16:0_18:2)-H | 1_PE(14:0_20:2)-H | 1_PE(17:1_17:1)-H | 1_PE(14:1_20:1)-H | 1_CL(14:0_16:0_20:1_20:2)-2H | 1_CL(16:0_16:0_18:2_20:1)-2H | 1_DMPE(14:0_18:2)-H 154201.42297 | 142816.30363 | 87827.28675 | 84156.349484 | 84048.30337 | 83885.76534 | 72784.30228 | 72691.5907 | 72583.13 | 16471.83573 | 16401.25277 | 16275.63167 | 16239.0712108 | 14312.94302 | 14219.895454 | 14159.1763 PE [M-H]- No PE(16:1_22:6) 760.4910767 8.028365556 1_PE(16:1_22:6)-H | 1_CL(16:0_18:1_22:6_22:6)-2H | 1_PE(18:3_20:4)-H | 1_CL(18:1_20:4_20:4_20:4)-2H 10423.861952 | 7613.65924 | 4243.479482 | 4192.1794 PE [M-H]- No PE(16:1_20:4) 736.4907187 8.597997403 1_PE(16:1_20:4)-H | 1_DMPE(16:1_18:4)-H | 1_PE(18:2_18:3)-H | 1_PE(16:0_20:5)-H 24630.28276 | 11944.47293 | 6368.03514 | 6288.44809 PE [M-H]- No PE(17:0_20:4) 752.5236301 12.49398788 1_PE(17:0_20:4)-H 5419.62995 PE [M-H]- Yes PE(17:1_18:1) 728.5220916 12.59695844 1_PE(17:1_18:1)-H | 1_DMPE(16:1_17:1)-H | 1_MMPE(16:1_18:1)-H | 1_MMPE(17:1_17:1)-H | 1_PE(17:0_18:2)-H | 1_MMPE(16:0_18:2)-H | 1_DMPE(15:0_18:2)-H | 1_PE(15:0_20:2)-H 22920.799027 | 14538.4881 | 14471.7711 | 13869.64 | 6835.590277 | 6671.41639 | 6607.01415 | 6000.722417 PE [M-H]- No PE(18:0_20:5) 764.5218426 12.01051645 1_PE(18:0_20:5)-H | 1_CL(18:0_18:0_20:4_22:5)-2H | 1_CL(18:0_18:1_20:3_22:5)-2H | 1_DMPE(16:0_20:5)-H | 1_CL(18:0_20:3_20:3_20:3)-2H | 1_PE(18:1_20:4)-H | 1_PE(16:0_22:5)-H 11604.74159 | 8213.190153 | 7882.782193 | 7856.66776 | 7488.777243 | 5783.13534 | 4906.65571 PE [M-H]- No PE(18:0_20:4) 766.5381072 13.94952317 1_PE(18:0_20:4)-H | 1_CL(18:1_20:1_20:1_20:4)-2H | 1_CL(18:0_20:1_20:3_20:3)-2H | 1_PE(18:1_20:3)-H 141935.2872 | 90730.2971 | 84636.15305 | 2561.05596 PE [M-H]- No PE(18:0_20:3) 768.5530931 14.37904074 1_PE(18:0_20:3)-H | 1_CL(18:0_20:0_20:2_20:3)-2H | 1_CL(18:0_20:1_20:1_20:3)-2H | 1_CL(18:1_20:0_20:1_20:3)-2H | 1_CL(18:2_20:0_20:3_20:0)-2H | 1_DMPE(16:0_20:3)-H | 1_CL(18:0_20:1_20:2_20:2)-2H | 1_CL(18:1_20:1_20:1_20:2)-2H | 1_PE(18:1_20:2)-H | 1_CL(18:1_20:0_20:2_20:2)-2H | 1_CL(18:2_20:0_20:1_20:2)-2H | 1_DMPE(18:1_18:2)-H | 1_DMPE(16:1_20:2)-H | 1_PE(18:2_20:1)-H | 1_PE(16:0_22:3)-H | 1_PE(16:1_22:2)-H | 1_CL(18:2_20:1_20:1_20:1)-2H 38147.55686 | 37565.40758 | 36340.2388 | 30999.89038 | 28993.40808 | 28672.0847 | 19270.0098 | 13780.7247 | 13774.2964 | 13458.96268 | 12393.87778 | 12141.7545 | 12137.6109 | 10967.07107 | 10809.85727 | 10684.1786 | 10564.6402 PE [M-H]- No PE(18:1_18:2) 740.5221494 11.6992463 1_PE(18:1_18:2)-H | 1_CL(18:0_18:1_18:2_20:2)-2H | 1_DMPE(16:1_18:2)-H | 1_CL(18:0_18:0_18:2_20:3)-2H | 1_MMPE(17:1_18:2)-H | 1_CL(18:1_18:1_18:1_20:2)-2H | 1_CL(16:0_18:1_20:2_20:2)-2H | 1_CL(18:0_18:1_18:1_20:3)-2H | 1_PE(16:1_20:2)-H | 1_CL(16:1_18:0_20:2_20:2)-2H | 1_CL(16:0_18:0_20:2_20:3)-2H | 1_PE(16:0_20:3)-H 49614.23715 | 48018.858535 | 31175.617 | 30325.061465 | 30113.98602 | 27458.20877 | 26969.32288 | 26055.09497 | 12014.566302 | 11574.02113 | 10514.79228 | 9854.31103 PE [M-H]- No PE(18:1_20:5) 762.5088616 9.376668496 1_PE(18:1_20:5)-H | 1_CL(18:0_18:1_20:4_22:6)-2H | 1_CL(18:1_18:1_20:4_22:5)-2H | 1_CL(16:0_18:1_22:5_22:5)-2H | 1_DMPE(16:1_20:5)-H | 1_MMPE(17:1_20:5)-H | 1_PE(18:2_20:4)-H | 1_CL(18:0_18:2_20:4_22:5)-2H | 1_PE(16:0_22:6)-H | 1_CL(16:0_18:0_22:5_22:6)-2H | 1_PE(16:1_22:5)-H | 1_CL(16:1_18:0_22:5_22:5)-2H | 1_MMPE(15:1_22:5)-H | 1_DMPE(18:3_18:3)-H 53960.56175 | 35784.89272 | 34466.22454 | 32496.25404 | 28428.0453 | 28127.81751 | 19390.22551 | 18826.42334 | 15423.38877 | 15298.23496 | 14784.87179 | 14349.62971 | 12337.67458 | 12298.5306 PE [M-H]- No PE(18:1_20:4) 764.5224565 11.20551992 1_PE(18:1_20:4)-H | 1_CL(18:0_18:0_20:4_22:5)-2H | 1_CL(18:0_18:1_20:3_22:5)-2H | 1_PE(16:0_22:5)-H | 1_MMPE(15:0_22:5)-H | 1_PE(18:2_20:3)-H | 1_DMPE(16:0_20:5)-H | 1_PE(18:0_20:5)-H | 1_CL(18:0_20:3_20:3_20:3)-2H | 1_DMPE(18:2_18:3)-H | 1_MMPE(17:0_20:5)-H 74719.07324 | 46200.65407 | 38360.39439 | 18772.408 | 15997.2456 | 15255.56655 | 15188.8407 | 14730.00081 | 13630.64158 | 13483.67919 | 13339.93158 PE [M-H]- No PE(18:1_20:3) 766.5375591 12.67582813 1_PE(18:1_20:3)-H | 1_DMPE(16:1_20:3)-H | 1_CL(18:0_20:2_20:2_20:3)-2H | 1_CL(18:1_20:2_20:2_20:2)-2H | 1_PE(16:1_22:3)-H | 1_PE(18:2_20:2)-H | 1_DMPE(18:2_18:2)-H | 1_PE(16:0_22:4)-H 19196.151488 | 14932.1356 | 14737.06621 | 10511.32506 | 8564.856648 | 7205.436059 | 6588.2858 | 6313.328058 PE [M-H]- No PE(18:1_22:6) 788.5227635 10.45979329 1_PE(18:1_22:6)-H | 1_DMPE(16:1_22:6)-H | 1_PE(20:3_20:4)-H | 1_PE(18:2_22:5)-H 53439.70059 | 27228.3446 | 14474.70137 | 13387.37839 PE [M-H]- No PE(18:1_22:0) 800.6156471 15.62452286 1_PE(18:1_22:0)-H | 1_CL(20:0_18:1_22:0_22:0)-2H | 1_CL(22:0_22:0_16:1_22:0)-2H | 1_DMPE(18:1_20:0)-H | 1_DMPE(16:1_22:0)-H | 1_PE(16:1_24:0)-H | 1_CL(18:0_20:1_22:0_22:0)-2H | 1_CL(20:0_20:0_20:1_22:0)-2H | 1_MMPE(17:1_22:0)-H | 1_PE(18:0_22:1)-H | 1_DMPE(16:0_22:1)-H | 1_DMPE(18:0_20:1)-H | 1_PE(16:0_24:1)-H | 1_PE(20:0_20:1)-H | 1_DMPE(14:0_24:1)-H 53932.97432 | 51144.2088 | 40349.3091 | 40268.6397 | 40154.04 | 37760.78253 | 29215.806943 | 27518.2211 | 27502.8723 | 24395.20552 | 22288.69 | 18331.5664 | 17709.65482 | 17400.07432 | 16936.05331 PE [M-H]- No PE(18:1_24:1) 826.6313665 15.62581399 1_PE(18:1_24:1)-H | 1_DMPE(16:1_24:1)-H | 1_DMPE(18:1_22:1)-H | 1_MMPE(17:1_24:1)-H | 1_PE(20:1_22:1)-H | 1_PE(20:2_22:0)-H | 1_DMPE(18:0_22:2)-H | 1_DMPE(20:1_20:1)-H 71241.75727 | 54359.15 | 53345.3606 | 38086.738 | 22430.28937 | 21929.97854 | 21428.65799 | 21252.5601 PE [M-H]- No PE(18:1_24:0) 828.647307 16.04444008 1_PE(18:1_24:0)-H | 1_DMPE(16:1_24:0)-H | 1_MMPE(17:1_24:0)-H | 1_PE(16:1_26:0)-H | 1_PE(18:0_24:1)-H | 1_DMPE(16:0_24:1)-H 148953.23117 | 73237.689 | 67405.4304 | 37372.60114 | 28055.91077 | 26563.9073 PE [M-H]- No PE(18:1_19:0) 758.5711029 14.84129179 1_PE(18:1_19:0)-H | 1_MMPE(16:0_20:1)-H | 1_MMPE(18:0_18:1)-H | 1_DMPE(17:0_18:1)-H | 1_PE(17:0_20:1)-H | 1_DMPE(16:1_19:0)-H | 1_MMPE(12:0_24:1)-H 15152.342928 | 14102.622 | 12091.127 | 11199.35 | 10706.534938 | 3095.79253 | 65.21594 PE [M-H]- No PE(18:1_22:5) 790.5415616 11.38313971 1_PE(18:1_22:5)-H | 1_MMPE(17:1_22:5)-H | 1_DMPE(16:1_22:5)-H | 1_CL(20:1_20:1_20:4_22:5)-2H | 1_DMPE(16:0_22:6)-H | 1_PE(18:2_22:4)-H | 1_PE(20:3_20:3)-H | 1_MMPE(17:0_22:6)-H | 1_CL(20:1_20:1_20:3_22:6)-2H | 1_DMPE(18:2_20:4)-H | 1_OxPE(18:1e/22:5(1O(1Cyc)))-H | 1_OxPE(18:1e/22:6(1O))-H 19872.303631 | 14650.615 | 14000.3437 | 13887.10509 | 7708.8459 | 7054.106931 | 6945.714091 | 6783.4981 | 6774.74292 | 6764.74703 | 6754.86824 | 6754.86824 PE [M-H]- No PE(20:1_22:3) 822.5999841 14.88966098 1_PE(20:1_22:3)-H | 1_DMPE(20:1_20:3)-H | 1_DMPE(18:1_22:3)-H | 1_DMPE(18:2_22:2)-H | 1_PE(20:2_22:2)-H | 1_PE(20:3_22:1)-H | 1_DMPE(18:3_22:1)-H | 1_DMPE(20:2_20:2)-H | 1_PE(18:3_24:1)-H 8780.16754 | 6184.5263 | 5780.626 | 1812.144 | 1566.61315 | 1364.04802 | 436.48322 | 161.9547 | 60.82803 PE [M-H]- No PE(22:1_22:1) 854.6631199 16.01385417 1_PE(22:1_22:1)-H | 1_PE(22:0_22:2)-H | 1_DMPE(20:1_22:1)-H | 1_DMPE(20:0_22:2)-H 3752.857576 | 3624.01118 | 1367.1259 | 59.04653 PE [M-H]- No PG(16:0_18:1) 747.5155359 8.042684868 1_PG(16:0_18:1)-H | 1_PG(16:1_18:0)-H 22422.67296 | 8843.69655 PG [M-H]- Yes PG(16:1_18:1) 745.5008585 6.514277273 1_PG(16:1_18:1)-H | 1_PG(16:0_18:2)-H | 1_PG(14:0_20:2)-H 14156.555389 | 6207.712133 | 5546.560289 PG [M-H]- Yes PG(18:0_18:1) 775.5439923 10.39268932 1_PG(18:0_18:1)-H | 1_PG(16:0_20:1)-H | 1_PG(17:1_19:0)-H 18295.96808 | 8356.875549 | 7975.83979 PG [M-H]- Yes PG(18:1_20:3) 797.5315944 7.516995887 1_PG(18:1_20:3)-H | 1_PG(18:2_20:2)-H 12612.30971 | 4960.38851 PG [M-H]- Yes PG(18:1_22:6) 819.5158652 6.331813889 1_PG(18:1_22:6)-H | 1_PG(18:2_22:5)-H | 1_PG(20:3_20:4)-H 16393.096959 | 9930.517149 | 9796.588681 PG [M-H]- Yes PG(18:1_22:5) 821.5303324 7.514134234 1_PG(18:1_22:5)-H | 1_PG(20:2_20:4)-H | 1_PG(18:0_22:6)-H 3303.74921 | 471.670756 | 237.981278 PG [M-H]- Yes PI(16:1_18:1) 833.5170258 7.097701875 1_PI(16:1_18:1)-H | 1_PI(14:1_20:1)-H | 1_PI(17:1_17:1)-H 111870.04277 | 63447.20068 | 63369.755842 PI [M-H]- Yes PI(16:1_18:2) 831.5014463 6.08038913 1_PI(16:1_18:2)-H | 1_PI(14:1_20:2)-H 7031.401019 | 5770.0786162 PI [M-H]- Yes PI(18:0_20:3) 887.5637596 10.09010708 1_PI(18:0_20:3)-H | 1_PI(18:1_20:2)-H | 1_PI(16:0_22:3)-H | 1_PI(18:2_20:1)-H 157059.24354 | 96098.868006 | 93060.80254 | 92212.104921 PI [M-H]- Yes PI(18:0_22:4) 913.5797368 10.9052072 1_PI(18:0_22:4)-H | 1_PI(18:1_22:3)-H | 1_PI(20:1_20:3)-H 74945.574465 | 53014.986215 | 52999.419422 PI [M-H]- Yes PI(18:0_18:2) 861.5486881 10.24259354 1_PI(18:0_18:2)-H | 1_PI(16:0_20:2)-H | 1_PI(18:1_18:1)-H 61573.485791 | 40469.479736 | 40413.899937 PI [M-H]- Yes PI(18:0_20:1) 891.5953758 13.95221061 1_PI(18:0_20:1)-H | 1_PI(18:1_20:0)-H | 1_PI(16:0_22:1)-H 21563.69115 | 19406.481732 | 19190.616164 PI [M-H]- Yes PI(18:0_18:1) 863.5635127 12.19870614 1_PI(18:0_18:1)-H 23617.07035 PI [M-H]- Yes Plasmanyl-PS(O-20:0/22:5) 850.5938751 11.671905 1_Plasmanyl-PS(O-20:0/22:5)-H 2575.05749 ether-PS [M-H]- Yes Plasmanyl-PS(O-20:0/18:2) 800.5790655 12.0093987 1_Plasmanyl-PS(O-20:0/18:2)-H | 1_Plasmenyl-PS(P-20:0/18:1)-H | 1_Plasmenyl-PS(P-20:1/18:0)-H 1782.199178 | 217.041078 | 41.202048 ether-PS [M-H]- Yes Plasmanyl-PE(O-18:0/20:4) 752.5574784 12.04320634 1_Plasmanyl-PE(O-18:0/20:4)-H 7958.352725 ether-PE [M-H]- Yes Plasmanyl-PS(O-20:0/17:0) 790.5945386 14.17742886 1_Plasmanyl-PS(O-20:0/17:0)-H 5220.558755 ether-PS [M-H]- Yes Plasmanyl-PS(O-20:0/22:3) 854.6251716 14.0438316 1_Plasmanyl-PS(O-20:0/22:3)-H 660.302478 ether-PS [M-H]- Yes Plasmanyl-PS(O-20:0/18:1) 802.5949289 14.05932121 1_Plasmanyl-PS(O-20:0/18:1)-H | 1_Plasmenyl-PS(P-20:0/18:0)-H | 1_Plasmenyl-PS(P-18:0/20:0)-H | 1_Plasmanyl-PS(O-18:0/20:1)-H 38384.736938 | 1704.9104 | 415.97553 | 395.2098 ether-PS [M-H]- Yes Plasmanyl-PS(O-18:0/20:0) 804.6107954 14.17423745 1_Plasmanyl-PS(O-18:0/20:0)-H 86.224079 ether-PS [M-H]- Yes Plasmanyl-PS(O-20:0/20:3) 826.5946559 12.04070654 1_Plasmanyl-PS(O-20:0/20:3)-H 299.084629 ether-PS [M-H]- Yes Plasmanyl-PC(O-16:1/18:1) 788.5787066 14.05920688 1_Plasmanyl-PC(O-16:1/18:1)+HCO2 | 1_Plasmenyl-PC(P-16:0/18:1)+HCO2 | 1_Plasmanyl-PC(O-18:1/16:1)+HCO2 | 1_Plasmenyl-PC(P-18:0/16:1)+HCO2 | 1_Plasmenyl-PC(P-16:1/18:0)+HCO2 | 1_Plasmenyl-PC(P-18:1/16:0)+HCO2 27193.72834 | 27193.72834 | 13529.68154 | 13529.68154 | 12790.01176 | 12275.098 ether-PC [M+HCO2]- No Plasmanyl-PC(O-18:1/18:1) 816.610018 14.73137929 1_Plasmanyl-PC(O-18:1/18:1)+HCO2 | 1_Plasmenyl-PC(P-18:0/18:1)+HCO2 | 1_Plasmanyl-PC(O-16:1/20:1)+HCO2 | 1_Plasmenyl-PC(P-16:0/20:1)+HCO2 | 1_Plasmenyl-PC(P-18:1/18:0)+HCO2 | 1_Plasmenyl-PC(P-16:1/20:0)+HCO2 | 1_Plasmanyl-PC(O-20:1/16:1)+HCO2 | 1_Plasmenyl-PC(P-20:0/16:1)+HCO2 | 1_Plasmenyl-PC(P-20:1/16:0)+HCO2 13863.448662 | 13863.448662 | 7885.095752 | 7885.095752 | 7741.796862 | 7549.489362 | 7217.155962 | 7217.155962 | 7038.098822 ether-PC [M+HCO2]- No Plasmanyl-PC(O-16:0/20:1) 818.6261446 14.83587121 1_Plasmanyl-PC(O-16:0/20:1)+HCO2 | 1_Plasmanyl-PC(O-18:0/18:1)+HCO2 | 1_Plasmanyl-PC(O-20:0/16:1)+HCO2 | 1_Plasmanyl-PC(O-20:1/16:0)+HCO2 | 1_Plasmenyl-PC(P-20:0/16:0)+HCO2 | 1_Plasmanyl-PC(O-18:1/18:0)+HCO2 | 1_Plasmenyl-PC(P-18:0/18:0)+HCO2 10768.458531 | 10049.716671 | 7320.092346 | 7219.616679 | 7219.616679 | 7173.972302 | 7173.972302 ether-PC [M+HCO2]- No Plasmanyl-PC(O-16:0/16:0) 764.578904 14.09407438 1_Plasmanyl-PC(O-16:0/16:0)+HCO2 | 1_Plasmanyl-PC(O-18:0/14:0)+HCO2 54960.9098 | 18717.214 ether-PC [M+HCO2]- Yes Plasmanyl-PS(O-20:0/22:2) 856.6414229 14.73847911 1_Plasmanyl-PS(O-20:0/22:2)-H | 1_Plasmenyl-PS(P-18:0/24:1)-H | 1_Plasmenyl-PS(P-20:0/22:1)-H 1796.487998 | 281.84254 | 261.97484 ether-PS [M-H]- Yes Plasmanyl-PS(O-20:0/16:0) 776.5753583 11.64009978 1_Plasmanyl-PS(O-20:0/16:0)-H 779.915224 ether-PS [M-H]- Yes Plasmenyl-PE(P-18:0/22:3) 780.5886686 15.2841589 1_Plasmenyl-PE(P-18:0/22:3)-H | 1_Plasmenyl-PE(P-20:0/20:3)-H | 1_Plasmanyl-PE(O-18:0/22:4)-H 23802.81817 | 10172.95631 | 8257.36536 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/18:2) 698.5113298 12.8801844 1_Plasmenyl-PE(P-16:0/18:2)-H | 1_Plasmenyl-PE(P-18:1/16:1)-H | 1_Plasmenyl-PE(P-16:1/18:1)-H 50266.1284 | 20191.1526 | 11768.9245 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/18:1) 700.5273028 14.2631002 1_Plasmenyl-PE(P-16:0/18:1)-H | 1_Plasmenyl-PE(P-18:1/16:0)-H | 1_Plasmenyl-PE(P-18:0/16:1)-H | 1_Plasmenyl-PE(P-20:1/14:0)-H 139238.23203 | 109452.76103 | 8206.27283 | 7193.77833 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/20:5) 720.4956697 10.27700087 1_Plasmenyl-PE(P-16:0/20:5)-H 39882.63635 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/20:4) 722.5118244 12.29837012 1_Plasmenyl-PE(P-16:0/20:4)-H | 1_Plasmenyl-PE(P-16:1/20:3)-H 108437.72634 | 3197.08675 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/22:5) 774.5425736 12.72120654 1_Plasmenyl-PE(P-18:1/22:5)-H 55145.35535 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/20:3) 724.5270822 13.74654632 1_Plasmenyl-PE(P-16:0/20:3)-H | 1_Plasmenyl-PE(P-18:1/18:2)-H | 1_Plasmanyl-PE(O-16:0/20:4)-H 54488.6702 | 17730.2449 | 11642.32878 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/18:1) 726.5427927 14.36073557 1_Plasmenyl-PE(P-18:1/18:1)-H | 1_Plasmenyl-PE(P-20:1/16:1)-H | 1_Plasmenyl-PE(P-16:0/20:2)-H | 1_Plasmenyl-PE(P-18:0/18:2)-H 160638.93675 | 9354.37425 | 7110.08175 | 5965.60203 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/20:1) 728.55874 14.88866484 1_Plasmenyl-PE(P-16:0/20:1)-H | 1_Plasmenyl-PE(P-20:1/16:0)-H 55935.39374 | 5152.2662 ether-PE [M-H]- Yes Plasmenyl-PE(P-20:0/16:0) 730.5731173 14.17643355 1_Plasmenyl-PE(P-20:0/16:0)-H 50063.07411 ether-PE [M-H]- Yes Plasmenyl-PS(P-20:0/20:3) 824.5790209 11.48703509 1_Plasmenyl-PS(P-20:0/20:3)-H 683.74 ether-PS [M-H]- Yes Plasmenyl-PE(P-16:0/22:6) 746.5117033 11.42716235 1_Plasmenyl-PE(P-16:0/22:6)-H 59397.749 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/20:5) 746.5115153 10.50985256 1_Plasmenyl-PE(P-18:1/20:5)-H | 1_Plasmenyl-PE(P-16:0/22:6)-H 30773.2793 | 9858.38005 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/20:4) 748.5274777 12.50888272 1_Plasmenyl-PE(P-18:1/20:4)-H | 1_Plasmenyl-PE(P-16:0/22:5)-H | 1_Plasmenyl-PE(P-18:0/20:5)-H | 1_Plasmanyl-PE(O-16:0/22:6)-H 71585.005973 | 68539.569973 | 18796.540263 | 18779.783073 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/22:2) 754.5737461 14.97284411 1_Plasmenyl-PE(P-16:0/22:2)-H | 1_Plasmenyl-PE(P-18:1/20:1)-H | 1_Plasmenyl-PE(P-18:0/20:2)-H | 1_Plasmenyl-PE(P-16:1/22:1)-H 66492.959326 | 60429.903326 | 5410.870726 | 2345.020346 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/22:1) 756.589791 15.39315412 1_Plasmenyl-PE(P-16:0/22:1)-H | 1_Plasmenyl-PE(P-18:0/20:1)-H | 1_Plasmenyl-PE(P-20:0/18:1)-H | 1_Plasmenyl-PE(P-18:1/20:0)-H 89013.62855 | 74474.12955 | 29325.44855 | 15591.95655 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/22:6) 772.5272225 11.67591795 1_Plasmenyl-PE(P-18:1/22:6)-H 29616.63058 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:0/22:5) 776.5584682 14.33087009 1_Plasmenyl-PE(P-18:0/22:5)-H | 1_Plasmenyl-PE(P-18:1/22:4)-H | 1_Plasmanyl-PE(O-18:0/22:6)-H 36172.686058 | 14258.184958 | 12547.410048 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:0/22:6) 774.5432792 14.10398786 1_Plasmenyl-PE(P-18:0/22:6)-H 84089.63877 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/22:4) 776.5581456 14.15638291 1_Plasmenyl-PE(P-18:1/22:4)-H | 1_Plasmenyl-PE(P-18:0/22:5)-H | 1_Plasmanyl-PE(O-18:0/22:6)-H 61402.43823 | 16545.06453 | 16404.50503 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/22:1) 782.6050313 15.42432716 1_Plasmenyl-PE(P-18:1/22:1)-H | 1_Plasmenyl-PE(P-18:0/22:2)-H | 1_Plasmenyl-PE(P-20:1/20:1)-H 61579.59366 | 39280.71166 | 2402.86128 ether-PE [M-H]- Yes Plasmenyl-PS(P-18:0/22:0) 830.625824 14.26257321 1_Plasmenyl-PS(P-18:0/22:0)-H | 1_Plasmenyl-PS(P-20:0/20:0)-H | 1_Plasmenyl-PC(P-20:1/17:0)+HCO2 | 1_Plasmenyl-PC(P-18:1/19:0)+HCO2 | 1_Plasmanyl-PS(O-18:0/22:1)-H 868.04469 | 748.7235 | 620.844997 | 585.651707 | 430.576695 ether-PS [M-H]- No Plasmenyl-PE(P-20:0/22:6) 802.5744015 14.40643143 1_Plasmenyl-PE(P-20:0/22:6)-H 5567.36563 ether-PE [M-H]- Yes Plasmenyl-PS(P-20:0/24:1) 884.6766964 15.02624416 1_Plasmenyl-PS(P-20:0/24:1)-H 437.84156 ether-PS [M-H]- Yes Plasmenyl-PS(P-20:0/20:1) 828.6105561 14.15753095 1_Plasmenyl-PS(P-20:0/20:1)-H | 1_Plasmanyl-PS(O-20:0/20:2)-H | 1_Plasmenyl-PS(P-18:0/22:1)-H 361.5987 | 346.3329 | 327.4856 ether-PS [M-H]- Yes Plasmenyl-PE(P-20:1/18:1) 754.5715672 14.16512089 1_Plasmenyl-PE(P-20:1/18:1)-H 29595.49584 ether-PE [M-H]- Yes Plasmenyl-LPE(P-18:1) 462.2979736 2.639508114 1_Plasmenyl-LPE(P-18:1)-H 4018.96814 ether-LPE [M-H]- Yes Plasmenyl-PE(P-18:1/17:1) 712.5272391 13.89592879 1_Plasmenyl-PE(P-18:1/17:1)-H 8188.797876 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/17:0) 714.5424445 14.56140577 1_Plasmenyl-PE(P-18:1/17:0)-H 6529.08938 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:0/18:1) 728.5582521 14.05979221 1_Plasmenyl-PE(P-18:0/18:1)-H | 1_Plasmenyl-PE(P-20:1/16:0)-H | 1_Plasmenyl-PE(P-20:0/16:1)-H | 1_Plasmanyl-PE(O-18:0/18:2)-H 77425.169 | 17654.6928 | 14485.6313 | 12221.54315 ether-PE [M-H]- Yes Plasmenyl-PE(P-20:0/18:1) 756.5888323 14.24916775 1_Plasmenyl-PE(P-20:0/18:1)-H | 1_Plasmenyl-PE(P-16:0/22:1)-H 17580.9399 | 325.44848 ether-PE [M-H]- Yes Plasmenyl-PC(P-16:1/21:0) 830.6252794 14.75020909 1_Plasmenyl-PC(P-16:1/21:0)+HCO2 | 1_Plasmenyl-PS(P-20:0/20:0)-H 407.116727 | 54.278248 Plasmenyl-PC [M+HCO2]- No Plasmenyl-LPE(P-16:0) 436.2823867 2.519191775 1_Plasmenyl-LPE(P-16:0)-H 4908.11769 ether-LPE [M-H]- Yes Plasmenyl-PS(P-20:0/26:0) 914.7192723 15.79605889 1_Plasmenyl-PS(P-20:0/26:0)-H 98.84835 ether-PS [M-H]- Yes Plasmenyl-PE(P-18:0/20:3) 752.5581285 14.75962035 1_Plasmenyl-PE(P-18:0/20:3)-H | 1_Plasmanyl-PE(O-18:0/20:4)-H 39616.14298 | 10419.18378 ether-PE [M-H]- Yes Plasmenyl-PS(P-20:1/22:5) 846.5610423 14.74032229 1_Plasmenyl-PS(P-20:1/22:5)-H 545.56757 ether-PS [M-H]- Yes Plasmenyl-PE(P-16:0/16:1) 672.4956364 12.13318225 1_Plasmenyl-PE(P-16:0/16:1)-H | 1_Plasmenyl-PE(P-16:1/16:0)-H 37821.15719 | 7316.402558 ether-PE [M-H]- Yes Plasmenyl-PE(P-20:1/22:3) 806.6042992 15.14068991 1_Plasmenyl-PE(P-20:1/22:3)-H | 1_Plasmanyl-PE(O-20:0/22:5)-H 15767.09888 | 9452.11359 ether-PE [M-H]- Yes Plasmenyl-PE(P-16:0/16:0) 674.5112091 14.19107965 1_Plasmenyl-PE(P-16:0/16:0)-H 62846.29224 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:0/16:0) 702.5424448 14.84111277 1_Plasmenyl-PE(P-18:0/16:0)-H | 1_Plasmenyl-PE(P-20:0/14:0)-H 15890.442281 | 4464.259687 ether-PE [M-H]- Yes Plasmenyl-PE(P-18:1/20:3) 750.5427948 13.93211039 1_Plasmenyl-PE(P-18:1/20:3)-H | 1_Plasmenyl-PE(P-16:0/22:4)-H | 1_Plasmanyl-PE(O-18:0/20:5)-H | 1_Plasmanyl-PE(O-16:0/22:5)-H 30621.56206 | 9127.01315 | 8899.54485 | 8746.46315 ether-PE [M-H]- Yes Plasmenyl-PE(P-20:1/20:5) 774.5436257 13.55810833 1_Plasmenyl-PE(P-20:1/20:5)-H | 1_Plasmenyl-PE(P-18:1/22:5)-H 7481.526927 | 7259.174317 ether-PE [M-H]- Yes PS(16:0_20:1) 788.543556 11.90084167 1_PS(16:0_20:1)-H 17355.3464 PS [M-H]- Yes PS(18:0_22:4) 838.5583241 11.24785188 1_PS(18:0_22:4)-H | 1_PS(18:1_22:3)-H | 3_PS(40:4)-H 18146.06889 | 10282.145152 | 10010.48653 PS [M-H]- Yes PS(18:0_20:3) 812.5436129 10.60778333 1_PS(18:0_20:3)-H | 3_PS(38:3)-H 14758.4434 | 8086.1505 PS [M-H]- Yes PS(18:1_24:1) 870.6215602 14.75987798 1_PS(18:1_24:1)-H | 3_PS(42:2)-H 56239.11272 | 29496.72692 PS [M-H]- Yes PS(18:1_22:1) 842.5904744 14.28028004 1_PS(18:1_22:1)-H | 1_PS(16:1_24:1)-H | 1_PS(18:0_22:2)-H | 1_PS(20:1_20:1)-H | 3_PS(40:2)-H 51898.36513 | 39465.49333 | 34106.11285 | 29487.84993 | 29093.10613 PS [M-H]- Yes PS(18:2_24:1) 868.6066452 14.33762337 1_PS(18:2_24:1)-H | 3_PS(42:3)-H 14200.25283 | 12723.3579 PS [M-H]- Yes SM(d16:0/18:1) 747.5632201 8.251367722 1_SM(d16:0/18:1)+HCO2 | 1_SM(d18:1/16:0)+HCO2 | 1_SM(d16:1/18:0)+HCO2 | 1_SM(d18:0/16:1)+HCO2 | 1_SM(d17:0/17:1)+HCO2 | 3_SM(34:1)+HCO2 8308.5117 | 7692.2637 | 4053.091 | 4008.7201 | 3772.0886 | 3750.1657 SM [M+HCO2]- Yes SM(d17:1/18:0) 761.5801001 9.48975061 1_SM(d17:1/18:0)+HCO2 | 1_SM(d19:0/16:1)+HCO2 | 1_SM(d17:0/18:1)+HCO2 | 1_SM(d18:1/17:0)+HCO2 | 1_SM(d18:0/17:1)+HCO2 | 3_SM(35:1)+HCO2 19465.55527 | 18138.07517 | 18053.67727 | 17587.27707 | 17520.99587 | 17419.92027 SM [M+HCO2]- Yes SM(d17:1/24:1) 843.6563158 14.68982941 1_SM(d17:1/24:1)+HCO2 | 3_SM(41:2)+HCO2 10852.4235 | 10575.4496 SM [M+HCO2]- Yes SM(d18:0/16:1) 747.5637095 9.475787398 1_SM(d18:0/16:1)+HCO2 | 1_SM(d16:0/18:1)+HCO2 | 1_SM(d16:1/18:0)+HCO2 | 1_SM(d18:1/16:0)+HCO2 | 3_SM(34:1)+HCO2 44357.2424 | 44138.1129 | 43813.3096 | 43770.2256 | 43413.33 SM [M+HCO2]- Yes SM(d18:1/24:0) 859.6894622 15.52161606 1_SM(d18:1/24:0)+HCO2 | 1_SM(d24:0/18:1)+HCO2 | 1_SM(d18:0/24:1)+HCO2 | 3_SM(42:1)+HCO2 148006.2099 | 147864.3981 | 147856.85829 | 147808.29 SM [M+HCO2]- Yes SM(d22:0/18:1) 831.6575634 15.00393638 1_SM(d22:0/18:1)+HCO2 | 1_SM(d18:1/22:0)+HCO2 | 1_SM(d22:1/18:0)+HCO2 | 1_SM(d20:0/20:1)+HCO2 | 1_SM(d24:1/16:0)+HCO2 | 3_SM(40:1)+HCO2 68298.84162 | 68261.52561 | 68237.29895 | 68225.89283 | 68223.05564 | 68201.067 SM [M+HCO2]- Yes SM(d22:1/22:1) 885.7015263 15.21630705 1_SM(d22:1/22:1)+HCO2 | 1_SM(d20:1/24:1)+HCO2 | 1_SM(d22:0/22:2)+HCO2 | 1_SM(d24:1/20:1)+HCO2 | 3_SM(44:2)+HCO2 6009.2521 | 5709.2432 | 5701.40247 | 5648.69149 | 5624.114 SM [M+HCO2]- Yes SM(d25:0/18:1) 873.7035396 15.51893984 1_SM(d25:0/18:1)+HCO2 | 1_SM(d17:1/26:0)+HCO2 | 3_SM(43:1)+HCO2 14945.1718 | 14816.039 | 14773.6536 SM [M+HCO2]- Yes METABOLITES_END #END