#METABOLOMICS WORKBENCH andrewpatt_20200522_094120 DATATRACK_ID:2018 STUDY_ID:ST001405 ANALYSIS_ID:AN002347 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 POSITIVE MS:MS_COMMENTS The capillary voltage was set at 5.5 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 LIPPOS17MAR_01.BLANK.1 LIPPOS17MAR_20.BLANK.2 LIPPOS17MAR_02.POOL.1 LIPPOS17MAR_09.38 LIPPOS17MAR_04.83 LIPPOS17MAR_05.39 LIPPOS17MAR_07.73 LIPPOS17MAR_11.191 LIPPOS17MAR_15.118 LIPPOS17MAR_10.111 LIPPOS17MAR_42.BLANK3 LIPPOS17MAR_16.12 LIPPOS17MAR_12.74 LIPPOS17MAR_18.146 LIPPOS17MAR_32.119 LIPPOS17MAR_33.47 LIPPOS17MAR_27.37 LIPPOS17MAR_25.110 LIPPOS17MAR_21.POOL.2 LIPPOS17MAR_37.154 LIPPOS17MAR_31.46 LIPPOS17MAR_30.75 LIPPOS17MAR_38.183 LIPPOS17MAR_40.190 LIPPOS17MAR_62.BLANK.4 LIPPOS17MAR_43.POOL.3 LIPPOS17MAR_39.192 LIPPOS17MAR_57.155 LIPPOS17MAR_51.145 LIPPOS17MAR_52.3 LIPPOS17MAR_53.109 LIPPOS17MAR_56.10 LIPPOS17MAR_58.156 LIPPOS17MAR_47.1 LIPPOS17MAR_69.11 LIPPOS17MAR_59.48 LIPPOS17MAR_81.BLANK.5 LIPPOS17MAR_63.POOL.4 LIPPOS17MAR_60.84 LIPPOS17MAR_67.181 LIPPOS17MAR_76.120 LIPPOS17MAR_71.2 LIPPOS17MAR_72.147 LIPPOS17MAR_70.182 LIPPOS17MAR_82.POOL.5 LIPPOS17MAR_77.82 Factors 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:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Untreated | 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:Atorvastatin | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 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:141 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:246 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:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:Atorvastatin | MDM2 Amplification:Lower | Cell line:224B Treatment_Status:Untreated | MDM2 Amplification:Higher | Cell line:141 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:815 Treatment_Status:Untreated | MDM2 Amplification:Lower | Cell line:863 Treatment_Status:N/A | MDM2 Amplification:N/A | Cell line:N/A Treatment_Status:Atorvastatin | MDM2 Amplification:Higher | Cell line:224A AcCar(16:0) 768.8868579 750.29124 52987.88155 182405.0283 54532.96559 189189.8574 48901.30656 28067.18796 255419.3058 268560.669 1742.624959 65068.3095 30349.91014 50871.18499 152980.3897 124392.5478 191254.3151 218140.9658 49722.48461 20214.95661 96150.00815 33987.74431 41298.86918 32845.02701 1719.183139 60354.19733 44606.19984 18267.20365 40348.57393 39786.38038 120133.4946 68245.955 24083.10109 42859.8848 64078.57016 136811.0199 988.6453422 58485.72596 38606.44576 43750.33352 176068.544 40679.63456 53406.88586 53481.57645 59324.21485 40911.50327 AcCar(18:1) 0 811.252952 66470.04321 196113.2322 20373.18148 287578.637 30528.09821 41604.75705 340325.0125 342926.1252 0 62712.85749 18579.01018 121059.7077 250994.5346 214277.7987 281337.4416 310284.8851 62669.68472 30022.74074 253200.8213 19850.37441 32115.12332 38506.85621 0 62578.81836 53579.97046 29169.16439 97721.45249 23364.53165 376706.7015 53408.33766 29130.14759 38555.28077 67696.30314 249534.6295 836.3388016 71994.27108 25491.4023 27689.99305 278559.7332 40100.86169 117626.2109 32419.82869 76894.08382 16988.87832 BMP(16:0_18:0) 533.7504788 1510.650448 1412350.549 652439.0585 437905.408 695929.2669 440212.2993 2348229.741 2813426.714 2961669.186 1287.139851 1195730.736 580670.3137 1231725.529 3042326.641 627075.035 696401.0577 3732780.874 1216703.624 1194848.372 717099.2218 497513.177 2088967.15 3069789.178 1062.511037 1456587.455 3317540.983 1411283.597 823711.4944 1295769.459 4332966.654 1690920.973 1268870.011 2999536.16 1286089.02 738546.3673 1036.669069 1228863.838 313990.3464 2172048.126 2782493.096 1550377.762 1049405.193 2378066.69 1385925.536 412664.6832 BMP(16:0_20:1) 11346.8801 12900.10181 610712.442 288938.263 1006509.027 314126.1115 918858.7156 571595.2332 625701.1145 887592.9072 18526.2393 167423.6287 976054.3797 596174.6687 832860.926 256882.3321 295582.2008 893301.257 339857.3894 718785.8225 353652.8849 129751.97 142939.478 669132.6349 12625.12303 769487.1876 671555.4775 188096.7905 499301.1545 247895.3784 908280.4602 191959.8211 135904.7755 432834.0136 510654.3534 271014.2973 14473.26729 606327.9706 384511.4426 115184.2558 724301.05 189391.127 633493.8144 660933.9569 613527.3126 770351.52 BMP(18:0_18:1) 1913.41054 885.3541546 574787.1346 350367.0534 573067.0174 308166.194 530848.4569 1725098.515 1919096.587 509717.5145 1091.856326 622287.971 635777.5749 765175.2137 1607563.012 434784.6392 452317.8874 2127631.866 800900.133 616323.5384 363426.4836 300997.6937 387170.8915 1447418.215 1275.720851 691666.814 2303003.262 1383180.268 459168.988 693049.2131 2555655.806 1217057.821 1285967.141 2404211.707 1244099.353 396063.9019 1903.75682 810150.2217 112649.1121 1244399.187 1810970.843 1209540.997 636572.0113 1581515.536 720597.4805 482059.5692 BMP(18:0_18:0) 1323.170574 0 525281.6747 284618.2373 187942.4482 396564.8742 218456.2939 505789.1382 1720418.502 376993.8787 0 398368.2602 173829.7116 423190.3644 1404420.472 411901.5871 169266.7251 922688.5412 376794.2219 517265.6358 414988.5353 244190.2416 344955.4226 570897.8272 887.5924455 552717.1706 736046.2378 251388.76 176828.8451 352379.6374 587659.607 511060.652 479598.5253 1299840.981 635022.8372 453430.187 656.7068482 728151.3468 125425.7878 497882.1681 1970834.911 598347.5185 385484.825 695744.7602 717501.9385 142607.7806 CE(18:2) 1415.595767 2124.610163 237336.8026 172916.1031 31814.45826 164242.4367 29955.2633 59613.82219 245664.2461 390376.1808 1104.477747 296842.2249 20361.63112 14931.76339 564199.5347 142552.565 101690.5764 424664.1455 201824.9835 25386.10989 174685.0359 18441.64411 61002.09321 48352.62581 2253.934811 233106.0774 76519.8858 52368.86723 25499.94499 246469.9799 384591.262 268257.3441 95787.98359 319401.9273 345432.2067 111372.1661 2416.138453 342357.8782 31175.57791 69457.79028 370321.4278 447701.455 16937.63492 89254.92975 396952.0793 20058.02114 Cer-NDS(d18:0/16:0) 0 0 121586.573 23207.43897 51088.33287 19243.81645 22684.44252 106730.8909 18110.92167 11319.38678 67.66013124 253716.106 21008.78974 21549.20088 19244.32423 17546.02981 10187.0992 8488.179202 119085.5942 61720.99385 22637.7735 20412.36374 68581.32789 181944.2898 587.7971035 121093.2656 139775.2327 69893.57277 9096.791997 195362.3317 8489.693485 244676.7325 77033.33 225385.6878 213395.3114 18677.92912 525.0863243 90034.18675 39067.47146 55083.08592 19238.76308 257703.8113 21508.33333 73534.81096 96244.11012 33393.91742 Cer-NDS(d18:0/24:1) 0 0 25552.31352 7806.656021 15875.33273 5094.38668 10464.52825 25532.61674 12375.48122 5652.989404 45.46228897 26221.38495 8756.195028 17127.6924 9700.106263 10958.85477 4359.337699 4357.305885 23964.8187 58624.01262 5608.934408 10045.12901 10938.17819 29555.50714 0 19673.27578 34150.90931 56264.07891 5350.002918 15390.92275 8489.79863 47251.70815 77788.15883 32475.25157 37638.58025 10691.61634 0 17838.23595 15839.70416 22325.09071 12463.92412 22299.55638 18606.13298 27176.25661 17034.45824 14692.36975 Cer-NS(d18:1/16:0) 891.9427181 952.0694489 437794.5103 82714.80845 204556.0241 93585.93334 116024.1208 90811.28437 90019.92775 57157.85373 1601.125201 928536.5774 158993.4789 83189.44879 88287.53828 186747.4988 113005.9044 59546.74306 195442.9514 225805.7303 168807.7413 125643.5555 189307.0207 310031.1886 1386.411676 447725.0122 301036.3595 188489.1431 76475.15248 550170.0996 62254.52608 837320.3807 243588.8522 1104195.621 737111.5345 96343.58817 1536.887199 409572.3859 172184.1462 182460.9081 130284.5798 854163.3235 75270.48284 200166.6729 508509.7448 214232.8199 DG(16:0_18:0) 2015.281976 2749.823262 526395.697 348791.5124 588455.1225 574244.4678 295500.7581 522967.9207 642059.4794 478327.9196 1089.879548 598848.4892 557832.5108 879364.3104 390349.2965 529350.5018 691540.3868 418317.4995 487883.8727 513856.4233 472705.8824 434387.004 454488.0847 763104.7865 2494.775092 388571.4734 746390.1258 709705.8578 479127.0025 1019074.181 591374.8755 480542.4043 1018885.364 1164502.509 800537.667 931112.3649 1385.960053 434103.7701 652309.84 649966.3264 835905.7389 434720.8642 427855.879 591953.6758 585070.2735 478200.769 DG(18:0_18:0) 5726.440536 10018.39717 1281812.208 428846.7026 1839645.666 549382.2375 873186.9713 1571224.23 1252577.017 682986.7879 7156.239299 861815.6108 812028.336 1407549.584 1345153.367 863287.9907 838007.3156 719237.1789 1705257.649 1202999.252 835254.865 1157350.889 944563.2155 1084534.093 7637.762138 703207.0852 1271343.273 1469960.438 1538071.575 1496369.596 1085552.783 1175031.759 773260.5832 1008333.239 1501048.645 882333.4992 8458.235725 1637612.199 1486905.126 1017319.642 1772940.122 1672638.994 1266930.532 1767468.93 1412908.637 540625.727 DG(18:1_18:1) 665.1586752 0 65988.06603 142247.4561 37790.73535 63440.10282 49057.70417 58930.99674 57640.99231 65227.81521 0 22868.96689 56649.03428 105294.0884 64959.24342 133866.163 131257.3126 45046.73936 53802.65445 79792.62311 82410.77828 35054.68525 52220.52727 53821.35292 0 75106.64109 61184.69289 107207.8284 92970.33173 34030.79063 67334.55193 29606.82513 81222.94946 54493.33368 45438.37682 131466.1094 0 64113.19481 29708.43805 71385.11067 49099.0086 28788.60134 109661.5661 56883.55497 64354.4906 46325.38276 HexCer-NS(d18:1/16:0) 536.5468665 270.3586981 599308.5385 624673.977 754778.5504 552894.6015 632934.5944 115052.1852 61730.79636 62301.03241 259.8535964 352331.005 796290.9493 162275.3146 71875.97011 555623.0151 368543.2882 51501.37766 647371.8072 308033.7575 526939.4427 664045.7227 129478.9411 88289.49429 911.6389042 464716.1146 109227.6985 314048.9089 176111.3457 408702.2213 80936.92402 435681.6656 459795.5964 501363.0935 508966.5111 656860.31 636.2088066 598936.0491 597969.1551 103488.7731 66278.7681 492534.3111 150449.5917 113014.4971 630336.2388 644266.4639 LPC(14:0) 0 0 96336.15408 39069.15814 226836.9343 36131.72285 156700.1719 40836.38567 172714.9264 140003.3619 0 134332.1586 195893.2039 63613.09235 182622.1498 90114.00781 31596.071 131766.3261 122728.6874 84047.73956 97938.85165 611478.0506 355340.2715 381894.9673 808.8754109 133205.3335 79988.3448 58517.91755 75585.66619 111634.4188 186991.6581 82970.6461 53453.30732 125123.739 151381.5674 103277.1418 0 138425.7622 289971.9613 510401.7831 180342.7143 109818.1298 107926.5121 236414.6813 143920.1462 510406.0055 LPC(15:1) 2222.627193 1170.50737 128678.2809 66164.6887 364451.8796 80338.00426 157176.3951 90572.68172 144349.4182 109268.3609 447.4746758 204765.0434 365340.1917 226046.401 131222.7432 132841.2729 62922.6107 122181.2538 147122.8989 217994.6531 167265.0475 501004.2975 363137.6168 262226.8618 1183.491832 163522.9883 112038.2536 164707.7265 189083.7795 114028.1868 165163.3003 119143.6211 156999.7337 153453.9436 199981.5315 141347.6684 396.0165833 166307.1283 284708.7348 473878.1984 140868.3791 171578.3759 309022.7536 268444.567 147303.4162 683586.647 LPC(16:0) 1215.3174 4675.953262 1831446.25 720354.5427 3761427.498 738550.1267 1529210.798 2094590.265 3488932.062 2087375.835 3079.607723 4689680.273 2570418.932 1448703.58 3425674.28 1650077.593 549089.7352 2258850.386 2172969.112 1650780.312 1866091.938 3939817.743 7336504.15 8646805.821 3898.565046 2270426.625 2660186.531 1174587.595 1031546.24 3073017.664 2902666.824 2920981.344 926313.0915 3084201.88 3981816.378 1800973.634 3388.191566 2254260.445 2764688.418 7809365.419 3935175.168 2865056.012 1393910.672 4446153.287 2174675.256 5083615.888 LPC(16:1) 0 0 19895.99171 4528.627759 166307.2826 3395.402981 62293.08553 31694.63685 32234.81289 18654.1083 0 41247.97506 65177.61136 24782.69684 33889.14659 18262.90263 3942.743441 18229.01396 40412.71523 25978.76953 25449.26664 169087.6482 210040.4028 287013.6237 0 33897.12472 45186.22037 20241.01589 21294.44822 35558.86734 15341.45377 22344.04743 21898.97114 12261.72647 84024.39096 24697.78042 394.4676332 41104.54767 119639.724 265155.1491 20138.39017 29688.3375 33826.27333 130886.0112 32910.60246 205827.8357 LPC(18:0) 606.0614426 3171.381602 1648385.515 563829.8259 515496.5483 626570.6388 284916.0964 889697.0813 1883504.534 973992.6582 2250.131023 4830282.392 391470.4305 195044.8565 1906948.413 1017601.871 450904.7347 1082615.406 1964284.802 642924.0528 1090604.473 411394.1907 1251575.955 1454255.255 607.401259 1972946.198 1139402.599 566630.375 165950.3965 3251721.236 1333286.607 4184638.609 570216.018 3716850.481 4454052.078 1048454.342 2345.436506 1893397.415 431037.4774 1387098.678 2124297.083 3275665.764 222345.6796 1148363.808 1925460.989 646689.9966 LPC(18:1) 2997.25074 2137.391456 1419860.482 1145448.457 3179458.86 1090163.824 1244213.975 1967547.405 3638830.377 2546008.599 3599.640463 3625793.885 2298875.584 1827525.31 3459450.235 2834657.259 792006.7139 2565698.925 1991430.486 2557093.12 3100605.133 3228682.3 7549831.68 8307944.923 3144.467021 2117557.849 2385713.432 1718545.854 1389562.197 3490972.331 3379034.088 2183554.197 1196580.038 3041834.227 3858325.132 3191085.309 4139.981554 2023078.132 2358130.171 8175507.421 4098084.898 2733204.654 1988774.323 3992944.029 2075616.92 4551443.883 LPC(20:3) 0 381.2231116 55709.91855 14396.24276 45173.95043 10487.5118 24093.71483 46387.54204 103801.4805 81161.43368 0 130668.0506 37509.12865 28467.65153 70833.4546 30819.3897 11185.53631 93114.45745 51440.51142 44763.37622 50294.72826 69587.64946 139757.4368 220411.9878 387.2037262 64134.38372 55110.45266 29903.44119 15636.19426 96333.8305 84073.38586 58821.40088 21353.65047 40290.39081 82942.71794 50109.05861 0 65637.23775 53611.82941 172704.2608 108373.0768 80775.15904 30344.38061 84969.87385 61227.20073 55295.80271 LPC(20:4) 0 0 154150.8453 31124.8922 138290.9435 33495.87922 48775.16403 109062.3405 367162.4231 231321.7159 397.6842524 441161.2153 73690.96078 35860.47895 330344.6649 88841.49572 18314.5363 225509.9689 178255.0669 102169.8977 78757.7004 141251.3413 88004.36763 535089.9508 0 179321.4029 152821.4795 73693.49994 27968.56816 371638.3849 336529.9509 234477.7672 57910.47663 382679.871 402209.407 87838.80673 786.8335203 197008.3694 95853.70148 433422.719 393826.8277 269914.5177 41730.83927 217735.3386 199420.3657 199467.0025 LPC(22:5) 0 0 7130.366715 2817.217627 10842.09598 2829.869794 6401.149138 11324.89966 15847.75083 7888.628784 0 18112.88807 5631.154188 5208.219185 13076.82518 4784.112186 2262.909698 7923.762111 7353.655835 12888.98722 6194.630244 15410.83718 118843.4957 56016.47505 0 9617.343956 9717.721824 8916.843092 2954.934293 11885.89365 12453.16547 7975.76014 7356.973997 13018.48952 16971.74862 6197.160181 0 11886.25353 11170.04192 35800.4871 19808.73718 13582.39022 3731.902654 20729.40721 9621.77482 18426.97838 LPC(24:1) 498.1706931 0 19792.91196 12355.10336 18316.93619 9105.842472 26705.04568 34318.1228 8011.82588 7298.332019 0 11218.95219 21106.80156 34921.50304 9361.286443 11144.65438 6255.603083 9075.207812 25722.2783 17712.99304 8866.800863 18985.7159 52878.63457 60714.57564 1022.453666 15032.97034 38572.24685 16535.01497 42085.7873 12223.66071 6228.915282 11275.33385 15205.92009 25735.16908 13164.72838 17537.99724 0 19566.16625 15451.15491 50615.3291 10387.39816 22904.55698 42014.14121 81954.42793 18222.99969 23806.16667 LPC(26:0) 129.3276156 426.1385543 111114.9741 85073.70747 305483.0622 86941.49679 319952.3941 55011.4439 29635.91783 28387.23088 164.6790295 21744.22405 410650.6977 122593.5954 30924.70175 49037.67368 27741.98642 24947.98771 162498.124 47585.11398 66588.68497 310132.2934 267603.6444 228014.5475 733.9118369 150461.1299 256689.2008 41791.22173 74102.68243 23150.47502 43805.54308 22658.10474 47583.88674 19580.3906 21302.4727 70134.3756 168.8301527 118051.457 309777.1112 308289.1615 22171.1453 32987.30948 95008.80789 342325.3823 111265.397 237852.5752 LPE(16:0) 388.4330608 0 22760.24207 7577.940544 75091.69187 8564.581987 44440.19707 12782.25011 18439.17493 14147.1485 0 18079.92622 70581.01118 19487.01697 15808.5729 11004.37408 6748.278299 9261.829766 26708.12629 24225.21546 12370.76809 80972.94917 45634.73374 44139.84314 393.7916245 25142.48558 12513.53046 25449.13198 15825.20395 19974.1076 17621.06362 13736.96409 17058.94279 22184.69562 27607.51694 12871.21226 0 21173.27351 63370.20055 53659.33257 16934.86793 23842.61058 22946.29376 35571.30828 22120.1415 197803.1082 LPE(18:0) 822.0537986 555.3219731 165473.3029 105490.7934 345714.7934 110772.7286 194903.733 58035.89627 112767.8119 90681.46998 417.3771729 196550.4594 625003.283 54507.62358 97871.72205 117527.3331 86357.85074 99698.10056 178161.163 85030.52641 135541.5383 351056.0581 150891.1092 164359.2802 0 184218.1308 46183.84054 69930.64611 51486.11803 233046.2486 134271.0628 182135.3776 95319.08591 199422.6783 213720.0004 129812.5739 0 196543.2981 279762.3069 234202.0123 99585.43342 217556.5563 67791.96096 158884.5446 185144.4327 490471.1583 LPE(20:4) 0 0 14149.56061 8451.853223 27189.35375 4436.649793 16590.11366 9814.58748 22640.88239 18592.07539 0 26033.46224 22979.55626 10071.02638 19897.66271 11034.60782 7357.73881 19243.69262 19800.53545 8095.663594 14078.72492 43679.75318 25580.52686 44104.8567 0 20932.57892 10137.4086 9688.913822 10055.77949 22074.10642 19808.47172 17268.1584 6197.665869 22639.50114 15775.54311 16337.5271 0 21506.2535 27963.34438 43813.84243 19809.03609 19243.43148 14252.94958 25260.22554 21505.78247 139779.6412 MGDG(13:0_18:2) 0 634.3008893 417177.3722 229204.5991 269442.1507 281255.6694 572060.2075 330352.3062 209031.724 173589.0254 657.9163306 213320.8211 343025.1211 554333.7707 215500.6919 332777.7793 260723.9776 136636.6267 380338.4045 477937.2399 472257.1111 260421.7036 172879.587 228822.2406 439.9026955 524566.5295 231762.6014 523291.187 974911.8964 236602.2305 285574.1473 178789.7763 452048.7701 80590.17442 191761.6339 400451.5073 66.41205323 403147.1685 288386.6373 291495.393 183422.4236 189760.0695 1569958.378 181272.1758 353011.2947 477400.8023 MGDG(13:0_22:5) 2881.449575 1366.13831 313566.7677 64922.92424 585890.4234 77462.54328 366589.5275 132699.3788 328560.885 210405.4174 1042.765176 501369.0915 173661.7146 224074.3256 288731.7962 46914.98473 44201.10035 250103.3098 456066.3309 144861.8795 38007.9361 246982.8976 215950.57 177783.0961 2691.107269 316317.3656 157512.6178 84014.48593 120140.1058 608299.8967 334374.0424 534997.9126 125885.5486 91827.16078 460821.8859 61646.73907 1623.556221 366178.9272 298494.422 189642.9515 347206.9455 591233.1451 91370.77524 163291.3015 226624.3378 213851.1723 MGDG(15:0_18:2) 708.9337959 0 69972.99639 250564.5345 98762.96616 128198.7936 87939.07069 49340.72099 96861.39617 92735.36499 0 74107.71983 124890.4286 391982.85 81410.66458 233657.657 124426.1266 60989.79651 95788.87978 386893.8522 219948.4382 87134.55644 90136.27994 37597.01322 0 117559.0304 52878.10271 171185.1144 188304.8316 49800.23759 133196.3539 50695.18289 251024.2824 23205.35974 50996.53477 256401.6922 680.459045 104988.8839 104389.1663 88563.96207 43930.02632 36257.20691 362275.9628 76278.60107 74156.35198 52874.81775 MGDG(16:0_20:5) 554.0386637 98.73714229 367238.6578 303839.7405 154649.262 444811.6045 220311.0291 135233.618 705243.2018 622732.3235 540.5190563 175653.0225 261591.1696 526931.284 997069.8242 256683.5066 60195.71427 634184.7751 610445.969 1112779.776 381297.8989 181101.7568 38942.09318 304502.2313 34.49843633 491067.0413 961643.4078 830310.2686 155769.3718 585415.4536 1210828.206 234299.2667 931561.9452 54992.06427 556591.6312 336801.2985 0 409790.1943 205560.5765 442104.9138 466760.5784 352414.1969 277709.4509 498844.0609 388903.4287 88807.69212 MGDG(16:0_18:3) 0 0 10319.05332 27498.31064 18878.34876 36046.55787 21756.72484 10477.64561 13569.71011 20014.58379 33.9726368 11413.68474 23169.48245 51984.9214 17680.22068 20966.6832 8115.753359 12703.04817 15557.94678 49222.28543 32061.70645 21523.15763 34239.66057 27562.4998 0 12635.82985 18353.77051 26182.37178 55956.12988 7410.024264 21196.41485 9057.186995 78411.75445 4006.580005 10733.60073 22157.66631 0 16515.91595 18401.21754 25503.95574 18173.32827 9051.193597 57410.19515 26560.9459 10220.8858 11925.48643 MGDG(16:0_22:6) 378.5891872 428.1425888 112733.1749 136864.9913 238827.8105 112671.182 219127.5529 237858.7374 82518.60527 366933.3452 469.0062364 151189.734 201140.16 398579.4032 456167.0974 142649.31 49808.05418 379023.1111 199812.6732 1222182.673 152610.3067 180369.1048 460002.2292 636835.9673 172.506488 250909.983 650366.2154 643882.4847 463460.4144 74470.45262 763657.0377 101679.6485 1318570.084 54236.40152 197603.3684 150304.2149 100.8319432 264789.6028 192235.7426 460850.3094 530999.185 168057.8269 526635.7442 493924.9271 246557.3747 175162.4786 MGDG(16:1_22:5) 0 34.07784348 39202.00733 37637.24029 53110.18962 34520.87902 83210.11931 129654.6112 59575.08654 94955.68659 98.83571794 55469.37541 80051.40757 246351.1118 69495.39778 24036.34789 12476.28263 51827.63803 81186.53031 407727.9847 40441.70226 67494.77909 463833.6648 430852.8069 34.12071556 70891.09155 508325.726 289790.3312 128896.8634 21264.04282 102218.4145 39268.91796 396041.035 28246.46349 43339.20689 31584.66516 0 75405.60952 93539.78595 456713.252 40043.7235 56172.73712 214425.5554 475896.5052 52901.60507 38063.1049 MGDG(18:1_20:3) 0 0 218046.8967 102842.3209 65718.96612 80711.50673 83224.30135 331891.8195 481682.0807 449766.7559 0 314986.0326 107757.264 112202.5912 288711.6866 53048.01422 32485.02848 488280.4575 217538.1004 176441.42 87856.47631 74423.52401 190813.0408 411187.2363 0 274842.5254 359794.4318 147147.5297 55328.53832 274727.9715 799775.2553 267613.4874 124222.7039 101770.1656 174993.5487 63811.71994 694.0429321 139831.9474 68854.44511 209762.2228 467196.2553 189935.1172 96665.63955 222074.1733 155423.8259 50765.9824 MGDG(18:1_20:4) 0 0 38223.63859 14560.23402 39131.64449 28203.46103 42151.55229 143398.3233 171115.2857 204398.0354 0 39325.46516 32291.28119 119488.4797 195945.2451 70475.31468 3394.137331 78886.52462 75919.99359 225493.5343 49474.59017 27378.55317 99008.36477 105699.6901 0 73785.58833 172778.509 98097.01383 88927.47132 48468.87867 230009.501 50227.10811 257399.6695 23211.52533 60029.29442 50441.16518 0 52290.67565 35041.98229 76680.24051 169606.6564 65365.91026 54817.78529 74527.18591 55159.3846 22737.72043 MGDG(9:0_22:0) 783.1363399 11922.20983 471591.4131 435394.4858 123365.8579 470733.1211 497164.1595 439614.7953 433209.2813 406518.9604 13754.11126 394287.6758 144092.7921 544540.3153 295472.4072 419197.5182 365509.588 373618.9934 544472.1689 456507.266 383667.4584 134752.5869 497382.7451 389143.4704 8672.072976 503959.9696 236383.9615 430815.6799 432286.4202 524676.344 482411.9321 335154.8786 426436.148 287237.5454 343853.6741 413214.3788 9447.19044 474008.3773 604227.5025 441531.026 345511.983 408468.7489 479387.3564 463478.821 409160.0503 450651.3967 MGDG(9:0_9:0) 0 0 332712.6425 147816.7996 118108.2984 128294.4519 91242.86933 221967.6908 361330.4901 270809.5768 0 1169749.874 80435.92832 41976.77237 411657.8144 286745.4022 112005.1158 206624.0431 481098.3889 134978.2449 314641.5804 83948.76433 422595.3293 181741.6698 0 363980.2271 217819.9201 154615.6402 47084.78487 660983.1483 380153.355 883954.4853 109359.2397 306593.5261 1270532.883 229201.1649 0 600172.3369 110714.7358 292441.3349 329908.5656 507349.1156 38154.62485 291895.8054 339737.4484 109306.8889 OxTG(16:1_18:1_15:0(CHO)) 0 0 16808.95751 61929.61646 26537.58936 8187.672865 22491.00048 9383.65979 22790.74493 21451.52471 0 14139.41382 19127.81783 38805.59287 25295.79 17245.0915 21028.27248 27671.90099 12718.26943 10703.64274 26396.06519 25392.5876 4149.489066 8941.363517 0 17486.24842 7989.159419 19857.23416 30094.12055 9285.543353 27784.82625 26953.63608 10125.28129 98806.65 13983.63854 43622.3224 1121.934271 16656.77653 10250.97303 4226.891538 35045.48558 18125.29948 26928.9946 8398.721142 17870.14392 47446.15548 OxTG(16:0_16:0_18:1(OOO)) 5547.104246 3843.858662 243452.1913 370760.943 189900.6565 857492.7948 143555.8802 178087.034 341325.3037 116218.0337 7731.604061 128189.3928 174269.0437 723884.3421 232296.295 472441.142 361726.4419 371637.3294 243555.9349 311394.2129 822927.971 185818.0565 41929.64784 129858.273 3056.623104 253153.9856 193869.9393 384132.624 626675.0517 214656.9592 109434.7251 399130.0046 376624.5362 182589.9139 294685.0671 526938.8374 6794.28947 172610.9775 119158.913 46144.07962 277274.1352 359059.8307 780684.6614 84332.75583 238774.5656 180122.3586 OxTG(16:0_18:1_20:1(OOO)) 0 0 70720.70142 76206.66122 42794.00787 95245.36378 30981.19769 41762.99271 174146.1712 87641.4975 0 124003.0366 48600.81627 181207.1856 147790.1763 66169.63551 95665.59715 129318.6494 62635.60109 103094.8323 88034.63876 42248.66821 8440.739571 57326.59266 0 109278.9605 57911.5166 87431.98587 119414.0795 82788.65191 173242.256 169700.997 66921.78803 224736.5616 110623.4228 77469.05727 0 61818.62934 31781.41703 9334.749612 275502.5058 159591.5523 187670.1597 24715.224 100134.8575 33263.36131 OxTG(16:1_18:0_17:2(OH)) 699.6038605 0 96795.94237 184919.7293 65006.54895 227879.7206 92043.64811 38947.56322 178423.4617 102172.8366 1113.885997 55669.57065 116896.4838 186692.9276 144494.544 280454.9267 360940.6027 90802.34292 80296.72753 89954.93782 309269.5692 82114.73174 21789.88307 35736.01945 0 73306.6482 76547.37818 235535.3901 166929.5356 38689.7022 95103.16047 76081.23876 79840.24269 487081.4595 45827.79143 157232.2682 0 71725.13882 72187.08756 13104.13214 214306.761 105644.1755 278441.0505 43889.17057 94459.55856 152265.9014 OxTG(16:0_18:0_18:1(OOO)) 705.408542 3171.619393 207517.1318 269844.3521 145390.6269 333773.6928 105052.8363 134849.9543 657887.7878 269327.5335 2888.834742 385435.6437 93411.15672 586394.2577 433095.2691 529186.2085 360609.7702 313076.1419 157478.8974 344917.0822 416738.5349 130491.8066 35075.15781 116301.9554 1888.644439 146083.859 148619.6374 254691.7635 492300.7548 181332.2077 419949.5131 373033.9526 271313.0431 623927.5576 294883.1186 160340.3404 3749.442312 169485.2293 90520.1254 41928.74648 556830.5121 270273.1669 740722.3459 40564.43957 241587.818 121730.6089 PC(13:0_16:1) 989.9098685 746.4606146 635425.1527 186212.3278 1280892.334 231535.2852 988510.3022 354084.8524 244577.4284 220384.4465 826.3107334 136613.1923 1729268.68 555435.3291 203785.4002 230613.6116 211171.3541 199943.2695 684759.3327 428367.9881 247135.6541 1205268.4 497073.0972 290399.7519 756.8467624 446581.0089 457952.3992 383225.4455 546681.5498 182218.6765 235820.4107 173649.1472 421388.6412 313198.7578 143661.1196 249721.0281 1081.227427 476737.6618 1022242.19 546335.5007 222564.2311 204714.0647 661477.2353 644340.7239 721575.2819 1298893.026 PC(14:0_16:1) 2195.493728 3798.915979 3552864.156 440834.1672 10206540.32 461379.1842 10574783.27 1047615.513 890448.8354 852614.4072 2439.022838 290173.6954 11375823.83 3077625.77 881273.1613 525763.5708 138207.8189 758463.2675 4100041.822 538679.5836 88614.47908 9770760.54 1745331.08 1473138.988 3244.801494 4316759.6 1646783.823 547649.909 3706940.317 508960.4725 1024428.972 865441.4228 510319.7925 1772499.54 889140.1119 426714.8637 4137.398598 4321513.84 8974145.12 2331250.691 976775.4187 1134505.325 3416529.075 2130800.327 4251028.859 10610819.87 PC(14:0_14:1) 503.0590983 287.9063234 67057.81445 4421.641102 122262.0236 4080.885455 132252.3167 3314.649945 7928.232501 6541.245501 253.1268984 3922.867184 172652.3613 32015.98404 6628.009609 3610.690048 3725.657283 5165.505906 85076.14489 3924.917335 4005.572933 139013.6326 9669.53147 7335.296036 0 89855.87689 6968.302011 3339.446622 30292.31893 4320.988364 6577.122 4486.650185 4483.893214 8809.141439 5790.128746 6478.691265 34.38019239 83413.36863 114084.4127 11150.7472 7026.920388 9580.188238 36135.84351 10558.38499 87118.76175 190946.838 PC(14:0_17:1) 1719.860968 1553.993744 633776.3259 96998.64404 1458255.261 86911.21053 1327710.067 451967.8313 129786.4779 140707.3755 2051.463596 221925.5911 1447140.967 228003.7989 128737.5292 76286.00441 71081.9694 131514.2924 620022.4276 126143.7759 75765.76489 1275334.251 856441.5722 534458.2785 1227.362694 631532.9405 630082.2241 135112.5986 284252.8109 201712.0734 179759.1514 282471.8786 117066.2873 354818.8729 274168.4218 80192.87927 1099.940979 600691.6535 1173936.611 912933.8116 144301.753 267748.557 173433.3077 1057535.501 676982.0807 1357536.377 PC(14:0_26:0) 810.695854 0 104519.3813 164748.062 274362.6277 126738.7212 208506.3173 78741.58563 72762.60461 111445.8782 0 10086.26775 265099.4666 102646.3535 105179.8009 66200.23544 93834.25548 98623.76444 129739.5359 39332.59295 67047.877 213961.0598 94466.34803 88174.7572 0 99974.50419 67256.08149 30415.89372 66305.76098 13251.02959 162101.8808 13157.7758 33145.86847 25516.69851 8592.231739 70247.26773 0 85726.88252 176291.2858 135242.1888 89646.38201 10917.81723 69383.73109 125155.062 102336.6629 281474.5301 PC(14:0_20:4) 886.1833471 746.645037 431770.5165 85119.95769 457324.8576 98557.31638 469067.2127 218825.3596 485059.5732 503601.7793 823.6302591 485503.6262 557713.7468 400670.7212 493919.6134 90474.86377 106390.0109 458819.6169 379310.3233 97448.77345 108352.6064 486350.0527 244316.4302 295825.3161 1429.4272 639064.0234 311460.2003 115926.7276 384629.2525 462782.4106 641824.129 557932.813 108037.4942 925192.609 541458.7871 97973.86394 267.5047757 515874.7613 398640.6814 282385.8538 461678.7833 607648.3581 341824.6714 302909.607 662924.5248 454671.1216 PC(14:1_16:1) 1273.382213 498.1717175 198904.4157 21051.52344 374754.5335 29373.64393 412057.9253 26212.60012 27551.74774 28017.62 291.3196174 19336.60681 536317.9391 226441.867 41864.60583 28087.69958 20400.75954 26595.93878 254370.5408 10277.85254 33072.92542 434841.0412 35360.87226 28778.11728 0 252523.4333 39116.46124 10096.86256 209143.6569 15216.9508 31521.08138 16729.02713 12473.70844 16279.20055 17016.9745 25096.2517 799.534359 240730.4333 328509.7017 35698.55033 26712.4392 19298.87186 190247.242 39956.97006 236053.2131 158054.3771 PC(15:0_18:2) 2873.360179 3766.496332 832400.8688 442617.6615 1417070.234 470143.4188 1443178.902 173500.9822 396290.7695 345043.1931 4372.458255 385854.1654 1507437.356 576964.5736 358596.1231 369448.1608 307927.9293 400844.1385 686996.0295 164732.0737 375751.9423 1385645.342 920183.4057 901274.9988 2083.812493 944458.9845 968316.1135 173246.0371 654473.6809 354565.3419 484240.5451 347780.1865 182844.5288 476858.9808 359473.3049 303359.8471 2725.929616 892866.7671 1132730.788 987697.3119 422202.1622 394711.5815 634298.8083 1241985.85 916487.6531 959002.3438 PC(15:0_22:4) 1804.641125 1685.215221 76319.69277 62799.90171 131020.3546 50051.78109 123137.4613 63330.6276 86853.79098 64599.93993 2707.203772 71577.70901 153710.2528 48423.40002 84777.10804 59081.87346 48961.78114 72669.78113 94353.88817 53866.76608 44784.1139 140517.0178 74854.15541 75808.50186 2007.110661 99030.49776 74000.063 60033.85956 62106.88044 79619.43691 115351.986 102067.9003 58525.1218 113694.1872 81819.66793 34264.47127 411.1532446 89221.96625 120780.6356 83897.25287 96963.31135 72200.88679 62733.13697 87217.99349 101037.7827 119868.7266 PC(15:0_16:0) 1893.067584 1271.182129 874866.8975 632924.3599 1290946.979 647865.9692 1061994.837 735228.8606 315119.8693 292789.1098 1868.102178 322093.8396 1217762.625 455486.537 331816.1429 593824.3849 587864.8028 301937.8854 1016102.761 314609.5573 602214.5387 1118634.816 1131019.261 878309.0453 1377.790302 975710.4813 961183.4449 287860.4683 350047.6929 325764.6379 374106.9274 290576.5431 292756.6344 278666.5155 284535.5037 545572.763 929.8090666 957509.4332 1088591.486 1381826.668 286428.6035 373820.0433 430495.6004 1419206.931 906111.7827 1193232.927 PC(15:0_16:1) 1658.391239 1248.582456 1368333.503 214754.6343 2472824.089 263877.7308 2287694.808 710962.5521 211623.8796 190975.5276 610.5879775 214370.91 3082301.616 787675.376 217529.3655 185618.0841 201278.6965 181365.774 1438887.882 150502.517 219259.1953 2364029.702 880542.5129 785850.3187 1225.273139 1447527.489 975313.913 154621.3848 617631.8178 208925.895 262224.0748 208528.3841 145875.7123 230034.4757 194940.2726 219552.3112 1376.62992 884974.7981 2157363.471 1021302.762 177838.4079 208724.0836 685052.2055 1137044.223 773149.5184 1478135.492 PC(15:0_22:5) 7202.828258 8964.819593 558877.5093 204474.5675 923983.3777 221369.8604 775863.3288 224505.7892 246361.0695 301344.3477 14468.8718 364896.4244 967228.282 335354.769 191879.171 189668.9224 237955.644 348965.2574 651183.9279 215664.11 225127.4381 824181.701 335052.6705 244234.2952 7182.241006 471312.0866 282920.5924 151043.6903 229811.5053 382141.4766 368044.4222 458207.2749 213703.1038 295238.6034 442954.6639 178238.8403 7142.385671 510660.5832 710402.921 329986.2299 272887.1286 548173.2537 260199.717 337442.0405 531047.7671 731608.522 PC(15:0_20:3) 1881.587822 1246.643103 1157698.046 715343.7514 1402860.377 826923.6968 1451130.093 429978.9782 738026.1926 1026486.094 1623.534077 1048673.891 1493211.294 382921.6258 709457.0027 698928.0032 638726.3816 730492.6636 1174492.303 467688.6288 587678.5232 1468591.772 644069.6535 577495.4385 0 1166696.689 567594.0544 558059.6401 699660.3467 946777.529 821644.5753 1024556.415 496647.0698 1422979.81 1044508.102 617552.373 3271.536251 1117621.95 1142422.787 684254.29 721556.4158 1409170.22 780880.1845 648092.0963 1271198.347 1221121.001 PC(15:1_22:5) 809.0661441 0 184010.6979 22144.12662 130810.6191 25009.70618 131402.9121 77931.89346 57284.88415 58795.87388 0 282614.9865 147779.7661 183968.7008 74141.72155 22711.0475 24405.43183 43636.67781 231968.5345 82623.88774 27891.7692 130785.9021 78101.90931 131277.2146 803.7427962 205980.5414 159689.3741 70121.37286 130879.998 341967.6439 65879.47675 313446.5485 99616.10856 557948.8052 58097.91395 26626.52637 0 221807.6727 101871.2285 103453.3492 52870.56146 391171.8897 152712.2614 104779.167 228007.871 131926.4504 PC(15:1_16:1) 2023.478563 970.66105 1083342.039 200178.5933 2740992.675 328258.6805 2738817.911 687707.2171 322994.8843 321851.4096 1319.569791 331443.6158 3264280.916 4074892.047 204687.3771 290997.6694 1241388.001 414573.9549 1171363.587 877520.4975 344942.0371 2858557.859 873608.7647 676035.1239 1512.362606 1184469.81 839186.9008 884488.0074 3508997.986 402951.6851 180577.8665 359360.2916 776746.1054 505562.9753 285629.9711 391360.0454 2044.141224 1052805.728 2376784.466 1053123.905 317923.9325 316967.8808 4297885.214 1112636.844 1137882.764 2858954.108 PC(15:1_18:2) 2149.258699 862.3964202 1013568.166 3814559.334 522068.3826 4626609.927 942427.6115 330380.2079 564569.1452 868275.2679 2059.196597 484644.0959 1181623.46 1418092.126 816188.6101 2784196.351 3846571.729 1024814.404 1107703.556 497630.5808 3235813.886 1026360.284 332060.0958 402827.7993 717.5934884 1087790.231 422712.467 470628.8883 716430.3628 689993.5697 1276749.476 679057.192 344400.4417 497347.675 587382.2534 2717508.15 1269.835535 966808.6528 845552.8328 139287.2249 615011.1963 742999.5189 1351822.413 603334.9083 949098.1053 1033333.964 PC(15:1_22:6) 366.6293391 543.1469498 442747.5202 53743.6578 819783.6581 78976.08351 847640.9817 412892.2266 125809.9293 124376.2233 793.1183019 239216.0749 843496.7306 1086863.728 127547.7729 64613.87849 71896.82181 118371.3906 430273.9174 399042.4952 72171.13218 903377.1289 408268.2672 510865.3153 711.857823 471335.0847 664121.3432 284383.4356 979681.8416 224822.7528 145136.992 267976.2156 438195.9977 350094.7986 257861.0735 79381.17001 387.2490472 457992.3047 685943.0783 500401.043 121510.9489 302847.987 914224.4438 560221.8377 368825.1368 442687.8733 PC(15:1_20:1) 2417.972299 2339.506875 253613.1693 337661.4179 501931.9554 76627.73143 218380.9859 223171.27 187344.0432 121950.109 4058.18334 113951.7827 533795.9399 733216.9708 217584.731 315755.592 347894.6579 78643.63225 367382.1796 217684.281 302741.9178 498486.1268 278684.2237 283935.8471 1701.784388 384355.2485 79916.98151 225075.7344 583314.0931 250671.9457 287754.8649 227554.399 194550.3605 67352.2212 230369.3947 117462.3309 2743.528101 213287.2561 399574.1261 250680.2941 180580.7105 163759.7439 665566.162 352012.3946 330683.2336 200054.1324 PC(15:1_16:0) 2144.824842 3852.628986 4392364.164 1091360.614 9528986.916 1373587.526 8442373.406 1566155.162 1243165.894 1229351.626 3793.403494 1481296.446 10321293.9 5812074.435 1193357.341 926694.4232 1560235.689 1340410.492 4618456.166 2717350.155 1107318.545 8657455.602 2667973.972 2184600.933 5363.645409 4299548.532 2446531.225 2612945.354 4898151.091 1834839.862 1502112.956 1595072.363 2532180.806 2020503.752 1552697.511 1119055.71 5775.003116 3292583.436 7859534.146 2967853.881 990651.0454 2015980.814 5761363.176 2994221.1 4169818.035 6224074.46 PC(15:1_20:3) 1711.897724 0 406708.3191 168745.8051 360061.1932 184236.5489 327338.4324 134468.7103 183199.7853 196943.5383 612.153117 337429.6203 406883.558 404563.9533 197617.3478 192114.4979 59024.92064 240216.7342 324976.5336 218987.9782 194206.8741 365503.3775 192467.6233 192310.1805 568.0958732 454360.4556 157671.3355 254907.7432 358201.6332 313917.3328 262232.2253 290876.2559 267657.1184 568727.3607 376212.2615 185317.2641 573.5026799 384695.7571 324177.6247 215122.3818 201405.0886 473983.7561 358578.8915 205531.8704 416242.5056 339546.6972 PC(15:1_18:1) 5240.304584 4568.747331 4762862.816 5732495.078 6682284.252 6650800.111 6204881.576 2090504.77 1982432.841 2362457.237 7456.25195 1809439.486 4601474.17 9715066.298 971643.7245 5031758.912 6896907.268 842949.5521 4448208.796 4179655.771 5455712.901 4891503.819 2588059.463 2757492.18 5355.287304 4378630.318 3054846.876 4801238.064 8279830.108 2331102.258 2762578.112 1418145.596 4468037.701 4424439.592 2499882.798 4618095.801 6852.698336 4215674.642 5121013.381 3128825.597 1918783.393 1754828.512 9577685.749 2797463.046 3125339.443 4041267.046 PC(15:1_22:4) 1525.813408 1384.788332 556796.3894 113022.9341 678585.9986 117330.9802 684572.014 357440.2826 561271.9239 399601.788 1528.629263 954286.3595 620822.3894 523447.3207 493605.2744 123681.7714 108413.6738 363512.2522 705961.3195 377310.199 126991.7776 732581.8082 301732.3764 446074.5925 1055.284395 736975.8294 476420.4553 425506.3873 236408.3243 784975.849 541711.639 547437.1329 484148.9124 480678.271 733056.0788 134019.3987 1082.95975 572786.758 626293.2634 310016.2295 583058.4783 972438.3075 266807.1068 330910.7679 577438.3472 639616.4146 PC(16:0_16:1) 16762.30287 9636.353628 17441815.17 3963654.833 38542017.73 1068366.587 35327028.57 17933671.97 8658917.998 8693361.835 12369.00384 11537998.55 40357058.95 12656939.12 3574454.734 1273576.79 2853665.643 3005361.585 20998934.61 7668110.149 3617072.595 36350276.51 27587763.93 21324992.68 16525.28541 20028465.9 22854703.47 7464091.865 12386161.29 11805789.75 3946751.883 14290496.65 6609573.672 8294701.856 12022427.34 1577149.909 16331.80826 17239410 39229786.1 30094723.96 4139471.994 14770226.19 12698616.3 30550149.69 20500756.98 41229771.6 PC(16:0_20:5) 1809.589026 1014.897099 930872.2185 178386.7958 750540.1105 241347.4519 820008.8503 664861.7563 556081.8943 560997.7265 2342.928863 474666.1549 961080.9054 648479.4617 567981.1135 207348.4756 215523.2516 581918.2743 956019.6544 245210.2029 240175.2767 807904.0673 690606.2059 868210.6507 576.5494822 960226.2117 960095.6189 211656.5672 562554.4227 498934.2873 788614.7793 554959.2388 234431.4716 401109.9282 378858.2345 236292.1974 2269.326409 880040.0904 626997.6017 869970.5204 567107.9257 737765.5984 581729.825 929001.9183 901125.629 563787.6716 PC(16:0_22:6) 3776.115685 2205.227981 964621.6798 218397.8108 1348427.723 254647.1978 703642.0384 2005919.014 387212.7586 450723.7905 1874.303225 560449.6396 1205399.902 1055256.614 405398.6311 256488.2982 214215.1264 435079.8858 1042251.208 1361079.918 247813.8329 1369192.696 1787120.527 1676294.386 4669.621852 1113803.742 2106383.21 1112076.672 955672.0233 515534.6232 553151.9091 553575.4188 1703339.656 904710.8439 566897.1603 253976.1697 2602.923419 1020262.979 178548.1776 2485238.251 410186.0979 688270.6898 1090061.89 2131340.392 844816.9295 1497075.924 PC(16:0_18:1) 19892.11286 30714.11768 63668131.5 56083706.46 82570638.67 61134399.09 80615423.17 56630347.59 59861377.54 64592667.97 35722.21071 54577888.49 80864941.85 79946640.41 62879583.46 51694344.03 41574158.58 52999917.74 68139175.94 57353336.36 53107268.8 77179763.15 76407200.17 75394540.88 42031.78445 69773599.78 75274132.17 51727067.88 78918761.77 54228319.66 67009944.15 55035425.4 56714070.8 18645553.42 57308922 57023220.44 39768.48751 69230935.94 79556213.38 76945277.16 53033560.02 60990873.31 78862240.47 81663452.26 59887884.41 60315122.11 PC(16:0_18:0) 2488.578338 4922.736452 4104184.358 4207087.829 7042960.325 4373511.993 6906114.203 3747097.47 4173964.974 5189254.497 5354.859823 4878476.859 6589524.305 6347358.49 5089536.671 3631075.261 2772109.681 3884778.066 5428088.144 4658144.22 4143910.272 5627518.111 6432538.885 6419571.924 4352.66131 5857015.036 5725858.087 3207837.453 6518079.703 4943444.073 5635458.122 3963733.694 4190594.955 311081.8487 4513134.573 4199193.422 3948.307788 5387798.901 2624958.455 1121746.16 3994480.676 4726425.137 2918269.325 6721639.14 4198381.516 4981943.161 PC(16:0_24:1) 2663.007281 725.2992477 413144.5994 454701.5121 819367.0194 465133.5092 654572.7268 452953.8636 277943.6535 323996.4453 2039.435785 82698.1994 747807.1814 882147.8464 300388.8067 275503.7577 408132.476 264336.2527 308554.1327 272529.9388 298236.9954 683907.7422 466806.9175 426657.8536 1410.910526 381741.7359 530999.545 281333.666 817113.8617 96999.65853 340398.3982 104256.1539 271129.9497 148720.5616 88847.67321 316691.2414 3159.815585 377966.7855 662550.1173 505181.9897 234431.3974 113394.714 747860.1733 551368.8634 356382.3781 734287.6706 PC(16:0_26:0) 44.16116645 0 150246.9294 117515.7035 714204.0684 123810.867 484246.9772 179023.1412 94686.17311 114121.1584 369.1254481 8273.4933 556932.655 190122.399 109496.1381 63896.27645 94570.21477 60484.50174 182927.5902 34433.77736 55814.3716 510284.485 256536.1737 161848.6831 0 164450.8989 157976.5651 43738.75611 140401.8077 8912.276784 146914.5326 6050.960958 47353.63463 12934.32357 14651.21951 61695.29194 0 153846.9735 532939.5773 284054.6858 74605.49096 12327.74985 152981.2811 302265.3462 151899.3891 351699.8532 PC(16:0_20:3) 2795.632421 3606.071735 5897533.209 5223404.163 5893007.616 5880545.974 6206422.186 3622432.817 4966513.97 6051696.875 3915.382235 4912137.585 7251830.328 8798143.047 5064677.09 4420513.758 2960205.135 5981179.145 6426439.946 2080940.446 4532985.363 6073118.248 4349340.636 4159919.644 3938.520039 5508602.502 4751442.837 2081159.552 8445188.772 5228816.408 7314103.17 4988057.025 2223509.545 7331413.022 4910543.206 4515000.959 3141.690558 5704233.319 4826897.751 5109602.36 4536007.42 5815913.106 8583109.102 5827609.532 6033452.623 5205415.976 PC(16:0_20:1) 9426.005284 11777.32156 14967739.49 15434445.96 16455973.33 16242329.1 15144881.47 12041356.79 14364068.83 14689572.66 15106.67541 13810486.99 16346407.3 14277730.14 14563318.03 14619763.43 16532409.73 13756493.32 15389264.72 13595059.16 14370875.64 13847083.4 12504118.52 12132569.12 14760.11358 15996142.41 13053640.15 13829077.83 12772306.52 15543545.35 15821262.44 14318464.17 13344738.91 3123077.18 14115259.74 13552679.84 14027.93402 14860965.14 14592266.08 13033021.35 13438376.39 14605753.06 13011157.46 14169372.86 11485537.08 10476030.14 PC(16:0_18:2) 12735.12411 16821.87044 31446873.44 38532577.41 37317448.86 40836327.27 36736955.02 21755256.09 32527881.8 34700267.85 14980.19262 26803522.73 38720156.64 41569913.34 30710490.89 37525933.79 34293528.94 33213698.02 33780871.14 10633682.81 36286918.84 37394337.62 27565612.1 27107983.76 12775.7163 33888392.76 29883466.12 9795358.975 44572636.29 23972465.67 38666865.5 25729002.73 10509005.19 31383891.56 27404621.66 36137788.77 20213.33086 33622327.31 29678461.92 31167890.65 31684614.66 27579405.1 42551555.9 32711445.73 33391172.96 34046162.99 PC(16:0_17:0) 601.1140983 589.3351244 575059.0417 355990.7625 605466.9068 560946.8941 616103.3332 711791.6062 473079.4847 531182.0523 1177.629186 384609.0069 718552.7017 314769.9852 497460.445 280440.5873 386150.6843 611569.779 640723.4418 157801.768 300683.6483 533388.2568 574666.5785 659437.4771 0 594227.587 816596.2474 168116.1908 179413.2372 340716.1316 614521.8999 370906.9692 192277.3007 368447.0443 309878.2195 315957.8643 609.2270793 500207.9683 516035.9001 659353.8194 422643.7668 365233.7317 293268.9131 683743.1313 530627.668 484194.4269 PC(16:0_16:0) 1600.830451 4779.959462 4244946.6 2062577.338 7482351.444 2025017.09 6906137.172 3783401.809 2171151.153 1958582.328 3920.399805 1336319.27 7832864.936 6016645.111 2222278.014 1995039.077 2044164.951 1894165.464 4596856.445 1743196.29 2113967.367 6859496.223 4139105.351 3838244.649 2408.169977 4496879.975 4230857.217 1572463.103 5196454.288 1594107.217 2623894.055 1445919.579 1614361.468 1332879.772 1442233.222 2216340.352 3266.692834 4243123.016 7454747.204 1039026.957 2103676.821 1517345.823 5510217.767 4689159.409 3947625.984 6351632.908 PC(16:0_20:0) 1351.897902 3284.076752 1663366.113 1915222.39 1508181.882 1485232.572 1672614.024 950634.9531 1326843.693 1321758.424 3065.568542 1710087.869 1534927.054 1347272.146 1599991.182 1201901.806 1573599.784 1412624.827 1797396.191 1278412.096 1471139.419 1291836.093 1192311.962 1227510.491 1339.531678 1663806.209 1212166.405 1075307.104 1026126.289 1723037.295 1754482.649 1543322.375 1270309.997 594876.6227 1342016.522 1408498.424 2675.614322 1387412.887 1460477.677 1273555.188 1145089.449 1419228.567 1116071.12 1399781.574 1154647.857 596144.0741 PC(16:0_17:1) 3120.405887 3925.287029 234775.1208 448416.791 515617.9264 578579.481 324590.6678 224203.6003 265461.9588 295749.8281 2474.896454 184049.7035 313633.5869 644550.2561 113833.3426 523591.2055 509411.6667 197371.596 277323.1455 277607.9444 439887.7686 393915.5952 258559.0325 216142.963 2077.794839 297676.2424 262861.5067 303991.0118 651477.128 160720.1726 276345.1093 200710.7392 302818.6946 630555.7523 263343.3955 447275.538 5116.050731 364869.7207 335867.3295 253702.662 301700.2735 282758.2627 614017.4996 379265.1409 398045.252 375840.7492 PC(16:1_17:0) 2389.357116 1835.360117 820938.95 421974.4053 1214639.592 460431.877 1148737.96 344087.5891 200284.9051 171427.1777 1852.92509 209393.3619 1397323.406 762899.3399 217331.0304 459634.0064 693896.493 180480.4733 746681.9341 218099.8806 473053.2536 1127408.908 972509.4642 909746.825 1384.736875 845466.9161 1047358.082 226054.6248 612320.3773 320430.0928 235317.2256 244417.7429 212621.1557 337555.6357 217680.3972 473032.7463 2419.604523 760512.8205 990308.1365 1012400.712 190033.1179 218680.1248 684803.1653 1058738.253 787012.1283 1054879.147 PC(16:1_18:0) 6955.417171 6085.447518 3312132.168 1490031.762 6120032.667 1617551.051 5757528.512 2456415.316 2140175.159 2332724.929 6461.001998 3389348.538 6512170.203 1513314.116 2278340.379 1832982.398 2003711.964 1765900.43 3940531.334 2754035.871 701913.6365 6008151.193 4716903.496 3533278.615 6057.22453 4194440.183 3843514.819 2529255.029 4248203.219 3170736.462 2622032.585 4167742.406 2686374.977 6169299.279 4343905.21 1153520.107 6874.61939 4528378.046 5809684.412 4101319.582 2398164.02 4897162.397 4095949.905 4072398.823 4383567.018 6329539.693 PC(16:1_18:2) 2084.386094 2099.124977 867178.9749 742302.9995 2446237.12 787316.4683 2401479.408 992057.8198 820206.4084 1172871.006 2067.117547 298832.5104 3289764.12 2710871.096 382021.0043 614655.403 351030.756 873983.0365 1779577.292 216329.5145 264164.396 2692142.68 1308622.964 1203035.725 1299.281407 1921652.956 1500634.174 201121.3041 2650936.188 712047.4754 1311744.22 412678.1311 198171.0337 256254.2836 890550.561 656335.9895 1711.273823 1752922.503 1983400.795 1610676.704 232871.0604 943842.7871 2466655.175 1685171.262 1653535.694 1967331.328 PC(16:1_16:1) 7695.474363 5432.060379 5498906.823 2194643.247 10990340.74 2593281.662 9926851.887 3590836.644 2217448.026 2423077.995 5463.613366 1369174.746 14360653.6 7977056.708 2326444.775 1929387.765 1628119.426 2306740.996 3470247.832 414695.4525 1748583.666 11985609.53 4424509.272 4656082.425 5486.381969 6204614.24 5247720.132 570027.307 8168413.214 1337237.862 3047331.713 1502195.399 359273.1337 2643051.95 1433327.627 1857217.496 5227.468384 5700710.54 8519435.452 5121161.695 2150908.075 1745976.728 7384826.418 5689516.705 4884443.962 7943744.066 PC(16:1_18:3) 0 0 109717.7981 30668.53584 86811.00487 29685.60395 99230.5251 34755.52627 43834.6579 30968.72137 0 34413.55911 142251.9703 81112.42305 39931.16756 33962.27694 26943.36844 36033.78521 98797.37837 5998.142815 24481.39015 114043.7657 38479.8987 33393.76303 0 96190.58894 46498.13389 5513.518546 59482.98319 38293.64565 44146.61233 35417.15936 8425.464802 59843.42801 32491.40348 28966.50428 0 103257.2476 58553.01935 38863.17228 41201.91051 36825.61873 67236.77165 54038.53915 115289.1654 86126.13301 PC(16:1_22:5) 98.70383793 0 104240.4921 42089.11721 149692.342 43125.32926 170889.2916 118064.0148 62720.34269 55704.35571 0 35993.04981 178449.2694 183495.4463 59592.24857 31739.00428 25207.98834 61710.73483 106925.1588 40835.69828 30931.41575 201248.2552 126316.8214 163850.5804 272.1950616 162720.3263 193941.0686 37192.67433 172201.0354 32959.80487 79410.61188 38707.41831 44689.38726 41198.09916 30200.67465 28134.03986 304.7031334 170342.9284 136241.9162 139152.1369 60798.09473 34904.82529 187830.2318 155604.3102 133072.1409 139979.9024 PC(16:1_22:4) 897.2855497 585.5105802 384759.1141 190558.4759 184004.1534 252745.138 314234.7741 358449.6153 365991.4531 363940.6288 0 335180.4652 289251.319 197051.8644 318944.0256 192627.0501 235127.4792 324044.0604 281999.2603 108550.6489 175625.7573 260815.7145 261445.1873 348190.6755 100.3464374 393039.4426 246782.6809 104070.6644 292351.3427 307888.8292 431143.1904 364323.8352 147125.0461 413656.6381 322220.5976 160539.7047 564.9160177 301508.9781 245262.2085 281901.7423 396132.4247 347644.9039 154600.0795 328105.6768 390774.8538 307685.396 PC(16:1_20:3) 2173.87548 319.2588411 430438.2395 400218.7064 458832.8067 388195.1923 541032.1956 368426.2317 380901.4869 461798.5222 495.8245853 423417.4505 664319.9063 575464.2815 399270.7136 312902.0795 392136.1774 498950.1818 666374.1257 116173.0245 327925.4759 611325.1194 362258.2952 445043.6725 165.9632713 621669.3508 480941.8054 114657.8985 552413.177 439072.1425 639661.6218 353602.2512 116652.2367 760211.5748 437077.7749 334524.0846 1001.209702 605208.0096 387829.6909 511807.8606 357522.3255 419018.8723 603163.2871 550544.2803 581860.7229 450402.3583 PC(17:0_18:0) 611.209686 538.6479872 136825.6403 117847.0659 139924.9031 143285.3344 150856.7118 119288.4152 59422.82422 55273.71398 0 91621.95096 165934.3972 102068.8327 75267.99552 90285.30428 100619.304 73021.85997 163831.0078 70473.70504 110655.1381 138971.1667 188447.367 156050.5027 75.98819751 172020.6903 181723.8815 58832.40299 92634.59632 112954.5359 94598.10929 107725.8141 54894.28417 77939.95783 87129.79333 87152.94576 0 122498.1361 144031.1252 246939.4632 51327.73861 118399.2744 131107.0064 216987.1858 127971.9851 106663.1387 PC(17:0_18:2) 3731.659158 4295.765888 1120749.112 1472539.584 1604808.496 1682619.233 1287356.391 449124.1131 894068.7332 1187264.23 2886.984614 1209970.012 1526984.992 934381.3959 894775.835 1021430.633 1225013.487 1054053.698 1290941.903 332740.7151 1069864.072 1347139.661 1284751.237 1194956.886 2904.506358 1270947.406 1256285.925 322605.683 1151088.002 1116656.952 1356271.09 1127636.424 352817.9195 526581.2592 1333136.248 992832.1524 3151.43591 1414251.549 1095219.429 1550270.568 841472.413 1479732.401 979179.939 1743793.05 1148495.596 1560367.113 PC(17:0_18:1) 4609.133683 2267.134739 2349361.086 1845414.228 2908354.036 1970415.399 2363104.338 1533220.651 1318297.123 1654210.73 4338.906153 1733182.103 2403831.814 1324282.08 1405835.729 1520286.162 1603095.072 1479500.979 2297211.813 1081300.448 1369520.258 2375402.279 1994072.85 1906376.063 3414.910191 2153165.73 1890825.503 1057675.696 1360739.405 980675.4028 1576176.135 1793082.876 1156919.168 2274353.706 1229577.08 1362197.483 5093.579664 1549598.375 1673925.755 1645019.128 1498711.247 2212625.992 1273734.269 1309679.675 2225514.528 2728484.616 PC(17:0_20:4) 463.2206 165.2260115 221575.9353 115760.3547 157015.1968 123008.4527 140967.3554 76868.62547 277086.4549 232393.5081 406.6145242 318411.115 198677.4778 93171.40163 125065.8473 119639.7553 22159.8879 235126.6416 270722.5662 131537.385 126236.9956 175058.0434 167298.2669 89554.87284 34.55843005 323197.159 227302.3934 134615.3285 69823.28678 177863.3157 374945.68 327622.2302 188488.1623 513639.0481 326010.5979 127531.8306 602.0376642 240282.8775 152079.3188 62798.12551 185876.93 246579.3514 98177.25709 166728.3136 252645.0021 145006.1164 PC(17:1_18:2) 536.9868304 1269.874506 179424.0434 316580.0072 135275.2886 281877.0282 182693.5442 109522.2239 128495.4599 191594.7261 499.156072 121661.5608 192162.5388 134951.5404 146602.3288 242023.8958 111692.9647 168022.6404 218527.0229 39607.1231 250474.1968 143461.4864 120649.2012 140603.5386 607.0639961 202179.6454 133090.7873 31464.39242 91694.82674 99292.64228 254306.0972 136416.0329 32224.04981 168467.7172 128334.5388 281038.5453 275.5425379 174675.2285 138888.7963 158045.9307 135221.6237 152273.9849 119981.7141 152381.4675 187340.3252 113587.0654 PC(17:1_18:1) 1350.988923 0 45420.51338 39587.36958 35080.75923 38553.56342 26661.19034 26896.1935 32456.4849 25553.13802 0 51780.33968 27860.41302 35826.21746 17038.03124 31207.01019 43443.27895 40075.36956 46076.18347 14950.65839 33140.63313 42854.96666 15825.35867 20496.45533 463.1243714 47435.03394 30615.33722 45322.04689 39282.48114 68739.16043 29601.22689 36659.79881 36269.76679 92441.4071 40067.10513 43739.13017 0 46171.84975 27301.35099 30884.46038 23122.91355 23821.7938 39417.40696 27071.77161 37398.42343 30657.93149 PC(17:1_20:1) 7528.43972 2637.735749 899396.3729 745812.726 1293249.049 621378.7348 1170374.39 436853.8941 503200.9632 419146.1025 3784.439542 440897.3873 1355664.469 896596.9576 465065.6555 468969.8993 710556.5611 579483.1646 961635.7959 491097.6853 527944.2177 1245967.536 895003.5399 490988.5217 5145.480703 856476.8836 945584.675 271844.952 832843.1258 745090.6959 471047.4782 424445.5976 420513.5276 625860.6418 667492.6919 432043.6101 5401.425121 782414.8142 702614.5534 944166.8357 478633.3514 849136.5301 916666.8639 1036388.211 912880.2667 1151985.455 PC(17:2_20:4) 798.1627559 64.86623764 401674.9041 123770.5904 573047.129 158036.7985 123227.0962 463280.1901 232337.9561 183460.2914 371.9111298 220180.8948 525805.3733 423941.8342 311991.9987 126727.7042 209301.6299 420248.6968 387717.2977 449760.0306 147256.9612 359860.8196 284558.973 487067.1991 385.7201268 378644.1307 491003.1375 605119.3954 455275.3938 185149.0594 343044.0105 269021.8584 470727.4789 411880.0755 217911.8046 115503.9 655.8693894 351185.5643 473331.043 286594.2555 151799.1357 189479.4266 511253.9602 346824.8348 364830.9564 149702.8802 PC(18:0_18:1) 1807.969109 1246.975116 1886696.521 2355432.781 2450562.442 3008802.946 2579343.467 2019807.662 1669085.146 1643525.413 1622.795304 1921041.399 2449753.738 4472365.473 1646886.42 2089495.632 1787096.887 1457801.678 2767550.348 1932715.177 2359142.348 2078850.299 2326087.607 2140644.579 1657.531256 2327322.461 2220415.795 1225682.574 3094179.337 2109338.873 2388440.933 1731562.225 1724794.083 755910.8482 1317811.294 2470686.611 408.5210111 1949638.957 2102676.813 2222406.53 1044503.876 1310409.846 3342249.064 2045426.242 1762199.016 1354590.852 PC(18:0_18:2) 10910.00366 12822.02511 24894756.7 38386725.32 10344750.72 39305760.93 11125341.37 5358640.732 30657695.2 33336374.01 12823.85885 30117768.12 9876691.28 11697032.06 32519661.68 32733110.7 29735269.08 34128805.6 26081880.81 4918484.635 33488713.02 3430831.573 10308743.87 8679318.741 15286.56009 23989802.39 5704816.718 4557372.51 3555454.734 28287653.53 37744488.44 30036088.72 6400619.385 8475649.818 30409262.49 31606078.61 11190.32627 23294632.28 7404976.134 7090289.353 28859834.13 29770924.74 5631087.285 7395131.261 23653215.24 6457278.915 PC(18:0_20:4) 2570.792778 5342.437859 7573318.423 2812776.131 4254456.333 2910081.19 4047914.981 4707067.732 9091983.436 8569378.009 6512.723833 11540452.64 3969941.232 1882706.706 9002561.871 3136687.549 2539187.238 8594247.144 7463583.748 3848953.722 3224666.201 3675898.498 3967071.243 4781653.894 5636.492142 7408457.365 5233758.992 4171359.378 1815874.43 9984471.72 10495221.6 11395125.4 5287222.614 5768474.31 11358840.6 2912313.865 5087.841732 7394255.566 4071814.095 4335968.556 9053152.545 11434721.81 1993791.047 5244756.636 7314621.773 4023810.053 PC(18:0_20:2) 5062.963568 7313.636419 2762447.687 3579865.441 3330725.931 4109084.999 3424245.148 2804885.852 2156807.608 2618449.273 5522.954058 1769115.024 3646814.429 6501472.741 2161398.229 3047230.906 3918692.507 2478157.628 2898311.072 2870077.925 3027813.105 3227159.677 1679554.161 2932918.074 7060.143666 2963065.354 3086939.047 2697802.547 5818254.14 2135209.61 2807822.576 1761748.17 2557603.62 1119418.969 1818637.997 3115664.628 8813.644612 2839253.887 1660054.601 3074280.091 1956240.051 2382081.291 6265233.973 3372600.522 2950409.091 3151860.059 PC(18:0_22:5) 2065.633484 2352.339487 1716330.217 530377.8084 1845867.244 738191.2787 1744252.081 2078827.565 1416765.531 1394694.421 2047.65595 1558924.764 1751802.369 1255726.768 1561549.389 708909.3283 613338.997 1562441.476 1915141.456 1788684.079 819649.8784 1610081.199 1836841.853 2263647.723 2610.542242 2054074.16 2719368.033 1870589.738 1162353.627 1868005.752 2089925.007 1816089.536 2482331.318 1095013.533 1759232.028 705922.1024 4615.191932 2007143.909 1790109.962 1946462.667 1624217.261 1927539.271 1259880.515 2466594.383 1960689.929 1869130.827 PC(18:0_22:2) 1031.662186 669.2693343 493564.2523 679868.5231 792100.5293 801537.4439 645322.2835 590891.6336 386064.3237 419386.2591 662.204129 241754.9772 742335.0635 1261252.334 409116.6004 557217.2244 721452.4596 359964.0788 591459.0551 517674.8037 592049.3874 630235.5987 547155.6803 591949.9399 0 481158.1727 691239.0295 524800.3955 1081121.201 236629.0677 460182.9403 264565.5311 514145.8183 418330.1736 218806.6879 590360.8945 0 511893.341 573706.05 605652.9298 381322.4653 323676.346 1102681.303 620273.2015 476135.485 715919.7304 PC(18:1_19:0) 0 0 428399.6806 389369.5803 619850.7382 449377.184 545904.5258 473543.638 301783.3356 338406.6746 0 193159.7346 583310.5572 411461.0574 284752.7551 331869.8857 385052.0883 299595.1427 480317.0896 325344.1986 336117.9712 549850.7533 492325.549 503056.817 1371.757791 475024.5282 589839.5997 343491.5787 358133.4018 268713.692 362343.9482 281570.1711 327629.9881 83895.46717 281602.3632 331736.0772 2844.706211 468095.7952 539633.9007 583886.042 287782.1679 330560.6339 402173.214 579869.4862 482766.574 574661.556 PC(18:1_18:2) 4036.156529 8199.354727 17022977.32 35612222.64 10293241.29 38373018.35 4897319.391 8087765.912 16343177.18 24113590.82 8383.075605 13692890.6 6088397.582 19316530 17405172.51 29105909.16 38203222.55 24729187.42 17436728.07 3473677.143 30535950.37 11705362.17 3658401.208 8270073.943 8478.0566 17098775.74 3815264.693 3742173.354 15732215.8 14663126.48 28693848.32 13339676.45 3529058.856 19865429.73 12917418.99 29628501.68 9439.22004 15746157.07 8984930.07 9561839.176 15855790.05 14857464.9 16114494.93 10896202.02 15573626.95 9819836.183 PC(18:1_20:4) 4595.302659 4624.596987 7583974.843 1783065.085 4531825.318 1956287.622 4627136.919 3264148.765 8427596.429 7711649.552 5603.464326 8783835.217 5116078.066 6669490.512 8605877.059 2401380.906 1774196.565 7778426.532 8146407.128 4495021.798 2585506.954 4536220.3 6124588.257 8583602.82 5880.930923 8061940.107 9268966.063 4469645.03 5950402.838 8149802.075 9720886.249 9770616.346 5126472.223 12948319.14 9269372.075 2552554.363 6044.120585 7749123.759 3996126.572 6675639.09 8208255.317 10331379.75 6210528.845 7345018.521 7902166.293 2330497.773 PC(18:1_18:1) 19195.62586 22323.39972 54787633.56 60830910.81 50929486.28 67468877.5 49574481.63 47466056.2 35807216.2 36270511.26 29487.27551 39439234.6 54652402.98 79584781.26 38358517.6 48523104.67 49947918.78 50612775.06 53026955.83 33144983.26 55464059.97 48918734.91 49016365.29 22286862.99 33439.44226 49851815.86 29231091.26 32227322.64 76084849.62 21122258.88 53619550.26 40489738.88 18688423.38 53773095.7 34848991.42 54764248.21 31535.5003 46241118.04 24790692.34 53624398.1 29877833.47 39195208.91 79568551.36 57349963.03 45015623.07 48127378.02 PC(18:1_20:0) 1037.894301 1984.145269 708361.3338 1292085.31 1022655.88 1360666.086 806991.7034 540839.8165 587779.5904 712271.2273 0 331106.3206 1026791.165 887350.2752 595544.3976 907448.0184 1118709.904 602081.4894 729361.7947 646309.6905 976209.2075 844831.2555 667959.512 573151.0228 683.5365172 750411.9788 639892.6329 608791.3129 845116.9217 391556.2819 746814.5446 378471.5812 627523.8282 610095.1966 368332.9218 994773.4369 0 704700.0671 821179.8505 752021.7161 578209.5855 410381.5334 790692.3848 765475.8102 643015.4849 910075.5337 PC(18:1_24:1) 2008.281278 0 589398.3861 343744.4618 1200301.132 432012.7812 1015528.223 794607.1544 278886.447 257711.7114 2043.861432 133580.1745 1063953.362 1443998.262 171529.2006 335225.681 382092.8845 232224.3566 618765.4079 439375.5161 264910.1062 972473.8803 813985.9932 817411.1192 1395.691496 605807.6467 970462.2532 482581.8922 1353410.009 167428.3876 255154.8422 127995.3153 458228.2977 231724.1633 146658.741 326538.4159 692.9909027 556316.3838 958915.4656 847975.1826 256577.9789 166871.8273 1360072.278 901081.6847 578268.3824 1133677.904 PC(18:1_22:6) 2092.159485 1079.067272 645309.6349 140673.8107 867035.2356 149161.4501 803354.3787 1570336.726 250056.4519 293709.8396 542.4731519 341620.9114 1012062.491 1950681.067 260711.1473 107160.4743 125448.276 262896.1559 773244.5305 1098669.307 138140.3795 913914.455 1570924.558 1695729.097 316.6721236 744965.7517 2174855.965 1011474.444 1735539.393 390198.3245 342122.9196 405595.096 997890.8668 605585.8968 420191.6462 125060.5814 1147.90332 672083.2825 804892.1673 1725616.675 259409.0345 501440.041 1776811.569 1961937.818 742853.1155 840540.1712 PC(18:1_22:5) 1691.087767 2402.362397 1028396.388 218682.3167 970170.4736 248270.5691 1038763.278 1294514.35 624596.3579 610520.9378 351.4176234 625951.4771 1086276.387 1186837.198 565002.4354 245261.8556 244275.3391 261005.9821 539917.0435 763155.1164 248601.0576 1032403.982 993118.9462 1320795.206 1208.207378 906608.8472 1565429.602 730360.4879 1015766.338 657463.4522 745922.82 655101.5821 822833.4226 818744.2337 378219.9761 252125.9037 2119.840773 918874.0473 805167.4887 1071257.339 580825.8403 222124.5785 1100649.01 1128688.47 980756.0838 863556.7561 PC(18:1_22:2) 2130.863539 1391.79431 843546.25 671784.7428 824753.6151 829095.469 794399.9005 793245.6284 881034.5271 885814.2665 2117.400098 742371.1755 686502.7455 1466767.201 865680.5293 620428.2865 635516.7343 838439.8068 921772.9237 616087.1356 667595.5743 770131.9052 542090.25 685294.8005 1645.770124 904558.9823 990406.0773 584432.7723 887565.2392 859437.8426 1012175.846 815680.5706 646558.0659 1186946.756 667464.4647 650099.7692 3141.450505 752847.7249 612232.6867 707925.7259 711117.2172 985153.0591 1397647.076 732203.8821 803589.9639 721391.6105 PC(18:1_20:3) 1302.390338 745.3349514 983686.849 691658.4527 427674.0427 1251708.252 452360.3513 569584.0085 837748.5215 589974.41 627.6180098 559953.7341 630032.4842 848898.2952 384692.3191 409459.2839 1566979.432 628496.0074 716016.8337 147710.6528 448732.8433 595307.7244 374711.014 375874.1138 306.3059368 591759.7266 499776.5618 271960.1343 364148.3555 927762.4199 638835.5351 597114.3072 253990.9319 1009493.998 446326.338 559859.0644 379.2477813 504768.5332 317234.0984 298910.8391 700093.8568 596930.5646 370291.0604 362968.0949 551411.6713 324998.2968 PC(18:1_26:0) 701.3344189 358.7553389 301933.6459 215119.674 1138039.157 253106.5088 520715.2232 171759.3137 87828.16043 86698.06172 733.7849407 15924.89793 765098.7655 413530.1935 82689.416 174394.3757 274610.9483 72499.87756 235105.3034 170535.6308 141414.3985 702217.8847 383751.2226 220030.8621 868.1850851 319641.0305 282024.7759 159791.0575 340458.7236 27892.42321 111767.946 14686.30074 161555.8276 40306.54473 21010.10877 151867.4046 475.6193426 307903.3263 898442.1832 419769.7136 73945.68895 40590.82343 334122.2916 509362.3023 320131.6564 970710.6291 PC(18:1_22:3) 4592.931639 2634.023308 1114727.751 566510.1359 921535.7616 369289.1353 977835.6665 859906.5386 1385483.121 1233822.455 3848.377638 2039181.338 822580.5654 620964.0706 1391735.538 359368.2856 495040.4139 1252663.437 1151818.115 768485.8985 383287.1113 850574.535 703158.605 830776.3979 3077.951779 1119219.859 1024402.946 796893.6176 569930.4144 1643188.744 1539619.297 1976717.826 951342.8013 1226136.746 1950373.79 315991.3358 2832.705523 1259323.46 787366.5607 779577.8095 1431451.536 1788860.782 1468122.749 817169.4349 1146845.436 895988.1477 PC(18:1_20:5) 65.29604632 398.2084887 190608.2727 113255.7166 185725.7465 82411.45435 214253.8072 147050.0643 126721.6878 170708.2901 33.86948085 164802.7679 254844.8578 224256.11 121889.4832 121099.4026 45441.85236 127976.979 250095.4807 61184.80004 97691.08505 182155.389 215557.1043 246096.2397 309.1628116 230541.5909 250203.4002 60189.4776 240938.3593 169923.7862 206616.3289 170165.3275 59374.24279 264706.4542 213243.3396 166675.6263 345.0515457 222533.9418 130353.8916 334530.6881 139590.0198 124498.0329 233509.3151 345432.855 251781.5012 189699.1463 PC(18:1_20:2) 3457.234164 5269.413962 2745023.616 4677732.662 2685565.695 5279729.18 2941840.218 2333954.499 1974285.366 2561879.128 6815.801636 1722068.073 3791332.356 8871177.851 2341712.818 3676210.055 4499507.303 4809410.639 2513914.445 983334.7045 3139241.543 3232651.604 1897123.495 2498161.425 3046.435355 3006498.366 3774325.254 1065874.104 7314045.539 4369687.248 3206696.036 1655949.341 1103926.497 769298.2807 1780488.817 3384510.384 3252.559736 2579318.895 1732799.8 2924014.576 1701614.265 2536729.805 8025127.85 3286274.55 2781287.637 1539893.16 PC(18:2_24:1) 0 0 255490.9134 273985.6444 387678.0463 305408.9785 312972.315 433193.2088 175167.9169 159636.6365 0 185693.9547 318160.6539 681940.9389 164538.8462 235391.3687 272250.6734 132836.4857 271385.6799 179224.8299 242082.9773 345813.163 316999.93 449028.646 0 248998.9724 544384.8422 154908.2272 567048.9332 228714.1162 193145.3141 196730.8613 164864.2707 322338.7126 188762.2579 233348.8419 679.5096225 260407.0804 306777.9391 367085.9043 142877.5003 261403.3804 564560.3694 376489.903 281643.5898 348818.5832 PC(18:2_20:2) 1365.304999 1724.906484 449789.8893 903514.5738 208288.902 902297.2301 336301.7081 205092.3232 308003.3241 490690.0541 1280.180565 344728.4368 269629.5376 214339.7476 461706.0234 297184.9849 1167846.993 849164.0015 436542.5225 92780.4886 492028.4168 312016.3414 167447.8061 204681.1414 440.5703477 389354.0655 198398.1274 108577.2104 211106.3988 438678.2184 861251.9074 327973.2518 112094.8691 424441.5725 238403.7593 418917.4544 888.8200181 305198.576 50050.43057 183364.7385 276330.404 272980.2722 227499.528 208911.0677 304580.6143 258618.5756 PC(18:2_18:2) 338.2398827 1212.736069 922316.0061 1664899.178 264565.9635 2084859.566 394369.5736 232018.8539 1020987.569 1929251.626 0 775222.1159 494969.5125 399606.3964 1093192.957 896695.6642 1416606.352 1886218.744 971632.4492 76532.99335 1181511.064 328216.065 165178.1448 170521.7476 866.8736524 940084.7812 174695.8185 80672.91206 161875.5226 794449.7006 2668729.844 726908.7962 67891.3872 503749.0493 669804.071 1226232.331 33.8031034 758350.6892 262596.6684 187398.1072 910667.8574 770101.0459 250456.7243 185943.4852 745666.4419 174147.7792 PC(20:1_22:5) 986.2827249 614.6749596 234576.9769 29236.96783 180547.9098 29179.80725 169955.0018 250273.0905 109234.8858 90602.08539 457.3496597 290728.9822 193205.382 206797.6058 107042.4975 38740.60001 25187.84775 112294.9716 265688.1478 117982.4332 32189.29686 200127.6714 255374.7726 380989.3653 598.8966288 286505.1786 394374.6053 127850.9599 198979.6977 268953.2623 133008.054 362766.1167 118128.099 383933.2258 344273.9387 43095.63329 173.7734915 300976.7437 171299.2859 240822.3373 115439.9465 410845.8352 245059.9879 254965.1322 309488.0541 221221.137 PC(20:2_20:3) 714.06717 33.31526588 65738.69993 22622.62696 35153.96979 34484.49747 33603.13249 75674.3249 70053.4594 82346.21495 0 39509.20686 47209.17571 45512.87624 63169.52161 22928.65288 47141.27766 62192.81105 66152.01074 15560.19543 23248.83555 40054.08038 35885.2972 30807.2036 0 72212.87296 55775.25388 12203.8858 19065.80136 28991.73309 149474.907 54533.25535 14216.88643 53017.97539 43559.00613 27266.3405 0 49802.45251 19371.93996 20840.48385 48473.17207 53889.78007 31884.61179 20055.16432 52296.54974 21071.89558 PC(20:3_22:1) 2799.000745 0 399632.804 134571.5161 362386.2175 146020.4877 320729.1256 501870.1958 227961.2483 225571.1705 1025.966647 118461.923 339552.3383 513079.0776 217736.3636 109000.5743 104003.1691 176918.6413 392329.4931 140375.8255 118948.4786 322414.2449 287815.3169 487837.487 0 362830.9391 599347.3048 136861.1888 467977.8606 494168.8651 236074.86 482123.768 164336.687 630328.8383 456315.1043 101085.598 363.6733931 357652.9552 296341.2048 300483.9426 228916.4489 360725.4 479644.797 304569.6914 382854.2286 332390.9396 PC(20:3_20:4) 232.9424132 99.20473534 103472.4932 12653.24557 44828.27181 12979.71864 58390.30991 86600.21226 88116.01068 102908.0581 342.4991017 99047.20531 69633.68758 41962.37985 87434.89796 11142.935 9441.349889 91255.49181 123618.0794 26673.56775 13836.69966 60777.92593 50823.48138 72945.98873 33.60452977 125971.5179 83241.02477 23604.40447 36115.11689 99025.54527 138593.2242 122920.3935 29705.13822 91106.59172 113737.0268 13894.14928 381.9842663 107770.263 46001.99655 56145.67345 88288.49275 152815.1507 37200.10745 63054.12191 116690.0112 46952.61859 PE(16:0_20:4) 698.2653889 99.92845967 1098723.269 238430.7337 2342894.524 311207.2782 2322820.169 419264.7805 370439.5356 453160.2 135.8738613 538555.5138 2717267.238 638175.5397 392779.1774 233756.0707 154419.1332 456070.9846 1106815.43 239017.7205 241456.9372 2433803.832 755212.8135 656786.3099 33.27463918 1088581.331 667240.923 237613.7524 576713.1652 477445.562 538740.4735 575368.3446 251482.6283 928693.7277 526591.6477 235459.4199 644.0616241 1039455.908 1968718.094 926178.4382 380007.9584 704130.7217 607767.1538 976189.762 1064255.643 2355445.786 PE(16:0_16:1) 135.539476 201.365215 267409.732 23086.71678 728257.445 27596.27822 632456.5502 154398.8824 42705.30333 44709.92949 302.7414781 77463.3634 518182.0599 259752.6129 39533.57404 24484.97179 15183.99801 35982.59377 279206.28 148983.0133 23613.856 645979.6841 255445.4226 190418.3111 419.37825 293409.1627 204623.1538 140883.6794 216614.2288 78836.72823 49948.26177 88940.39641 147704.3602 146581.3861 86071.76343 31611.18036 375.1655066 288392.2831 391322.0995 287843.1235 39792.00301 116099.4512 277808.6593 353299.0021 291164.8848 706958.4891 PE(16:0_22:4) 0 34.13077481 334407.1253 45844.28187 451523.334 33424.89083 343934.3659 85699.09444 140225.3373 123062.5268 0 383384.2183 550843.9368 101838.8948 150892.6026 43581.93623 31149.12504 119557.5336 395544.3754 86715.64669 40747.64847 455881.5433 84403.45439 113749.1747 272.889994 406093.8111 106627.0133 59501.42814 78197.31117 197277.2125 197241.7029 333873.33 96455.71012 261436.5072 433824.0756 47050.66659 0 295061.4593 493269.8078 91718.7035 140300.8239 392048.8737 108099.3711 100318.7274 270836.1831 337037.3829 PE(16:0_22:6) 0 496.93803 232337.2722 19297.52821 475878.9716 24900.9405 464139.2065 108007.2473 25468.61296 31047.83528 0 81238.16006 581429.0832 174527.65 32824.18789 15261.81123 13581.77639 27699.91134 251558.6506 95916.47551 18204.39423 489073.2733 190480.2558 183865.3198 307.3372815 231927.49 169595.3868 76034.89949 117600.5656 53194.37205 38483.34954 83197.86311 107676.7405 82380.21197 97567.71163 29128.15521 68.59746494 258751.9528 465578.8783 185086.5409 23096.89851 75934.32349 166261.9408 180433.1049 250715.5742 424868.2715 PE(16:1_24:0) 0 0 13017.39126 13086.41559 92380.83181 30526.04496 22242.54042 7996.214878 6616.21731 7295.337874 0 2829.961248 25064.33657 20942.07654 3370.283182 15840.37443 3760.511936 3707.266907 10183.36544 8450.374734 19779.93497 16362.7669 6787.663223 3395.405139 0 15281.59804 9780.808762 6190.478966 14083.4713 11884.72795 9621.72788 5659.324067 5094.239382 6792.812146 15629.1254 17290.6758 0 14737.04994 25469.57232 11208.21248 5657.625899 10308.19375 12801.68452 17633.86266 18750.0711 25708.00053 PE(16:1_20:4) 65.66214698 0 29153.6434 4877.325518 52744.21179 6954.106536 55732.14042 13639.15474 11972.33939 8356.963656 0 10567.18892 81550.18485 70545.52223 13787.85332 6198.029979 1695.009503 8513.333026 27117.40681 5656.400848 5671.06422 82847.48291 27473.08818 32777.53677 0 33443.05269 36786.54637 7257.202694 26216.83067 5457.897958 16568.94894 11851.81616 7224.875779 12054.39887 13401.24252 7112.556105 32.92262434 29929.17211 50217.56023 19572.35836 7720.272714 7895.249945 74175.93498 22668.09518 31673.16642 42145.53199 PE(17:1_18:1) 685.1449691 0 111984.0854 79325.48413 253434.0002 76552.90431 226267.2443 65647.56877 44174.34277 43013.79705 284.0072325 47575.83033 214776.6463 223708.8064 36221.25795 65138.08355 60246.20569 40752.85536 131726.3982 160507.4157 59444.04293 212800.2584 116343.2081 93378.8747 279.6346201 164506.0042 99605.6722 137223.6262 179591.6714 58856.83101 53766.59125 61153.35733 123502.1659 76402.85252 55443.0221 63410.52131 870.6673596 150828.3309 190225.5704 140262.2292 39617.3096 61124.32827 198348.0555 115418.1257 165660.2389 135494.7751 PE(18:0_22:5) 0 0 194107.0584 25117.14639 173513.6822 28470.9703 145850.0499 50156.09172 54338.03379 65758.13009 0 248745.6451 135274.2304 81771.90164 60760.0797 18029.36183 14939.69988 25729.98381 249911.6643 24448.59036 17173.36937 171134.693 83574.65492 56780.94976 0 145027.9026 72857.17888 44033.93132 53078.09662 208395.3403 62356.71739 366690.0726 33676.40713 352538.1235 295728.5333 27375.49985 0 199576.3543 135757.659 98290.26827 72481.6681 390012.9777 65190.51571 83738.31026 185641.3479 130202.3731 PE(18:0_18:1) 1458.72471 1051.318803 3369119.117 1364284.958 5601417.247 1818842.101 4995974.032 1277546.148 1603989.112 1929092.598 2866.286872 2427733.246 5524601.735 3702571.965 1786489.853 1204088.285 1603845.985 2136892.608 3446260.842 1957700.269 1226602.608 4543744.298 1776253.121 1546233.916 2688.953115 3964330.555 1716918.172 1727568.007 2590476.912 3008179.893 2145380.536 2953947.278 1884315.609 2492045.785 2870130.182 1328835.231 687.4992279 3356070.874 4635489.593 1962694.734 1523901.666 3220554.302 3085903.395 2158984.238 3636477.17 5762963.604 PE(18:0_20:4) 1334.081632 1742.339817 5058656.383 3065899.758 5873877.633 3272163.718 6175861.281 2458054.163 3342395.855 4153719.291 3730.726887 3787932.142 6643751.552 1227921.967 3577881.498 2385476.242 3423240.189 4296663.091 4794175.732 586871.0493 2548069.731 6284201.208 3208230.683 2467462.092 4758.967037 4566738.553 2987082.008 639273.5976 1093583.875 4560925.916 4641608.138 3900819.192 596182.8945 2699952.589 3442479.076 2363355.646 2664.707991 4455852.776 5321164.669 2979823.507 3069659.852 3780975.141 1287534.745 3192337.772 4355722.998 5251804.632 PE(18:0_20:3) 0 644.7788941 465913.3469 429315.8928 634721.1303 187358.8858 654217.5601 166914.0745 334174.8975 241956.4487 982.0127083 397913.3648 746058.8208 324292.4995 190125.5072 403635.2913 110308.1077 380662.6404 525646.4325 180187.4661 129604.5619 657077.2044 224529.9063 197064.6115 0 555116.5092 233449.4218 225367.0017 305467.3299 613929.9698 313034.9154 438574.754 156894.6665 203601.9083 472309.2767 163664.4501 666.6300446 480071.0712 477744.9368 251486.485 338367.5286 587889.648 256986.6227 298448.2724 282854.9397 525227.2546 PE(18:1_18:2) 427.7999997 506.7996258 379427.4565 404633.157 276771.7433 413550.3921 293299.8657 155873.779 163728.3825 203381.4259 1273.333629 253245.5771 708839.3902 737783.3586 142595.9481 294207.2629 359497.3453 205100.9281 426640.4074 218161.2002 253911.6676 586643.5759 250938.5097 238664.3546 372.9951171 416178.627 247816.4985 234219.4063 759973.1449 239933.5272 236973.1075 263560.6543 261588.1667 230675.3469 268606.382 321996.7581 309.142443 398661.077 457605.0849 334838.5266 214333.8181 393894.5391 278861.3989 379020.908 412642.1842 413504.0805 PE(18:1_20:5) 809.4204466 0 156436.5158 93337.74065 247322.6661 115386.2259 236280.4484 82624.17207 73196.342 89011.87049 0 55246.21213 282647.649 203381.1261 76349.9327 131334.6132 94702.07441 68603.65029 182476.9222 74187.30493 109938.5265 244031.1824 143035.0439 171402.5222 33.58124865 191743.3605 143241.1337 74466.73028 222541.7432 59488.99705 95282.93828 62736.83809 68344.67314 93189.50791 56563.06687 102979.4861 0 174790.6715 171935.6663 200786.0379 87646.78907 89608.23396 224051.6377 175042.3382 182008.5834 233443.0151 PE(18:1_22:1) 0 0 73554.19092 38176.42324 93121.0065 66242.29872 79902.66245 56978.85209 26576.84149 47589.93808 0 37052.35961 94894.06477 127885.6452 33931.0588 41445.45492 49824.5429 26869.30596 54645.75202 68219.5571 62068.14491 82551.30934 32813.37489 45386.25653 0 70550.75974 41959.19984 48798.02037 99510.01294 60013.10722 64673.30308 46404.01882 49771.63985 79731.77479 60319.5335 63062.94305 0 65235.83832 52142.40664 53907.76215 20045.1597 58358.49986 173160.8408 42936.25428 72290.2427 82583.77199 PE(18:1_24:1) 0 0 43575.92563 45007.34786 86238.66524 32181.44086 93215.62629 39617.101 15738.48325 22543.26673 0 12879.7934 91342.72166 197407.2359 18666.44334 42567.90761 61631.4669 16611.72668 50275.60787 29544.63562 27596.52681 91175.5626 52313.65779 54517.07595 0 42447.62027 41645.30802 39092.17503 110228.6353 23199.19327 17599.98447 21504.65924 44186.12472 22638.05704 16325.37683 23330.95058 0 40602.40219 64002.10677 34442.64713 19266.5386 31059.15156 78136.53771 85518.11867 32351.05802 76389.80466 PE(18:1_22:5) 456.1207486 0 161348.5663 89091.25355 216199.2013 153431.7145 169561.6344 59447.95493 146520.6713 230624.9119 66.90673494 107136.3001 145229.6029 185949.6886 53767.36133 44248.52889 26599.77096 52602.34332 82064.88311 73706.92737 46969.92414 92029.90757 150186.8271 107744.1841 396.8668041 79994.86934 108718.7854 60727.11046 179107.1638 30065.0367 62816.0536 55464.91859 83246.10845 144360.4249 109508.3473 35657.06101 70.35671974 116861.1222 107566.5439 193803.1562 65084.63022 134031.4796 164974.2814 208911.593 111909.6798 141972.6294 PE(18:1_20:3) 765.5589155 838.8168211 273623.0499 131133.3047 570247.6376 141676.8614 514699.3808 220877.9933 119479.1876 135896.9631 1318.810922 131995.1132 632771.1445 1063910.077 86208.05914 97289.17393 150487.9841 92196.95702 322100.3238 320152.9473 141696.3021 632826.7296 272657.7923 273567.4794 553.9109239 325705.4974 331602.4392 299803.2869 773981.0342 140416.0541 130736.7627 175726.8436 347730.5556 341985.0612 293288.781 128968.1244 390.3880661 446847.8536 532605.9902 294854.1955 122906.3345 306313.6528 1035320.434 340161.3964 435711.5937 590538.1465 PE(18:2_22:6) 152.7428831 275.6272846 222510.2867 897354.4609 191707.6637 655564.2697 170291.3042 101876.1965 292202.7733 406796.9241 373.1474008 164241.6099 205600.9974 17108.52048 213357.3496 350362.532 396065.6272 291900.4132 238600.6198 98442.08606 724549.8242 182064.856 135350.4467 145745.8123 383.8139737 303593.3162 153612.7828 94827.65522 208005.102 137961.2778 288036.8468 222271.7511 113836.9818 443585.7326 205609.2003 718321.4545 409.6708048 286862.5265 165668.281 198772.7259 280621.2012 259848.1451 232384.5051 183200.115 299156.4673 209010.0018 PG(18:1_18:1) 1195.67192 437.0906919 483845.0108 289339.7492 650814.2593 312147.4057 638284.5963 911537.5395 859882.087 743604.5671 334.7507579 322051.7844 220873.2939 910425.5697 853610.3219 268064.7286 344987.1986 853078.3216 483482.1514 1115328.855 334594.3158 247327.0786 524974.9326 421806.6944 418.8002473 554486.7311 150884.0832 268541.9975 293363.809 270201.6786 336606.6471 361207.9253 392335.8716 494389.473 369793.6559 264066.0972 506.9628346 544698.9104 497302.6807 644331.214 320552.0079 344334.4323 63513.15978 747909.4309 561968.3257 615135.2853 Plasmanyl-PC(O-16:0/17:0) 0 0 80382.06586 144052.3452 58996.21326 146587.5114 52965.61262 221200.2809 53902.295 39408.45238 988.6548418 30133.99654 91747.93182 70222.56812 59418.77495 86805.22494 134400.3266 55148.5036 81116.86754 76755.68603 131317.9824 78528.06965 235634.6767 246357.8944 345.7762757 76499.19703 267718.2808 45219.50231 57045.51987 40307.4746 72187.46752 33649.50075 55232.22928 51193.14851 34750.75268 123554.1308 0 54198.95693 59197.72722 353398.067 50652.40227 34714.54649 72703.29216 305210.0174 63828.75785 47737.91317 Plasmanyl-PC(O-16:0/22:6) 757.3536674 806.5806755 214105.93 110375.9269 214133.6435 132703.5647 208892.2593 995436.3041 207932.8101 245919.7602 733.2254662 123432.986 251473.2177 632690.7211 198578.5653 106998.9237 100596.0782 234663.3083 229234.712 883548.8593 122950.7897 230150.6212 988408.8719 1087930.417 1511.778162 211505.8902 1227215.968 546318.2238 549810.2174 137331.0452 284146.8323 129564.9266 822034.7338 192544.7726 150926.8034 121251.9379 1405.623627 112965.2938 21404.34898 1055832.568 214671.4824 151918.8236 551574.8433 1210049.865 224994.7682 215652.362 Plasmanyl-PC(O-16:0/16:1) 2639.19735 4216.873397 743889.3784 1720873.175 2141039.865 3283597.247 1715017.04 1843327.664 1696194.343 1459228.051 5745.812468 764288.8379 2214096.84 2544484.279 526732.0571 2588739.616 3071620.803 422039.1742 1636435.775 2492818.387 2771158.796 1226082.084 4489609.847 3972492.164 5280.214682 1649685.659 2534586.784 933217.4389 3599150.65 350513.7359 1260442.937 300392.7977 2250875.745 1238361.05 794540.2869 2721585.84 4348.048751 1437904.481 1742934.202 5112762.807 1430001.874 802178.3325 3752909.187 5024474.932 1487999.583 1975671.275 Plasmanyl-PC(O-22:1/18:2) 2001.864327 1688.402718 229617.1346 278197.0206 147940.2549 300869.6255 145083.1689 214133.3677 482519.2733 325530.2289 0 134435.2451 173311.2059 252941.9359 542221.1446 221566.1649 270225.5359 181845.6018 261651.1807 208915.5918 233930.991 166679.4024 186600.6707 281257.7635 1366.239545 210879.7711 281401.0083 183229.6612 237652.3623 155927.3148 657521.0145 169445.9031 198597.9976 200179.491 133528.2146 235480.4716 1405.624756 214740.5827 107731.8023 229220.3367 352687.793 183645.3077 230182.5555 245235.3852 226729.5739 127369.7461 Plasmanyl-PC(O-16:0/18:2) 1590.484659 2045.706526 1817512.355 11657000.82 725887.633 12704824.53 606243.3545 1291398.975 2865259.162 4011968.809 3119.745909 1523874.541 692422.8771 2259052.188 2807403.104 8059990.879 10341835.33 3642085.812 1892853.102 1356929.978 8288123.705 639578.1712 2117808.433 1685838.351 1673.088803 2043451.008 1844254.363 1237652.38 2123016.722 1436365.087 4596860.614 1518322.2 1208642.257 2088137.318 1565713.113 8248985.2 2685.677027 1975978.96 488446.8904 2524869.321 2981758.315 1716600.208 2238249.954 2568832.226 1894884.132 659850.6551 Plasmanyl-PC(O-24:1/18:1) 490.9669682 0 133152.1711 178637.6109 195389.104 173725.2675 180304.2592 121211.02 190315.792 203516.7541 0 52752.73012 220962.8713 355114.6604 187563.1183 111760.6564 171731.8532 164052.5707 180365.8466 240595.004 122720.682 160376.4098 158549.9495 163962.2954 1059.345923 165788.7486 150278.5821 302100.1312 327526.0909 67475.25467 268307.1941 61935.77681 272758.0014 106540.7409 59871.0207 112063.1612 0 142524.0282 133484.396 188177.6353 160377.7199 85958.11888 299537.2898 186850.8334 137413.8698 169225.337 Plasmanyl-PC(O-16:1/26:0) 0 0 67513.73378 96794.01421 138933.9442 105650.0028 167550.1106 81885.75259 70622.26739 106511.3283 0 17458.34946 233744.7938 156569.7073 67201.8011 54585.53673 100740.9778 46590.18946 80780.79789 65073.04156 69043.94635 157461.486 97347.7866 78529.07277 0 75169.23013 91472.07021 61276.3576 117636.5536 17994.3346 113274.2359 22118.79195 57868.76541 33114.31006 21494.90371 60005.59573 0 68105.25924 88043.63102 94840.66893 38424.89312 30994.41167 120247.5277 133383.827 68781.49812 134092.4045 Plasmanyl-PC(O-18:1/22:5) 1092.613328 2329.976024 312059.6553 139977.7725 266459.3599 142620.7193 263150.8456 236178.4936 396240.2806 525118.5599 2443.934783 209088.8719 279720.7467 364207.6574 396930.7084 120763.4823 127408.5046 277587.0841 272434.8015 617209.7002 142895.2467 259362.9372 248103.9135 606138.3438 3964.265771 297445.0774 629217.5389 764271.4904 321839.2195 192627.2206 602101.5839 196178.3353 392485.1948 195352.276 151951.6653 119417.6926 2682.314683 242919.1871 216827.2807 442336.1081 480615.4846 172253.8176 342008.76 272600.3009 269432.0619 253339.4947 Plasmanyl-LPC(O-16:1) 0 0 27792.07799 28525.43671 37923.92668 17580.14247 20576.605 56124.83843 76412.61307 48737.88544 0 62934.45725 25967.43741 25891.52531 68364.50072 48254.11416 20278.47729 46721.0707 34245.69463 237909.601 45533.29362 49639.78652 121462.4733 160288.9697 0 34985.6242 55929.63003 167572.7586 33344.56352 37798.61784 32982.59689 34277.51468 203216.414 35917.50358 37154.27936 52640.00163 0 34790.50181 48826.21793 121663.5185 47891.27281 31886.9281 44461.73517 94346.36467 40315.6215 58688.3468 Plasmanyl-LPC(O-16:0) 0 741.9654136 38284.02963 31445.40099 23685.40064 32172.75483 14999.91692 73745.39844 60433.43306 41743.23699 0 72689.70777 20661.27491 30802.91204 58034.24875 49792.54393 22992.90852 48449.28937 35499.03718 164256.3079 45561.98804 23702.76356 121045.5718 170262.9279 396.0259827 42147.14395 106531.3623 117185.6183 23817.34481 50376.36459 57069.27121 49640.50032 107342.1809 61344.1126 64284.46121 54895.88726 0 51615.34838 17016.56593 178326.8402 69069.87539 53647.11441 30430.18494 132565.2378 41013.14115 28288.45331 Plasmanyl-PC(O-16:0/20:4) 1943.595499 3024.207151 1745930.293 1673773.16 582498.192 1928438.918 571821.6058 3173522.102 3734757.143 4089358.207 3326.430804 1705757.669 681006.8145 1757397.733 3744887.444 836828.1238 1527264.302 4086955.062 1823271.487 1969607.607 1010681.742 598146.3616 2940734.909 3782004.447 2555.95083 1950532.844 3943529.773 1789514.955 1500354.41 2149039.339 5682856.656 1955579.905 1781155.461 1846589.085 1955771.28 1103988.922 2166.929467 1854204.678 548203.1207 3615456.949 3954428.131 2216407.331 1672080.818 3891230.711 1854685.037 676693.2783 Plasmanyl-PC(O-16:0/22:3) 4143.879591 1986.191136 439203.2974 612866.7852 296405.5056 763777.5211 299527.4087 681282.4682 1057504.159 1338198.468 1314.080837 234579.3241 344680.6864 984322.4197 1091718.235 674933.8657 636099.3663 1157889.944 528394.0543 395807.4307 650724.095 96060.02871 755459.5278 793807.3022 1691.421413 469800.1653 817469.4182 896072.9784 890675.9725 292842.2169 1485135.551 252467.9513 343552.8804 368269.2855 287749.4757 666213.122 1025.822072 484843.6365 233772.7077 781220.3043 949189.2341 314725.484 375736.7974 114949.5762 447531.2042 258750.1407 Plasmanyl-PC(O-22:0/20:4) 0 358.290009 51856.45144 21907.19502 45820.42386 14094.19838 70078.75626 38749.23173 54304.23099 77170.67274 0 18661.49795 79147.57658 34584.19195 86788.56935 10938.16443 17242.81183 67498.96924 54428.35625 119697.2121 21846.13165 37941.06826 57993.02601 65550.49988 780.2858702 57814.12941 52958.74389 76981.83605 24796.22104 27418.55443 102919.502 26562.61039 115132.8968 30828.08392 27229.53253 9974.393108 0 42338.45389 54842.41646 79325.846 84002.68811 36029.42984 55883.21581 76825.73166 54946.02672 70089.00208 Plasmanyl-PC(O-18:0/22:4) 0 650.082784 193326.9968 130238.9651 100695.5188 124895.5213 102929.7352 202189.1724 334374.99 466766.3931 42.91268335 183439.0304 107428.458 113468.1205 333374.8931 108656.7562 103856.3566 374234.752 153236.1251 132150.744 112473.7406 106392.4929 108758.5297 223367.1508 0 169721.9658 224412.596 119142.9516 122835.8083 155114.0612 482328.5479 179714.6768 145591.9815 180179.4844 122114.2034 110147.3604 0 165119.5562 104656.8658 167713.4022 346656.4709 172394.0057 114586.8603 180980.9658 148675.2428 92749.92887 Plasmanyl-PC(O-22:1/20:3) 0 0 36370.15468 38103.72981 17623.01906 53786.257 20018.16327 30896.69565 82928.79278 112672.9868 0 26322.51902 26478.28958 32915.02995 81104.20081 40737.96378 30848.36645 70555.64894 33793.53158 25602.67626 34532.19529 18677.30728 33001.55344 30647.8667 0 34372.53097 34662.90796 21523.82478 21632.77249 24790.90754 92629.51268 12761.55263 17008.96056 39921.42154 34732.09886 31914.67286 0 36312.62952 20132.13272 28476.92371 53775.00629 37566.67773 27444.34383 25826.15205 34346.37185 13582.29769 Plasmanyl-PC(O-16:0/16:0) 1039.429739 2133.768492 1774313.806 3957928.47 2608886.615 4582328.247 2829302.934 4226435.701 2307353.407 2496006.294 1528.073335 663508.3237 3281253.269 3797109.265 2396730.431 2853407.215 4445794.661 2126364.38 1808109.994 783330.4001 2788346.024 2798249.346 5005388.623 4712047.046 2813.128537 1843873.048 4874812.649 994682.155 3352227.911 876126.8638 2591694.346 782361.8569 971448.4653 1035441.394 855978.6012 2822367.683 5216.500153 1793531.925 2071537.816 5203826.705 2317281.211 944929.366 3364301.809 5258738.394 1758372.334 2140900.505 Plasmanyl-PC(O-16:0/20:2) 2841.036674 349.5997106 384916.8546 1159296.144 365297.1193 1304798.065 287742.1218 571737.4989 338787.9337 373656.9253 373.9536608 164753.5978 475870.4172 1169639.32 409976.0641 1001399.93 866088.0093 444659.0592 435087.8249 1417461.642 1036789.492 394947.7871 463179.7015 341199.3605 1780.030977 439190.5911 707802.1447 1710123.91 1292498.086 163583.5451 328586.9432 155584.5663 1219901.1 153174.8576 198228.9021 578883.1412 1375.687019 389513.3544 391603.8841 613396.8899 598673.2931 193921.2021 1362908.718 923232.1125 513466.4547 483144.0147 Plasmanyl-PC(O-18:0/20:2) 697.0708246 1648.442364 643108.255 1555329.35 458470.2315 1759044.293 128272.4307 644253.241 1062524.893 1251936.524 0 103841.4955 526533.0325 1033635.065 1021433.429 1201513.155 1614624.517 1316329.204 611717.7747 285577.1907 1278035.343 347466.7841 547421.5732 220725.7027 2766.674938 551159.5174 845399.6384 281919.3433 815053.8945 58378.62966 1546696.734 300542.1482 249775.8964 464877.7 354473.1106 1225324.407 1407.626847 542233.4608 72906.99182 731235.4325 946074.6124 330453.9579 947753.6966 785266.9544 465886.5555 481781.7782 Plasmanyl-PC(O-22:0/16:0) 2959.087231 0 137709.0719 394787.7786 117773.2544 475362.5771 136822.032 81413.86491 209689.3438 252225.7096 0 19125.5772 158275.5453 125400.9141 194603.362 216895.3076 268627.3658 271499.1349 144537.2083 53736.55976 252475.0404 139831.6511 127216.2081 85628.81306 0 116195.1576 91361.45524 50609.4046 83659.97833 18921.26358 215153.2275 26078.07435 54663.05852 50544.88828 23026.09171 254970.9337 435.5594369 101115.0803 98428.44369 126185.9082 195722.1279 38065.89468 104632.8442 129139.2742 113110.6061 128054.0322 Plasmanyl-PC(O-18:0/18:1) 3478.460656 2002.95782 2045987.73 6923563.063 932676.449 7912011.889 753223.0968 1465919.087 2615932.85 3392235.104 3033.237598 483478.5867 970107.7834 2962575.53 2404401.291 3962358.419 6349141.16 2921771.991 2156299.4 2713548.118 5164338.173 784390.5623 2380015.05 1705302.754 2448.11725 2038249.744 1842256.955 2690698.094 2441551.732 450752.3172 3579379.197 620934.4311 2564102.236 1039461.059 606501.1976 5356494.804 3567.648019 1700918.809 591900.7196 2800306.401 2298887.96 504190.7422 2780132.463 2832111.523 2012352.32 731881.7904 Plasmanyl-PC(O-18:1/22:4) 0 0 106099.9078 53205.00866 80161.88011 61359.27442 65746.41783 155718.1307 399550.4333 393000.6559 2347.058735 176177.7829 67495.81633 150378.1231 328654.9207 64085.50828 27767.59199 268764.1289 154277.1579 155525.2394 59129.16698 72742.56104 112002.5918 176956.4419 1336.248569 144804.1462 216279.3538 160982.6976 124558.7519 139019.8236 409252.2103 170275.5244 146225.6245 208379.181 186663.1969 67514.80317 0 177149.7114 56870.83389 129838.2511 419053.2756 168826.0509 122245.1783 141602.2482 153501.6588 69614.96871 Plasmanyl-PC(O-18:0/20:4) 1647.087773 3322.883997 989893.9953 662166.353 318132.0048 665015.8522 282181.1296 842741.5248 2853172.169 3099004.794 1301.784387 1050780.818 403469.7544 672625.6583 3071234.664 624704.4229 623043.7158 2992462.398 856217.021 851766.3333 650328.3998 404664.679 855770.0445 909661.1703 2560.069184 978332.1244 984343.0037 800331.7248 583239.2946 914759.023 3491219.009 1087444.038 835442.3686 1008429.882 928187.4762 661200.2336 1989.980264 934946.6095 208675.2048 916284.9522 2638116.4 1103432.541 626566.3138 1005137.772 941680.2972 193680.0603 Plasmanyl-PC(O-16:0/22:4) 291.9392256 432.2800058 497609.3628 164833.4608 190082.2546 229009.323 196691.4025 892698.8328 1265788.254 1341934.051 956.9722661 554261.1211 235695.8951 585255.9834 1225536.728 203438.5398 229759.6061 1121815.483 497192.6928 283205.3069 204137.917 232274.13 595347.8425 933520.9977 329.8347755 433258.6768 951383.6351 235549.1937 523984.9898 443147.6256 1562905.386 509689.8848 529434.5828 670857.4178 487056.269 211678.5313 694.0429321 466682.6946 189639.2392 652121.8351 1280062.348 529239.0556 546223.2549 655048.567 489558.4963 184534.3715 Plasmanyl-PC(O-16:0/20:3) 820.2730252 365.5894388 365385.2018 596910.3177 161965.7542 660219.069 196113.2426 592266.1114 659952.2153 922021.0419 1149.839744 340796.4607 244664.6542 478237.4492 637601.463 636595.2289 400606.2682 816330.2983 367221.5378 443493.0394 605820.7897 193192.6313 57519.47306 532745.7328 1155.841655 415390.1053 669692.1264 439896.339 242016.8246 282388.8506 1059062.349 309610.8197 423501.9878 456840.8951 331351.6718 685353.114 808.5694604 349459.08 144875.7626 649950.1372 635614.0814 358757.6132 437318.3858 723503.4409 349868.8666 154063.1434 Plasmanyl-PC(O-20:0/16:0) 3812.338455 0 183774.5491 786945.1004 157763.9628 617604.1146 156204.6767 151527.9219 302748.6956 343737.4261 0 43810.24909 131559.8328 188444.1317 302769.9767 358378.1476 759708.7842 237991.8578 203255.1672 83941.99117 367516.3873 160075.1271 221397.8904 169287.2021 743.3805087 149908.3363 177363.0575 80898.31794 133452.951 36421.01069 486825.9307 41555.67157 82477.75456 77934.11876 44572.77467 397002.4096 0 205706.2835 87290.28144 203467.5544 261416.6621 65031.17898 157049.109 204411.0535 153142.6485 128517.6611 Plasmenyl-PE(P-18:1/22:5) 0 0 24411.40506 5760.036446 36499.70121 6280.320646 32979.93575 16130.125 17562.63603 13017.33677 0 18875.31648 50212.40212 55735.01407 15279.71771 3014.02247 1130.976585 9236.828448 22010.56568 32268.88924 6224.607543 41489.98372 25469.05436 30658.4609 0 31776.80226 28863.02031 33010.66263 64899.57221 16268.48228 13016.87518 28569.14172 43677.32691 137258.7651 36334.96341 5213.681914 0 31809.71971 28473.71796 32558.80279 18112.78528 44370.52842 71347.69503 30004.43435 42095.739 50110.53277 Plasmenyl-PE(P-16:0/22:2) 0 0 135014.3478 223422.5185 225130.9385 222236.0016 217425.0777 74608.34772 153440.0573 119448.2986 0 40510.98512 222365.98 138029.9875 162635.0754 196807.2991 214539.7805 151217.5234 133540.364 258939.1534 188310.4052 217633.6682 101694.6625 89312.71744 364.3758258 120524.2701 91269.56262 279807.0543 130643.755 49459.98268 239262.6496 48051.62624 106922.2034 71038.41061 39560.19901 182006.33 1354.047633 120082.3003 139857.1178 109389.0467 154267.2717 58620.23533 411072.0053 122806.5244 129350.4303 149654.3577 Plasmenyl-PE(P-16:0/22:1) 0 0 108972.0289 256581.9582 174488.1813 457266.6279 168782.2498 49356.75325 103316.1309 137168.42 1010.284778 19907.09805 193681.0751 233532.7433 123441.3864 218921.9504 184289.9819 119791.7363 124588.6899 233719.7009 170610.8905 167143.9051 65893.4781 62078.49549 0 109033.3183 51705.3837 181862.6861 191668.5084 24638.8587 235476.518 20186.16736 164734.635 46277.70707 30196.45531 263537.6719 700.7052033 91774.99756 127896.9978 94625.57607 138815.9916 35569.30205 244897.537 114469.4974 105594.8376 189143.5794 Plasmenyl-PE(P-20:0/18:1) 640.6376938 640.8946719 149633.72 245013.539 86835.19508 269381.1765 77235.91994 97818.43486 151265.7651 152313.1335 0 98241.71315 99184.01096 133475.0603 149262.4209 235764.7016 232248.3863 144774.111 134119.7386 136190.7661 241293.4351 91321.89462 111646.9048 118275.1118 353.9647372 133365.1461 123114.1172 136942.6852 115216.5025 89240.59241 206640.1534 87485.62927 144918.3356 95569.80409 90765.25142 244070.3973 0 128881.2754 94632.8673 144674.6266 150993.8552 94235.89776 106838.5236 142303.3127 137217.0878 79336.07674 Plasmenyl-PC(P-16:0/20:4) 944.1268495 2244.617268 1326757.861 823947.7728 1125187.189 1024110.138 1079956.678 1853177.444 2208299.387 2185209.349 1795.990393 1745216.869 768910.2316 1224498.245 2304622.949 763802.2832 739609.699 2161693.877 1634259.958 2412906.848 946753.9277 1029142.171 1471011.996 2179751.068 2039.933094 1264727.847 2279771.473 2213425.385 928110.5287 1438611.967 2678669.845 1491545.448 2488109.368 1740423.874 1528594.483 831397.4541 1386.602737 1153858.076 907786.0005 1491580.383 2093712.541 1598391.948 1143227.617 1502879.693 1275773.98 820432.5311 Plasmenyl-PE(P-16:0/22:4) 56872.35432 55246.06214 1249720.176 346468.5807 1388095.682 489416.2091 1270475.118 651387.8347 1187075.315 1263364.24 68039.8403 1701267.435 1345759.606 970829.5912 1112849.623 411207.4015 665303.9759 1141703.302 1359928.952 681838.98 517212.0564 1223627.626 664869.0812 704619.8705 82257.91392 1225625.162 768411.8778 429172.3231 810721.105 1591894.839 1462635.31 1821456.052 582422.7296 1428846.68 1791322.135 485136.7886 73426.67451 1131248.705 1098412.855 691817.7263 1034313.997 1806289.14 984427.8689 692523.4377 1285659.331 964537.3525 Plasmenyl-PC(P-16:1/24:0) 2031.064196 1090.256305 200283.3456 611719.3852 266539.4459 712466.2324 187296.9058 288913.1403 563018.3543 552033.116 821.4747535 127888.6189 385722.2305 582895.3792 556314.7682 404206.1281 634586.2926 588622.8966 288032.4514 344956.2692 441510.0919 274570.1788 427062.2591 460743.8879 743.3074822 341624.8402 348414.9196 366265.8597 496366.4277 152408.5722 853727.7761 128603.6231 435204.8328 238950.5578 132615.5077 458576.9711 1146.954748 271784.4285 229140.8891 359538.7763 538747.1748 167098.3995 619724.4322 391023.7783 310413.7158 252663.2937 Plasmenyl-PC(P-18:0/20:4) 1532.107881 741.8067559 1478934.202 636887.2336 618160.661 770601.794 553745.9991 2121288.766 3138335.531 3550950.512 1442.230319 1617660.667 652730.0814 1849415.776 3202228.717 628923.4933 642794.5791 3186936.376 1564531.945 1427852.764 682960.2799 562374.8341 1744845.65 2600524.271 1313.21545 1502585.812 2761466.942 1333045.105 1489643.557 1468615.237 4349680.091 1716720.515 996944.2007 2425222.957 1616178.612 669039.3865 2073.453244 1487291.947 431686.6986 1994635.698 3012786.874 1672590.234 1712507.405 2180689.156 1419862.776 492659.182 Plasmenyl-PC(P-18:0/22:6) 237.656223 921.2756621 99809.20303 52900.63559 80359.99756 47791.12068 84888.76564 360056.6386 104655.5196 122617.5058 635.6746352 75880.42338 96261.08918 396223.138 113050.5386 48303.64668 36463.54683 129058.6786 95615.68942 357441.8958 44789.86468 84328.49877 258806.717 417153.091 627.9520455 96488.15916 471201.0278 408341.1066 307480.1379 75429.52679 153195.4601 72296.20645 364262.7572 97207.79235 63501.97332 56918.85719 446.1208224 80142.66525 73626.53797 282386.9568 96238.67831 79879.69956 348806.7206 311869.4612 78597.34308 69042.93843 Plasmenyl-PC(P-18:0/22:5) 469.1481696 305.511476 89753.33987 72558.77591 92056.99596 82558.8514 85100.37871 162793.803 205360.081 235675.0825 883.7272453 91860.77545 85655.95602 272260.962 234872.9181 66817.93185 34638.32142 199489.453 105383.3587 234399.6934 66541.69764 82994.57739 220947.0745 341332.1453 101.4992183 118629.8551 346449.3393 237164.1703 266959.9866 59220.05094 254868.8056 85969.42743 240567.4042 97190.20958 102746.4695 69293.5134 358.4419695 112139.2957 77670.61098 239379.823 179553.749 79630.18776 280211.0648 271969.2688 103496.5923 81942.02997 Plasmenyl-PC(P-18:0/18:1) 3218.584216 5832.221072 1250723.43 5312661.508 702496.2781 8707986.924 866452.4265 1591741.743 2906415.696 3412534.525 5281.250801 759972.5029 965623.2936 4670480.801 2637209.676 6553707.219 8907420.075 3135346.793 2073252.982 2381145.228 6719611.439 692749.5577 2302257.286 1691057.388 2831.366955 1991970.907 2081327.823 3515139.202 4093922.847 726665.5332 3744498.727 773483.6053 3173261.874 845494.4147 765973.5515 6604196.583 6291.63997 1854445.268 554315.6692 2712000.203 959962.3945 830136.9677 4512127.615 2663885.087 1186908.96 818755.2653 Plasmenyl-PE(P-18:1/22:6) 903.2791204 693.1228296 225538.2693 62834.65288 352907.1632 70843.14345 293849.5617 312145.2724 95864.07285 77345.50242 1075.43772 96417.3857 382494.3229 576088.118 63901.86611 62823.76688 41382.66986 79577.52893 220101.6697 382182.1715 62210.43258 475518.3416 426815.9952 581171.2195 497.0687404 270135.8088 587702.4542 322624.9039 399358.4644 65203.73591 96290.52118 83033.61789 699719.6656 154629.455 99376.8773 64783.55448 746.5926722 298069.3026 604437.0907 381124.1232 78898.47482 101332.1461 485467.6556 414273.3963 279018.6722 192579.8381 Plasmenyl-PE(P-18:0/22:2) 1328.680166 734.1955497 57044.66771 80654.55403 84325.14902 98441.01704 81362.6243 18983.46775 81699.1164 111014.4701 680.9078552 12592.85954 60103.19114 131917.2911 75771.7608 63473.22358 121060.1826 72832.32193 66512.00215 84987.10481 82125.0059 92285.60121 27157.50008 34521.51862 707.2718353 42254.05659 36469.19038 92574.11638 96562.64302 13845.47051 112904.7132 17553.37562 71323.09228 28648.28005 13503.30984 71499.27757 0 63301.57132 46934.39774 30678.45025 55416.60025 18221.41728 135198.5409 35772.63221 53811.2814 92119.27875 Plasmenyl-PE(P-16:0/18:1) 341.4734428 936.4977113 631204.5205 638395.8412 1426388.241 758886.9189 1013934.64 525998.656 273813.5018 332405.7345 2598.288069 243035.4373 1340898.301 2626520.681 301764.4512 599697.8132 822005.967 298338.4019 523713.9852 2130231.607 618191.4817 1051598.962 743421.0362 707458.8807 2027.936181 667833.6851 674917.0187 2122080.222 2054772.786 322178.9915 405388.1111 300878.2647 2278153.612 424549.6304 247630.8308 583873.7204 1014.271671 550510.9961 1092765.849 780976.4231 340926.1103 353501.171 2761687.533 890892.7706 666598.164 1235047.254 Plasmenyl-PE(P-16:0/20:4) 1188.857798 1136.762064 3047018.619 1381262.44 4739276.599 1595650.246 4228332.966 3413874.788 2249591.127 2328732.799 1059.811176 2913606.84 5090465.245 4830795.042 2336944.127 1275324.62 962084.6905 2234509.163 3187456.999 2148667.529 1294758.284 4293432.393 4354103.547 4760699.013 421.2277128 3363989.85 4993985.175 2502827.742 3946043.904 2787101.484 2939657.034 3208642.524 2582661.421 4493224.13 3368030.427 1411924.302 2000.640393 3122177.255 2536159.032 5160690.623 2233530.518 3515805.801 4525710.572 3662603.254 3331963.199 4487127.067 Plasmenyl-PE(P-18:0/22:5) 341.2064798 640.8946719 374963.1967 209326.1822 447233.2295 249240.1181 331717.738 208802.1259 307136.6761 320090.0993 1663.095978 424068.4082 432638.124 313321.1458 376298.3517 193785.6603 233814.1794 298636.4325 379454.2285 295076.9735 194663.0243 299464.4319 240423.1114 259455.1958 396.3507297 329036.3031 161024.6032 252847.3736 263861.772 383157.7823 334960.194 418771.3703 320845.3883 463833.6567 440113.5843 185943.3997 1400.937171 365540.8878 358548.206 286555.3695 383838.8223 539816.3158 295273.9367 313240.0373 308577.2042 456744.0578 Plasmenyl-PE(P-18:0/22:3) 0 0 116141.9379 54977.68532 72738.82301 37873.85188 90865.9611 36217.02638 165686.0319 237765.991 0 128742.5796 72122.66354 104832.1704 211552.8936 25339.32677 36961.41007 131277.2699 138149.3808 100545.2051 43188.80467 83704.21722 36027.24438 57613.71635 0 105096.4687 48820.59444 110348.8445 61919.31689 136961.242 275952.2348 151568.4583 65733.40424 273354.4252 93364.90962 35114.48169 0 81946.94998 46697.15259 46445.61486 190981.6693 201305.9925 120701.2621 60578.00672 111594.9066 107684.7326 Plasmenyl-PC(P-16:0/16:1) 2268.423564 1249.458616 360204.1341 755354.216 995854.1582 303764.1306 639145.2165 616070.7405 494763.918 461753.839 1650.881294 226827.2099 661805.8651 868472.0826 429548.751 885635.1129 298606.5188 373604.4429 409435.0361 733396.4616 677318.6323 617023.8647 943102.9622 783178.3759 1591.351336 456052.5241 916481.4721 605803.3431 1218259.277 244019.9603 558208.895 235713.8292 755010.2041 304866.7984 254165.309 783213.4434 1297.146588 564401.1218 636824.8749 1275829.932 610783.7001 310122.7075 1183358.657 1212660.367 509425.5755 899869.8712 Plasmenyl-PC(P-18:1/22:4) 0 288.1693263 95182.625 40751.00763 61693.96208 37354.2041 79331.97685 128812.66 213490.5443 197745.3494 287.7123345 48316.14118 79857.00477 89609.24661 250499.8508 25602.46005 52061.02511 235123.0718 86027.05674 165149.0869 33956.93353 63559.48373 76658.19386 183050.1659 0 80366.13767 156523.9924 158920.6015 80554.71204 47968.16931 277247.6531 56036.21038 189211.7467 75839.61622 47553.34479 32256.11877 34.61589803 73695.78388 73006.80563 94592.99345 214916.008 41879.6348 92789.44078 125825.9578 89716.42513 76697.20526 Plasmenyl-PE(P-18:0/18:1) 3077.707864 347.8622306 282599.8857 843176.8692 407956.0399 1075653.233 342244.9592 152264.7398 252658.6325 331821.1622 0 137431.0148 387062.522 875090.3809 251630.7415 758307.1995 1100916.411 295128.9972 307501.8481 885965.1533 825453.8244 354989.9923 248422.6253 180197.2512 0 298765.1581 215409.8681 836052.2893 895440.5715 162545.2123 376536.7744 144344.8984 907222.8969 239188.4623 159260.577 680331.9272 1423.500409 295527.6373 280497.3635 249124.2425 207620.2491 198301.534 1141729.485 283754.4707 294758.5964 286679.8513 Plasmenyl-PC(P-16:0/20:1) 1797.780757 1046.042812 487720.5845 1183553.526 409654.8104 1308088.472 367199.0176 594493.5141 693902.0227 725969.948 2051.588583 163160.2722 496499.338 1532180.81 646473.8445 907051.0543 1247143.45 658044.6472 612154.1852 1740763.711 1067633.086 391722.0243 838052.3665 624639.9493 1113.452931 580802.9928 691916.3767 1727023.757 1231002.466 179000.655 795818.4043 166494.7115 1767703.698 246798.3504 168565.3681 947937.1756 1375.687019 614134.1941 398865.9996 937291.1577 616602.164 185477.5173 1426267.534 961041.9507 528419.7405 484061.4977 Plasmenyl-PE(P-18:1/22:3) 3870.775746 2382.650056 762404.9509 299336.3886 373381.4369 346155.4319 486472.4956 265655.7334 1189587.26 1482879.581 2049.963952 1600355.835 338948.5759 515052.6636 1163217.149 273629.2543 312819.2566 1198659.362 1182629.817 152956.0802 270162.7815 248714.6833 297102.1328 319626.2838 2030.086398 882748.4331 327358.7014 156330.5592 217643.6322 1709412.274 1607870.232 1470994.977 335615.939 1229255.636 1525017.177 264779.1402 2092.861729 716247.8935 408702.1768 290572.6551 1216286.958 1846249.231 265555.3743 327163.0063 1004987.263 464587.9435 Plasmenyl-PC(P-18:0/22:4) 352.2426323 350.0264526 162496.3522 81191.40265 116587.3936 84147.08789 125484.5448 242009.8547 241927.5201 455587.4663 43.213141 128543.9475 151148.1507 169225.1841 513347.4226 89378.03755 79658.80753 376700.5966 163606.8415 393579.4683 97105.6951 133058.2607 206893.2876 271850.0734 0 181918.5441 274420.1177 335397.675 171079.3378 129584.0455 444603.9695 132576.2123 365794.9204 169285.3374 133572.0878 82548.02198 0 167677.4231 116712.3742 215158.0291 475161.7356 160385.8842 174973.5997 221021.661 185691.4014 122239.427 Plasmenyl-PC(P-24:0/18:2) 0 1009.571437 113873.3437 261171.0605 75084.25844 289167.7364 69831.1119 67865.11437 187190.8471 245392.6947 0 62513.86678 64058.73521 100707.2833 175456.7478 152370.4324 247534.6951 188735.6573 118909.1847 84856.4059 149538.4984 70419.94197 82943.37612 67129.30957 0 91375.94452 78085.72934 94247.80346 88591.73176 75532.38735 305675.7968 48451.58715 79704.02276 108444.595 71488.08975 154203.2136 716.2484836 104539.4369 58842.47178 88724.05006 168342.5617 77514.06059 94060.57769 84741.79418 120891.9894 65964.12586 Plasmenyl-PE(P-18:1/18:1) 1372.724603 640.2241699 352173.1095 1368000.004 439224.2011 1635136.61 299646.0249 145592.4105 248179.7272 278433.9867 1646.614024 149006.9449 451255.2083 1610322.04 245019.3919 1121850.699 1485928.277 126057.6986 380596.6815 1242199.063 1104337.783 271736.8908 283577.0087 249407.6704 365.9080858 388782.0888 275567.7667 1053838.062 1091781.358 161532.5742 312283.9629 162080.4704 1128175.688 208560.7002 171508.4624 1388610.132 673.0414513 375458.6418 208003.5515 350992.6719 209674.7898 193071.23 1516344.341 377288.8849 376692.6207 348925.8728 Plasmenyl-PC(P-16:1/18:1) 1905.925622 131.2126461 182877.9046 310869.6551 161180.4819 418113.8171 208495.5589 215385.4105 158418.4943 174858.3576 505.9775061 127117.9159 230872.3167 603871.6572 168748.287 248546.8515 224917.5056 187531.9621 167706.7065 395630.7039 304671.7658 174298.8772 279279.0552 234114.2176 408.5811544 174751.0375 259135.6989 370817.2616 376650.4702 147829.3039 207569.4224 138784.5128 355264.0298 137694.4909 138081.4909 270642.5419 627.8790471 129492.9949 146043.9823 274110.6854 178972.9502 126842.9015 502182.1118 301755.1347 131890.1109 150617.9765 Plasmenyl-PC(P-22:0/16:0) 1450.981964 742.0549135 612993.0275 1735233.096 429231.4161 2209359.488 432279.1333 520988.0927 816582.8392 1132971.573 2203.425817 192821.7053 490177.088 860114.2082 919222.8657 1166936.116 1449269.693 958121.9293 595160.9889 562471.9748 1225708.053 376077.3553 754500.2172 596582.8691 1119.683203 573912.5456 617641.7054 556257.3673 715106.4819 280986.6126 1549511.721 256451.6981 617870.881 543608.2549 401625.3071 1137365.833 1850.708316 604579.7097 316460.6666 912394.3826 991747.2821 380304.9903 840569.5834 931988.5959 638330.3102 417595.4468 Plasmenyl-PC(P-16:0/18:1) 4800.923236 2800.149568 1780998.441 3365483.683 1505041.113 3724792.44 2102460.205 2378779.658 1924150.494 2047658.736 3953.840648 1016855.398 1458573.284 3293042.155 2022956.55 2699796.791 3386998.939 2198819.38 1854486.402 4463653.189 2661388.797 1463356.079 2710117.686 2586037.464 4715.072027 1944261.699 2571414.673 4187725.119 2870477.523 990158.0268 2439065.976 1055604.376 4367349.149 452739.6812 892039.9267 2781567.895 8763.884777 1845495.852 1534782.509 2917207.425 1989049.37 874996.1186 2634245.02 2908700.077 2069052.431 867683.1729 Plasmenyl-PC(P-18:1/20:4) 1435.418279 1558.041071 593969.9435 418209.1504 573245.4782 494317.1666 557418.8325 1434576.244 1460909.996 1379490.402 837.4739942 430210.5441 639919.437 1188601.216 1547280.553 406385.7975 398104.8374 1309612.336 694241.5596 2159719.927 454131.4976 571553.9767 1060541.613 1806425.258 1706.129614 723099.4856 1940791.045 2533121.539 1076968.438 268451.9357 1712290.403 461723.3529 2747416.393 623794.1695 420000.3954 443889.514 2077.33748 641914.8245 437601.7005 1074425.1 1430090.095 527637.2446 1109932.792 1242793.058 639856.8375 320276.5414 Plasmenyl-PE(P-16:0/22:5) 6584.659958 3914.610746 367577.4187 255147.3231 489752.2555 365082.2888 312068.6845 454294.6215 235218.1151 148522.6813 2694.188486 362341.6608 572937.2246 623361.8276 229630.4276 371877.0515 84490.91229 223148.9789 419582.0904 439299.3919 385043.92 418753.2186 594950.0033 583990.7292 1994.964983 508025.8693 548741.2485 413806.8244 467878.2476 432894.3484 319215.6516 480916.8275 430406.2231 487291.8175 437019.3443 401822.6245 1642.244545 423028.3114 468850.7898 641317.8104 173832.7083 516037.6034 631433.2076 710737.5375 473787.6393 465697.0635 Plasmenyl-PC(P-18:1/18:2) 567.2288526 64.9885894 113007.2503 399607.3884 76792.79587 483591.3961 39293.25097 85042.29563 273011.3612 420483.9505 132.6012128 155278.979 44367.87968 168957.4006 187669.292 226659.0768 280532.122 255844.4196 130891.0239 180875.2863 324008.1324 48330.02556 198325.1703 114228.7319 345.960211 148047.23 157250.9885 162153.9998 245976.22 127391.8078 398203.0574 97103.10733 170153.4181 87225.81206 177315.9994 262753.7257 67.47223821 172826.0067 41324.38921 321151.1234 229496.8238 148333.8424 186849.8377 301355.9656 161679.9138 70073.17249 Plasmenyl-PC(P-16:0/22:1) 0 0 78721.60368 153948.3517 83143.30158 148167.3863 93995.93326 58152.91118 61011.3477 114609.1421 0 8786.550558 73275.31081 158651.8756 92440.55634 103456.9239 106664.6531 27386.5995 88994.39888 151901.5944 118806.3152 64542.47842 89892.05572 61262.86122 0 55468.32699 73826.86432 178326.7749 116595.2249 9660.040841 93946.36847 10679.99328 235827.2028 8837.234313 9376.494833 103108.1154 0 53656.5356 57467.00726 80556.52213 72137.42862 17472.15751 116903.8991 94069.56782 57537.95617 111249.6793 Plasmenyl-PC(P-18:1/21:0) 0 0 14397.91352 16623.56065 28922.42215 33451.43692 15063.35689 23479.02921 17884.37194 26556.0571 0 16850.46927 21377.10681 39033.20021 17572.47687 22074.8224 21337.07843 13504.24304 24612.03705 26947.44647 26281.22396 28489.46718 25288.7667 16893.62495 0 22864.55938 21141.65961 24980.31091 39310.35234 31057.74617 26774.45754 10672.47578 31396.22903 13424.80093 25540.61498 20395.07025 0 30817.01695 26239.47568 29911.73923 17020.45151 19111.22913 31176.17217 25396.77832 16628.6702 19262.0476 Plasmenyl-PC(P-16:0/22:6) 575.5424614 0 197642.0054 84324.31745 181952.7001 103074.959 244148.6813 471525.4642 153491.3032 146100.2113 0 154646.9952 229264.787 329908.0241 156670.0423 89883.80711 33987.80586 122573.029 225220.7606 1075228.013 107849.2603 201038.2197 340223.4905 581640.8345 104.3116623 174934.0628 621742.5431 1171799.71 173911.961 114610.4687 157121.2287 141611.4164 1018823.596 136489.9983 120924.1249 96352.30701 623.3340877 167226.9477 222662.0397 297731.162 125802.6815 119609.2757 274202.6739 348755.7123 160721.636 188296.5612 Plasmenyl-PC(P-16:1/21:0) 481.3353321 947.3113407 187322.6539 250658.5086 274287.7811 217708.4748 280285.8535 354200.3374 337832.9838 280056.3417 607.6102732 305847.6387 184752.3917 298630.2824 312185.7482 276864.9519 249727.9681 254764.8016 341050.907 310409.8383 231439.5793 225572.0877 342816.3788 277770.4569 786.7349501 272762.5228 72759.69465 230683.3067 361096.4582 290987.9991 249098.8974 289017.5542 96851.78026 59850.48018 197969.4921 254901.3892 547.2451853 261119.2601 368802.1174 284343.2941 179127.4594 237610.8262 229615.102 259391.7898 217864.7739 153774.1071 Plasmenyl-PE(P-18:1/22:4) 1047.009639 0 293508.9729 54887.43682 346976.5021 60787.92302 276126.3998 126968.668 293571.8918 331288.3576 348.881196 471245.031 344511.2322 216357.7074 341041.9818 56595.88299 45843.41584 326217.8979 365286.1494 147334.1147 58289.34484 268525.7963 143498.3334 225519.8532 420.2039715 345785.2472 185349.5609 124710.1019 175009.6749 428427.7578 334129.7306 554225.4767 166887.5847 207647.5142 446471.956 53760.17275 0 300891.7644 242370.3324 160359.5454 242256.2581 382119.17 181456.1762 178126.3766 304282.4721 275492.0159 Plasmenyl-PC(P-16:0/20:3) 299.9786272 579.2472965 214099.7778 310723.2271 96743.66643 338085.8699 100070.4191 172420.875 353778.9135 413516.4932 284.7960737 261874.1551 110902.1292 220055.8991 366948.8031 317910.4368 183146.9409 396676.8366 223396 337096.474 302893.7071 101895.9018 201104.9484 113945.1024 0 212026.3522 191822.8421 409065.8483 180083.719 197308.3685 524671.2211 245656.1149 434648.572 276694.7474 206948.6209 324491.1801 0 156224.732 84915.37405 165167.6596 312820.4021 219837.7758 191924.7992 194885.0798 190367.2677 84883.17341 Plasmenyl-PC(P-20:1/18:1) 2454.794471 697.7156841 132183.2691 209693.2213 165377.3027 253229.9142 132625.4617 222720.9189 301442.0684 331083.2507 656.9532633 48043.20615 169518.0882 136262.5805 261909.0906 251010.2739 249411.6542 265601.2285 142079.5789 540927.2167 212956.0106 120098.7979 323186.7314 247170.8533 721.1021559 135173.8671 290263.7724 311136.4082 213038.3217 58127.16466 355487.8138 54025.82703 601835.8116 72654.71541 73568.12155 232682.4983 729.4332871 157691.8417 112924.0684 285970.3252 251752.6961 59314.61408 391463.7491 346369.1535 136940.7576 128666.6117 Plasmenyl-PE(P-16:0/16:1) 2535.542439 1709.209714 96948.80822 78304.91895 307707.9657 111314.9294 84611.46811 82133.98168 34421.90609 38537.29465 1673.960791 26339.53478 319196.9333 380498.9051 26301.61609 71307.89392 79075.01214 30940.55702 121819.6446 232651.0981 89033.36024 258098.6012 160210.7809 123906.56 1301.425381 117813.2203 118227.2724 204352.8327 294216.9145 26097.93886 37523.66381 30584.76061 240065.4055 52257.42326 27124.10033 83634.38417 1611.068671 110855.7079 239076.8523 195919.6204 26821.87502 37339.70541 391148.2887 189592.8691 112265.057 282866.336 Plasmenyl-PC(P-16:1/17:0) 1014.261477 326.4387467 45542.03815 7367.761809 171170.3228 7084.814198 89856.80545 40800.50203 28433.93427 30187.52279 101.0185212 12624.33148 169516.7227 94313.04816 39216.23337 8164.909185 8057.473256 21205.17564 81441.20854 14472.64619 6558.215871 166465.8846 133828.8567 74357.73014 66.12853825 77988.86104 62752.568 6054.499153 152587.8562 22838.50509 31912.04452 26929.50771 15420.39931 10824.0415 16007.59977 9267.926645 0 81488.20935 177222.72 143294.3556 28277.21101 28377.20391 125551.098 108660.4517 77082.50961 132807.4033 Plasmenyl-PC(P-16:0/22:4) 2243.336809 1000.019692 310410.6732 147049.3212 350958.7146 195986.9303 313003.801 606342.7651 705289.7522 669501.9301 1033.07219 357071.1195 390850.4953 558116.2247 641450.5953 178034.6408 80986.7114 382051.3849 374515.4833 1096872.06 183313.6578 345004.4821 459080.8883 424970.6004 1542.943123 399304.8083 687356.9306 556529.4147 402020.1395 229366.1908 690105.033 354171.8254 508737.3536 430987.4802 337261.3739 166133.9279 1399.151176 216409.7284 315216.9905 296798.6983 436978.455 353651.0021 500430.1863 345778.1733 383807.9789 352836.3746 Plasmenyl-PC(P-22:0/20:4) 0 0 11552.64112 14149.29677 19870.21135 8490.36354 15609.08991 17557.74315 13435.48377 16390.06303 0 19397.65775 15037.65671 15799.93132 15905.25669 6730.51939 20941.72691 30056.58919 18762.7056 26623.31911 9784.722933 16153.00888 12145.67854 12811.31811 0 19569.17588 17569.77383 29005.71568 9927.859783 9206.257861 15371.77154 18552.6386 17743.20729 9303.592822 6146.837941 13239.97754 0 10266.4629 12008.0445 18100.72556 7919.074086 8404.550373 20008.2985 15077.86006 14501.20368 14718.71382 Plasmenyl-PC(P-16:1/20:5) 476.4469922 994.1965427 447213.521 182412.5518 515503.5118 210976.6936 83282.59824 263125.9574 108036.2569 183264.3105 0 280665.5613 329714.0289 268216.6598 128331.8589 145604.1634 136281.1511 139643.3953 559112.9642 455424.0101 191019.5165 667074.9447 539361.1914 446887.8545 379.7375114 560998.8684 83247.40658 333609.2065 598059.2604 250294.0372 221391.2194 257998.7921 397263.3 143549.446 308456.7046 191729.3602 350.1572064 497039.8706 738297.9796 466054.2141 116906.398 343770.5603 244788.7752 475477.8983 350353.1469 58499.15322 PS(16:0_18:1) 1890.999575 1416.243469 682332.3885 329263.498 1031599.894 341599.0592 940212.571 438189.3515 227641.5821 300965.3602 1086.043248 331993.317 1150021.205 1220409.42 284383.6801 275818.3618 366826.2378 301197.0365 689884.8705 557312.7154 255072.8181 922683.4597 625003.9402 601322.3322 1207.564243 673298.3512 552701.338 624777.5566 961440.6081 447155.5012 384939.8447 463259.2774 598068.2171 742041.1457 497801.7406 342042.3858 2072.682408 721375.706 903584.2947 652606.695 252375.995 460091.0034 1138491.534 705037.8675 679410.8122 873021.483 PS(17:0_23:0) 0 1454.308496 118175.8997 102285.551 76708.25529 170929.2402 107639.0622 56454.68481 73802.12607 58012.27596 0 85549.29501 114363.649 55892.15684 76159.79199 125046.1623 60505.99603 52000.87581 109557.3319 102936.9523 155869.369 81781.6245 47710.53994 33960.12801 1633.658644 99145.47777 28982.24092 76278.30174 57212.50697 135563.4341 76885.04339 106912.6231 68589.51306 136640.1176 127970.0189 179205.6959 872.1776646 120432.5585 98262.0904 42366.11123 83181.15103 119093.6365 60176.35773 42638.31857 118786.9433 103874.193 PS(18:0_18:1) 744.1822831 270.3586981 394533.7353 92797.65517 659529.1205 117223.2886 740472.8791 455039.6263 196339.0972 151376.0089 892.6733572 207656.1832 454749.9231 542903.4087 176959.9118 103390.291 86611.83742 155348.5943 463448.8437 446800.7375 119170.4724 346280.6769 515420.3768 383434.9763 341.8081481 434738.1376 495883.5634 1166691.258 746080.197 216798.9741 175084.7778 213678.6867 1107684.764 200990.7071 192002.1527 102595.8349 1154.240894 371863.861 556061.7691 487074.9902 145423.0794 227124.9529 813062.9487 558118.8585 262717.9418 457008.8761 PS(18:0_22:4) 369.4038837 670.7086894 427735.7766 110384.4284 233683.0768 102439.518 251952.5982 198066.1653 530029.5743 513337.1874 32.60491693 659291.1917 358309.7428 130178.206 513362.8162 99603.7935 97364.26189 502732.1576 422220.017 102551.2853 108091.1517 278877.9398 237172.8981 247335.4089 34.64651004 456077.4596 233237.8595 93997.61531 100706.3955 493815.827 602558.2354 620848.2974 130732.8993 780547.3019 546349.5951 77532.99108 175.4799478 390762.5747 232258.9644 226259.4923 314806.7282 695555.0182 117715.1634 294562.7037 321641.3411 299729.8471 PS(18:0_22:5) 266.8600544 409.2317388 204136.8133 112488.4367 190468.3702 119346.4986 190722.9859 180929.199 197454.4531 223577.7393 301.5136593 174479.2364 243249.0401 111492.5507 198348.265 108008.728 70223.25795 208954.3947 238182.4398 99229.20765 100368.7731 254871.0725 359270.3593 280923.6119 342.5645278 223410.2167 246039.2331 73703.1582 106397.5771 82142.20101 210575.0062 165640.0152 100034.7087 202256.1675 142099.8065 82064.76343 252.8862126 241446.182 181131.0298 392182.9516 197589.5563 179536.3489 124506.8243 424662.9363 227426.6432 227070.7796 PS(18:1_18:1) 1706.608822 1048.763198 295221.9199 2234358.158 190559.6222 2457754.926 363979.0034 229983.6764 535432.4343 636948.2542 1470.050376 454011.722 377862.4088 487620.4099 720692.216 1656859.398 1355242.277 865190.9414 644229.2729 332996.9903 1842676.235 329116.9913 403578.5498 339316.3962 1466.201739 592908.3709 155839.5775 297630.8645 368334.5076 360041.8923 915497.4666 471916.1735 331536.1194 633865.1959 441471.3237 1653377.282 1436.596368 605733.3364 297505.398 463657.9842 599566.5058 591738.5712 474954.0083 413135.9902 559546.3789 89617.05769 PS(19:0_20:4) 400.3705858 131.4467383 148719.6203 20958.7691 411022.9721 19330.8722 466034.4358 16329.36476 54300.92123 61012.35805 466.8757782 29593.95074 566976.2783 116031.4142 45260.78074 17248.45431 15583.53387 51109.90405 137138.4059 45586.70099 14403.09738 300626.9676 32843.45901 38413.97014 392.1473243 107671.7432 23710.24208 33119.24097 88290.31391 25770.84957 55883.95722 30339.44937 31813.03823 35054.36025 28890.1365 15629.82288 372.872997 112769.7998 360868.5794 37352.90898 37946.79223 35753.01226 111622.6029 45838.80959 134125.6571 466761.8571 SM(d16:1/24:1) 2253.627606 649.7613159 258281.8579 301186.9567 267179.6093 360143.8792 370697.093 665012.2243 366626.4644 758510.7887 0 350078.0249 214989.5709 394521.3526 572943.9501 256427.9374 211175.6688 600922.7873 418355.42 1038648.759 395827.0856 337486.7178 407536.9901 683821.5154 674.3306824 259397.8426 745128.2179 521308.656 692037.3441 255072.6475 861896.6866 195747.6808 627269.8655 404972.6846 223863.1551 327427.3869 0 311864.944 412477.2648 318565.193 668346.6443 323749.1635 805963.3035 350701.9573 247574.4152 342282.4198 SM(d16:1/24:0) 2680.017481 0 994137.0496 926708.158 852525.8417 1016981.829 719179.2688 1115017.41 1412649.697 1470423.535 1678.789413 1002761.609 696307.6209 1213056.338 1367188.348 859142.2602 822387.3809 1613631.058 1028167.3 1153682.574 886345.9236 713998.242 1281551.792 1353444.634 675.436557 990764.951 1453541.74 1492078.729 900513.4795 773593.4139 1879832.898 904431.4708 1901398.207 1067134.047 1003649.927 808842.6826 1715.885749 976144.7019 634022.6446 1202504.579 1374265.627 798946.8431 1055649.677 1513275.639 945619.0128 561501.2007 SM(d17:1/24:1) 685.1228195 645.5392405 427817.0391 286338.0268 520623.3795 308849.1637 407591.6716 538454.2306 601804.3532 413383.9944 1384.820855 444521.0149 431094.9698 744307.7403 339219.7189 248747.8056 249698.9919 399563.0045 396927.2726 592783.418 159844.6901 388888.974 616935.0936 617713.2744 1380.099885 422895.8692 704633.8912 540671.3155 624634.4608 201608.8342 469356.6337 342524.8562 716677.8454 380808.9401 358841.2093 229815.0105 1377.21665 355360.9516 407971.8995 601431.7661 463657.0396 345108.9513 718693.5677 681599.5588 372175.0403 437021.396 SM(d18:0/16:0) 1114.602644 1511.130649 1550170.652 1388595.565 1709530.719 1392050.682 1073436.499 3351690.741 1999879.696 1796085.644 2514.690269 2259663.255 1277663.784 2933421.655 2416052.223 1878918.084 1405891.114 2370594.387 1902617.467 4866773.65 2050469.879 1167102.131 2868430.163 4896851.141 2588.862934 2114262.601 5083556.228 4690914.345 2629374.625 2095148.427 3297754.322 2725030.771 5138577.757 1122291.81 2947407.616 2115647.262 2640.116469 2150153.511 1787078.831 3006126.317 2563455.576 2353313.524 3331537.926 3125075.279 2139945.297 1971130.695 SM(d18:0/24:0) 665.4964417 0 161062.1103 110120.0354 73533.65836 123965.489 84666.57616 177744.7448 140852.5242 206084.9776 0 35906.067 105736.9989 279556.4363 284170.4938 90789.19561 54180.6675 178872.3668 138019.3549 128780.6031 73352.37816 56388.39828 233382.7595 289059.3532 691.8765015 122762.3193 135075.9964 257432.0054 225332.1352 57866.72093 205426.6485 93713.42339 274616.6632 53444.33649 88877.3448 77313.56629 692.9909027 108919.5729 135688.748 205844.0574 286867.4572 130153.7183 112197.8206 394381.1732 68066.54861 64133.6216 SM(d18:1/12:0) 4313.692861 162508.7181 289186.8609 280960.5908 233506.0113 251963.82 239603.867 235409.3923 254676.3102 307257.4141 222065.5313 281771.6781 203364.0257 203583.4394 264074.4895 313501.6564 178225.5247 298490.015 316628.7611 255914.3798 251279.9234 201302.2739 236880.8445 230851.9522 202170.2912 260723.2403 169563.3148 308845.0363 259020.389 233195.3962 358158.175 312557.8375 203794.9381 221233.7593 234818.9762 280269.9655 195299.3946 323995.4156 212696.8805 231521.7192 261120.7154 268122.8955 204958.1659 230062.3726 281846.0686 277058.6072 SM(d18:1/16:0) 919.4264061 477.9787394 360640.4011 448560.4905 389160.5856 516621.2335 299099.4451 195182.8708 257008.2992 296177.37 341.9872937 212001.1008 377546.8802 360952.7279 253200.5956 320219.3657 419538.1004 269273.375 350420.0879 191514.6581 336372.862 323354.2335 258967.1463 265980.2778 131.266257 378253.9761 323194.1275 203409.6792 251517.4753 246766.7148 387695.1372 245914.243 239101.1616 263334.4094 251423.5675 286274.6423 135.6241837 323538.6538 311388.0449 254024.7737 225022.4178 230366.4702 273340.256 282699.3694 317893.9676 344307.1734 SM(d18:1/18:0) 1291.945906 329.6326998 1612328.494 1233084.908 1634216.574 1311599.271 1320812.277 1453311.181 1466905.876 1381631.561 1237.305836 1512228.579 1342089.908 1476925.654 1542553.34 1237219.569 837704.9687 1451216.715 1709428.974 1954308.215 1314197.803 1329403.675 1242019.677 1856536.175 561.1181444 1726420.534 2085227.42 1972706.606 1219793.103 1570409.958 1803950.389 1789662.086 2249853.494 1197527.942 1872827.101 1170220.604 778.0972217 1633585.399 1350994.26 1760539.162 1499178.021 1908902.794 1413117.648 2093404.005 1704068.508 1521654.11 SM(d18:1/24:1) 4844.276995 5785.046634 3392266.142 2316515.48 3550540.741 2735409.013 2732969.959 4365758.61 4858026.197 5957941.473 7602.045483 2431090.236 3173467.492 8100556.92 4879834.413 2385971.797 2160753.92 5703246.254 3658125.565 7712320.282 2306553.683 2867993.82 4735003.285 5069525.097 6186.314109 3511684.968 5436983.186 6770236.171 8117467.317 2642443.062 6055367.112 2613906.275 7464015.43 1069250.885 2594680.112 2059361.848 7184.105288 3335293.643 2392796.388 5021125.359 5189083.751 3023196.589 9144654.074 5374922.935 3556319.561 3489136.215 SM(d18:1/24:0) 2327.49043 2379.58992 1731853.141 1944178.217 1420100.667 1998747.408 1270606.402 3401335.29 3135981.237 3672620.881 3474.501744 1237904.506 1302305.433 4300897.616 3407045.656 1490871.304 1860068.616 3577396.56 1801242.838 4640247.63 1654805.846 1092559.288 3907738.078 3568275.151 4235.729071 1831764.678 3629538.505 4292607.348 3985567.684 1006050.703 4113646.299 1095918.844 5018187.041 938988.6037 1252380.166 1589585.41 3144.35357 1837289.842 1241714.579 3778563.482 3117370.171 1130335.912 4326845.811 4074591.613 1752305.957 1164471.871 SM(d18:1/17:0) 365.8278266 163.7529667 330208.4606 290599.2476 215127.0019 404173.3007 144520.4638 296942.1895 208230.5118 155387.5991 0 229166.8106 289387.9873 370597.3073 273262.1858 272013.9031 81499.49945 273365.1784 405817.6984 347417.0371 383260.6836 229603.5252 228894.2354 245125.8287 307.965843 376893.3671 398774.8652 396545.8587 140309.9595 262280.1783 331751.7031 254101.9294 413316.7851 474722.7988 238986.1305 246495.6628 280.7590687 278562.3475 307627.7262 231196.3407 141467.7338 151593.2948 232606.5344 164899.4072 297631.3841 174697.1183 SM(d18:1/18:1) 495.0515349 265.2995506 206721.2771 268091.7395 422026.2768 285397.3411 334415.2004 165819.3932 276036.3181 297528.2027 1039.231854 260261.5364 320639.7883 380084.897 272336.2924 299500.0369 84748.71874 240541.5962 327016.6997 685263.4268 335112.6134 283855.1386 384430.6897 474077.0562 1107.037485 341158.3583 594579.8515 481629.7858 309094.133 183442.4357 349273.222 255875.9483 806913.1055 277047.5721 291391.4956 297722.2929 544.3599013 311569.2309 398849.2729 460714.4079 290081.9865 269752.764 376088.537 572278.3005 327092.499 421243.884 SM(d18:1/26:0) 43.31140623 0 25214.70722 21194.78258 56216.52861 39212.40318 37452.61506 111423.4954 44385.8396 39690.44185 0 11613.99499 36083.64052 101954.6775 36209.08135 25103.36083 8006.908577 30604.02996 35124.33123 103089.5792 29049.51037 47163.53554 114845.3224 91881.11272 1774.164521 24082.35942 162347.5872 70873.2737 47532.45487 16474.60456 60541.92701 8810.698597 79651.3255 15731.06691 11089.26608 21888.44726 0 28551.0944 45728.20287 133639.6145 42189.86905 12270.83592 106855.0474 150272.284 28749.9449 26362.47068 SM(d18:2/14:0) 0 0 92321.15071 81907.21603 113024.1754 93604.73894 100197.657 61591.68271 70924.86147 62560.16718 0 53617.2167 128738.4792 150260.5082 60948.77212 64928.15928 36986.88351 68951.13534 109363.3102 93398.26679 82310.14493 54566.44339 61357.67368 60922.85163 0 105700.5371 101850.9114 119893.1172 103478.4937 57048.95493 95731.72386 55444.57197 159421.8643 83727.99917 69463.39338 83322.74786 0 103858.6549 83612.35288 55777.92625 53780.94063 77565.43444 136295.8511 77082.89741 108038.546 74926.7868 SM(d18:2/16:0) 1332.460386 1072.164505 1265678.432 1057883.962 2134958.484 1177182.531 1737380.557 956546.6923 852187.7844 1006302.903 2659.811635 715819.9242 2092978.458 2574772.844 821263.6807 958386.1462 636457.2352 985757.7221 1698099.209 2171797.764 990360.6344 1611154.605 1310994.253 1498655.501 2365.371261 1459063.724 1573566.165 2271255.247 2205490.452 622814.4072 1332716.305 699652.1805 2081907.201 1112533.193 825645.8817 998462.7094 1185.771011 1403467.816 1931271.04 1569432.518 943286.4759 823787.5246 2573937.304 1779066.274 1414275.263 1891418.957 SM(d18:2/24:1) 1705.484111 2002.905117 613987.6629 479377.7134 675862.021 529679.6834 496996.5005 840986.006 1276005.411 1281461.212 353.6427281 613099.6935 475226.8246 1812378.459 1150280.902 479038.8513 417534.5412 1330297.213 638927.1343 1840043.027 422587.389 567698.2574 814456.4975 1039979.974 1331.876057 864031.7178 981639.0086 1567651.364 1532965.277 544890.7152 1415118.355 540272.6476 1938111.941 414817.9372 580241.0423 416396.7839 2674.785557 624296.5428 484307.1803 756821.1319 1039702.129 590351.6958 1790576.842 899496.7422 869431.0333 477445.36 SM(d18:2/18:3) 267.8830457 0 152049.2494 167243.524 252860.0442 163640.4278 225136.086 153367.0931 155452.8389 150343.5738 1009.49728 146068.0129 184732.2948 262836.3919 170418.2483 175340.7741 96844.79359 149591.8045 207890.3584 281178.219 208106.7152 237632.1257 154786.7404 145226.7547 547.580387 221651.2456 234952.6779 338436.618 207843.7697 92734.83893 227587.7282 152406.4802 278457.9114 106060.0627 149101.6777 188546.9075 0 217163.8449 249113.7634 249691.0312 153286.6449 96906.27273 270110.8827 143978.9213 206671.2046 224432.5926 SM(d20:2/24:1) 0 663.2681091 93184.3573 34873.93256 187944.2678 49743.01119 163969.5094 371691.4304 131108.4027 137514.535 0 73630.47163 141874.2587 510022.295 93125.53305 32332.53353 16240.15637 77471.54735 90219.9068 315881.5274 29412.85272 167663.6877 353242.6604 379174.119 746.9651917 97778.28697 560797.6787 295206.6764 450470.3218 66560.50717 140340.4457 52741.84761 341792.5684 108137.0568 72432.61665 37436.03581 0 122326.427 133406.8926 413805.0043 112127.6828 79158.358 477893.3307 453236.4277 102267.4913 155372.563 TG(14:0_16:0_18:0) 11235.63653 13073.93851 72341.86696 164830.1022 412768.976 231642.7001 122893.1925 95114.65748 181063.1564 87636.7536 10392.04341 51942.66129 294411.0868 93827.10491 151122.1684 139192.5767 209234.393 150556.3698 96973.21836 127496.2582 212745.7254 165488.6113 57986.91019 60420.98259 7890.477582 98758.85285 99311.38796 122864.7607 44028.35528 74273.33244 141423.9868 58096.62305 115110.4723 95989.60212 49010.61317 134274.956 7275.791083 97699.37799 316360.1148 55368.01729 107804.3397 94515.47853 125390.5955 48663.66064 119206.0545 146720.2123 TG(14:0_16:1_18:1) 9993.442072 4464.123035 116598.0787 706388.7385 582287.4481 763838.9229 478620.3684 168416.4196 382476.3522 199502.5612 8666.579797 255279.931 500653.6472 1438190.216 300180.8243 865022.5193 807165.9949 222244.1443 231068.0682 189984.7138 811443.4474 523241.6672 91639.70245 140373.6352 4998.229434 207345.4235 182370.1613 181729.9187 1158367.847 139643.9306 239669.2602 196442.7335 108279.716 214432.2369 163760.7175 835418.1094 6416.077069 171260.7698 376629.5372 89570.19689 322569.602 262183.5687 1595425.154 124061.8673 180232.7448 506287.5774 TG(14:0_16:1_18:2) 1046.113965 1404.59779 15167.4755 61096.70431 36878.64769 184111.7982 30143.17951 12635.60378 29790.66511 15132.18132 695.1772735 18677.97525 28738.17967 137984.6693 14308.45392 61634.09237 46378.22573 14575.68757 12909.07399 15335.53828 90868.04456 40628.93109 5340.667062 11375.4279 988.8888572 18433.71953 14510.67116 5138.271042 101263.1364 16313.58225 21668.31884 17595.31049 6235.773175 39526.76138 21862.46951 139477.7194 0 22642.27408 16279.674 12239.85825 9987.891571 12478.09657 247258.1646 10340.8878 25221.89163 25364.57423 TG(14:0_16:0_16:1) 13777.69326 4468.990599 106121.9851 354248.4382 262215.1293 504880.222 202120.896 87299.50769 162210.7374 113308.5355 5794.56754 112212.1921 248471.2456 399185.4413 124969.4731 264059.4323 328530.7729 109526.2633 133412.2508 83233.99551 308829.0241 216118.6213 43685.5772 76565.83753 6554.707513 138471.1394 60711.91503 79710.56839 348374.4111 79547.54775 87668.18202 97305.39937 89094.60401 216236.5324 91608.5871 306464.2665 7561.204438 94146.29278 208306.7139 44225.52197 125978.0108 146808.869 443601.1574 56201.3642 105476.9784 249264.2907 TG(14:0_16:0_18:1) 12676.28024 11145.50009 378355.7948 1515098.194 883707.1587 1632363.796 720223.9643 295065.3901 661756.6449 495637.0488 11383.28311 272023.9963 738413.6416 777401.6748 533867.0179 1137555.885 1455431.445 498366.4417 357930.5201 531380.2994 930032.71 636272.8442 135825.3157 181010.0886 10725.06604 373192.1895 227110.9083 319892.8965 748534.9598 288975.3493 574342.6491 295864.4459 451099.8306 206702.9773 321123.1683 821980.3993 9378.03742 295652.6227 737804.7806 139471.344 611297.5536 389791.1387 1088393.481 304041.4344 333451.1194 767915.0425 TG(14:1_16:0_16:1) 3853.950396 3480.672591 47774.62642 82543.83086 82806.59476 63616.56264 78207.6712 46799.51412 44399.28458 27003.17602 695.1772735 39938.92495 32568.24266 213636.6833 42187.92656 79237.99262 73221.09613 18888.91762 42942.22695 17374.25066 44014.0975 75149.40693 19474.96941 29643.89385 1578.151726 21531.10511 29874.65449 22266.23127 202431.207 51704.36794 40924.98503 36618.2122 18937.82916 44749.75567 53055.63348 68047.96954 2595.936789 35510.16618 48789.801 20059.24304 41419.59514 52958.35634 123374.8239 23583.71122 32631.16938 83687.62107 TG(15:0_16:0_18:1) 11070.43053 7706.934223 54392.58556 223692.4854 115432.4957 309240.3325 62454.00353 64986.48655 81721.05856 42689.80337 6510.732408 56754.67304 82964.85024 87690.17698 41676.90221 193277.6578 249204.9649 66074.0189 38020.75503 68259.5454 199818.3648 93881.33092 50239.4123 47836.73131 2199.989278 57241.95478 58288.50743 43800.48491 59139.27233 16355.51012 32156.95724 48688.98742 44868.6921 69174.28704 32448.76405 145399.754 742.4608582 38759.20559 43172.70535 24841.20182 32333.62021 51279.10281 98594.02998 31075.46789 34401.18416 107492.6287 TG(16:0_16:1_20:4) 0 0 47573.19865 23948.91882 40792.13952 21748.47932 25473.32868 21743.00091 90413.88497 29473.12977 0 77981.37553 37613.93285 97544.53333 83068.3232 29920.35731 22889.49184 42373.65737 35003.6371 41360.60568 29673.50695 40159.82748 7139.510347 27986.30831 777.6580383 39251.18045 30460.55635 48008.79903 100914.5394 41819.82137 41923.65419 62545.24237 48707.25669 147145.6447 68739.01017 39705.4071 1131.438303 38360.62588 36915.18872 8316.422417 116252.5298 50183.15091 80278.49561 18859.4166 40623.04664 40572.61138 TG(16:0_18:1_18:2) 12848.68468 13249.38833 867537.7547 3874947.735 930072.9044 3969194.166 994404.1708 576654.9914 1687840.932 1118498.513 10602.4345 1080898.516 974728.0707 4073304.134 1577823.082 5124280.299 3675852.355 1294953.342 777019.3425 1046088.002 4457765.692 1049987.756 197128.2533 389628.729 10589.99186 803656.7822 534999.6183 844949.3722 4015648.724 888679.5433 1495307.886 960411.8129 1019197.569 621448.2004 1021554.163 3688693.441 11951.89933 759894.705 760538.0811 186435.9957 1630861.299 972555.2069 5297688.008 415128.8976 742731.1833 911800.7614 TG(16:0_18:1_24:1) 2825.183844 3454.682499 97750.06541 753411.1785 341212.8609 645551.353 166745.1205 92817.60925 295360.984 144757.3926 3638.894672 58280.60791 297432.0158 578463.4872 296948.5157 451547.3659 563938.6693 226137.2852 113795.2138 133765.506 417770.7419 273616.9273 33495.43665 40758.13603 2005.093867 111775.15 54732.36835 205524.7247 488863.7714 65984.79096 297558.1539 65852.73824 171909.6596 93948.16973 49460.66002 535955.6617 2992.145942 94964.96019 289601.6251 38913.11557 246007.6947 76272.67452 518846.2855 91133.31009 102569.8805 115682.6871 TG(16:0_17:1_18:1) 5706.918168 4188.574078 101418.4469 473460.9935 145124.7548 630035.2548 137425.189 77596.72609 159143.7928 96091.01999 3060.250426 134899.1477 159786.9773 322300.7101 130491.5066 479295.056 575978.1497 117795.8424 78028.19254 134786.6286 568528.756 164117.1649 50281.40412 65215.29017 3640.772557 104978.8245 81082.24044 109040.12 257835.8063 87444.50183 147613.1914 97949.67746 110386.5361 173445.3352 76455.05073 484650.4508 3012.758841 87448.54809 133222.1236 42009.72117 130508.7485 106720.7269 356549.6433 52316.16538 93872.61644 164849.9702 TG(16:0_18:0_18:1) 7813.09187 7614.145277 305210.7129 3224826.822 981245.3065 3956919.924 380065.2554 112489.1528 858006.7854 637964.1813 10222.51142 545132.233 494665.7777 824714.1995 765883.5278 2449942.476 3359021.067 901028.7063 429884.9328 947776.7329 2630211.948 493672.8246 107870.5865 68009.73972 5862.617627 437557.4388 98558.81855 629208.7171 828373.2802 448157.23 1038393.543 469581.1806 634719.4279 541421.3866 432444.3081 2479126.294 4746.066017 407226.9504 569786.3005 89286.37841 841612.8398 467250.1954 710009.1441 165089.9014 401984.3309 310320.7579 TG(16:0_18:0_22:1) 3282.701302 3995.017689 24875.05177 476968.4902 148234.1513 458607.7962 48812.33926 28046.32037 118774.3663 74934.93572 2942.470478 31969.30109 86418.77049 115938.562 123257.2866 264597.405 413895.8962 81604.85826 39347.16157 56597.50413 278335.1134 101936.7949 13863.25689 11527.28423 2659.373353 36728.97847 22938.2565 78886.9746 42625.12598 17964.64303 103266.7984 25583.80141 67690.96643 31403.38442 15500.90825 214006.2814 2618.695285 37156.21864 107657.4815 16805.19701 96346.38225 25876.44942 98454.08051 24376.02385 36013.19677 36258.03141 TG(16:0_16:1_18:1) 12592.80687 9379.429593 736980.3361 3054435.308 1453912.863 3332214.766 1309448.491 527805.1261 1386817.789 844487.2939 8169.17879 796733.1496 1297110.187 2842429.776 1318838.537 3409162.621 2850283.689 920118.0139 734255.0501 1109305.141 2764024.147 1223065.67 261187.5456 352652.7409 8637.882217 804447.7082 471933.3836 837448.6124 2837459.235 697033.6623 1153605.492 660902.8858 990181.2637 471143.0654 679153.1636 2333955.033 12337.08425 629043.4144 1075710.022 227347.9791 1348112.535 819959.4977 4015325.788 496653.9949 619946.5009 1311772.236 TG(16:0_18:1_22:3) 8165.616863 5385.041481 361918.9374 860211.0332 265755.4437 1000147.593 229566.1147 205792.2009 606421.8177 463841.6429 5181.107496 450405.6791 284873.7772 1341581.101 691973.7366 825039.047 868990.8837 506920.8012 397677.554 429486.9813 956483.3871 268904.0535 80922.99348 185787.8718 2748.862184 349613.25 258715.8602 356817.7109 1152181.693 410962.6217 696494.2514 409377.5313 403614.5036 640971.6917 427135.8682 684797.3244 5080.203183 313667.1774 199366.8936 66272.84822 478857.3647 514194.7 1563068.54 126714.3367 341470.1355 201697.2706 TG(16:0_16:0_18:1) 15125.74088 9366.735579 585779.9887 2098325.393 1708466.23 3334054.945 1058104.013 363858.3681 1196712.928 868442.4981 9676.378066 447673.7722 1224959.827 1375487.712 1295424.143 1892003.91 2770449.95 1146036.393 571735.8531 990083.0142 2182387.505 1168409.401 285472.2917 262982.6885 11957.72543 605119.0326 416362.7865 1150309.47 1417926.757 526379.6107 1090828.573 486985.0955 1045509.646 424523.3361 432103.7394 1565180.98 7268.491355 563647.9172 1229570.479 221410.6824 980079.2254 619003.5666 1736619.138 404082.7524 621232.878 999283.7323 TG(16:0_16:1_18:2) 6901.512228 9754.025117 235255.508 981863.6818 533899.5666 1185732.035 514093.8248 269820.551 571716.348 280918.5529 4819.822683 272033.9703 545996.1822 1784723.131 454186.6872 1329238.27 1139318.071 372047.9072 296446.4516 246909.1913 1162283.944 545101.5904 94233.32114 187589.6125 6515.788697 304925.916 289611.6547 227654.6309 1827181.28 302357.8054 420096.4682 230206.11 264887.6489 112858.988 152205.5704 1340294.766 4521.547895 254256.8179 373204.423 93906.25788 537794.3872 190895.4584 2492596.05 173363.2281 252369.641 478104.9363 TG(16:0_18:1_22:4) 4617.106089 4201.53179 381445.3263 548446.8248 260925.9446 570624.8015 209935.7572 257458.5122 1037684.057 526883.7552 4039.257524 630917.0777 218956.1019 1031327.279 881183.9826 759166.6148 596668.7946 569996.8268 406165.3373 602968.51 748306.2784 213648.284 65043.04591 191129.4497 4488.947894 381809.9131 265695.3934 512228.2527 1017964.532 363711.4555 705834.3397 623679.1471 534427.0384 688753.9863 557287.5634 713881.1888 5307.823552 322327.0539 195351.7516 64831.9232 910461.6026 490670.0838 1249630.662 90570.61233 336011.0836 215610.9994 TG(16:0_16:1_18:3) 1778.047671 2080.518057 101262.5793 138753.8507 88741.93091 178349.6077 94623.07002 60956.58275 137840.1028 77994.4773 753.904633 140038.9055 88423.89507 414635.3844 123297.876 138305.4864 100915.0247 68908.71768 95362.75039 41298.32088 139414.3953 94198.9275 17814.32051 47137.24844 868.0320906 94545.36927 55522.38345 47321.02045 361341.6054 80664.77592 98327.83449 127548.0085 52654.90912 154127.1347 108975.5808 169053.6724 1177.396698 74539.27946 71406.71052 17371.48221 124600.4859 138206.6823 380034.2883 36363.08992 93063.80639 85204.49204 TG(16:1_18:1_26:0) 1423.582458 1941.538869 81508.54394 644644.4863 492802.5249 768307.639 222387.8936 78696.86137 290164.2116 132589.4126 2373.970771 39337.39596 301873.9589 585136.9691 247607.571 455760.5146 824183.05 174937.3619 91789.57012 176095.6136 593154.1218 485492.4484 38525.84067 32159.27392 1147.989422 87017.49352 79750.73198 160815.0702 383512.2673 36347.33758 274680.8896 32985.52819 153981.7135 93925.80104 35978.74178 545893.2188 2175.912335 94079.69377 295972.4608 43249.81642 332003.1486 62755.94675 583458.1503 76262.08441 91382.69749 118586.5059 TG(16:1_18:1_18:2) 7656.690594 4196.464463 320036.4361 998321.0427 307069.5855 694868.9309 311093.6501 250591.2473 414035.59 129314.7541 6934.116502 559849.5914 327637.8169 759667.8055 644198.3387 981565.3507 1315212.474 43483.43101 324637.1168 52878.89354 1134748.175 335902.8495 63958.61356 175251.9047 6877.20442 345837.7047 243884.946 258076.4188 1132908.082 451315.3172 343206.0326 456620.9079 309296.5183 308838.9665 451523.6057 1444979.224 5273.118988 291573.9652 218596.3608 64101.68655 581998.6445 496110.0313 783236.652 104229.7474 322711.4315 243883.2248 TG(16:1_18:0_18:1) 14805.75582 13251.16522 1083120.562 5223830.998 1943820.784 8298051.182 1461927.349 592163.2949 2882377.954 1914531.594 13781.44747 1159272.326 1729785.433 5027907.801 2819449.213 5814699.655 6693407.783 2315498.862 1093765.466 2031492.327 6321881.698 1449218.741 328015.1904 456971.7022 13597.03067 1232556.364 796390.6913 2457109.82 5011495.175 1205399.913 2252663.468 1358657.505 2312353.855 915574.1292 1080836.753 4809645.737 15259.74798 947736.7884 1408410.913 281114.8165 2263015.562 1577775.538 6563375.701 486104.4041 1279521.892 1216473.254 TG(16:1_18:1_24:1) 675.5755774 1867.177579 54313.45942 485053.5346 212784.4533 471157.9089 153229.0326 79696.13864 244836.1695 166537.2538 2044.098424 114846.0696 155092.1164 607894.0397 193080.7413 488783.8492 507432.785 148292.7649 78649.90759 135973.3148 404618.4072 207923.8362 28434.64853 32678.43518 53.72283852 71577.74904 84546.77867 139696.2557 361756.0854 81057.99246 277780.0529 70320.14404 138117.3145 154671.8397 108375.8375 438027.9833 1188.139724 84643.69466 133648.4831 23182.07266 230323.5725 105576.1805 678656.4614 70857.21832 86432.63315 101007.9244 TG(17:0_18:1_20:2) 1061.488654 693.95571 27724.06425 229459.9709 25449.94239 332882.3148 27292.45327 20614.71752 35892.80428 33209.40973 0 45524.8159 27110.33359 152231.0454 41379.61006 138950.7424 176187.8962 44716.27087 31093.07231 30236.98984 238091.618 29971.31535 7432.080152 20726.16473 1152.717621 33853.16427 20754.19107 24587.26665 42515.63003 11756.70507 37417.85915 29704.71258 31691.40836 50162.20349 25359.92077 169197.4522 0 26701.70182 17381.11281 15425.66115 28547.37023 38964.84029 160694.4915 9618.918529 18866.55775 21697.87523 TG(17:0_18:1_18:2) 1792.747645 1397.055087 47274.7402 324831.5047 46714.16716 354376.4122 58046.62512 29866.06717 85647.22602 61696.21922 805.66514 84717.07012 64547.63726 224170.8131 84967.73594 119178.1234 337268.6849 67813.85964 44828.96523 61692.75905 437532.453 59966.99533 10919.54525 29669.87534 1086.835919 57590.96517 45087.83594 47580.45438 186933.0239 21692.31098 66364.36835 64609.63488 66172.10057 59760.00845 41737.13926 360913.4617 1490.419971 48238.99082 43861.50391 11364.27466 72840.96181 58448.54336 203279.5854 17743.67524 31637.79172 37918.25182 TG(17:0_18:1_20:3) 0 0 13719.55968 45786.99053 15750.91047 40640.17238 8079.320964 8259.840379 17715.25042 12000.23013 0 16456.87545 6010.066674 35199.12328 10933.75148 13953.92612 41894.41348 13591.39749 9198.040203 12356.44033 132551.8252 14718.20351 4326.857079 10213.11627 0 10211.06475 14834.88237 7586.017381 18209.6395 3961.275814 10170.66171 16263.24918 9868.107539 14239.36942 8737.576266 36867.28151 0 10076.48475 4123.828099 2130.435346 12628.66057 15332.69242 50426.94445 2263.063943 6162.161115 6642.174085 TG(17:1_18:0_18:1) 2460.757471 1070.138205 102185.3744 373423.3752 106144.3092 554877.8883 85899.98066 50893.87816 151010.4461 74291.23742 2704.472036 121036.7745 82470.47877 214448.5268 101073.0715 729608.0482 626185.7217 121566.2689 88343.44888 122685.7697 566414.9695 91954.75101 20227.11356 44989.91157 1640.638333 77886.5665 67365.16763 70365.793 88580.64776 39629.73189 107835.3293 86404.52019 72345.08299 132730.5834 65619.16173 464387.797 1700.164863 66129.35095 47190.70463 27774.42549 66194.85163 103840.759 285163.1052 36799.98837 85356.4451 64251.40473 TG(18:0_18:1_18:2) 19368.78725 14912.44965 902566.1811 5037115.335 763936.6197 6500582.82 603498.731 419500.3799 1577388.254 1166591.798 21227.38378 1074391.315 828735.9309 4723473.674 1441554.536 5904746.348 5465789.297 1299708.219 812545.311 1437325.227 6412818.222 804758.1065 204593.1545 415038.314 15931.27064 956274.4064 588351.1099 1319826.868 4600160.076 997035.5249 1332486.413 1253136.729 1257895.811 606068.9173 918380.243 4799163.085 19073.94808 624234.2479 617027.7592 178615.1127 1354144.914 1286667.076 6477410.029 338968.1816 1002556.261 521416.7726 TG(18:0_18:1_18:1) 8548.665543 6634.627369 659629.0035 4375953.299 748612.8626 5599952.082 410846.573 175450.4103 828426.7571 702713.61 9476.724553 919655.7247 479546.3636 1772855.161 813542.5051 4125837.152 4883216.252 888352.9792 607204.7861 1160995.139 4290453.072 533602.7901 111870.1549 69098.902 8247.216285 604460.0113 128407.9867 798093.7627 1497149.828 740912.3336 1058769.304 812176.7585 881686.4085 635127.1346 713832.9848 3772491.001 10131.78841 575050.9192 414239.1503 99225.00308 819862.121 795355.3702 1544703.306 150345.5088 580255.0183 420609.4383 TG(18:0_18:1_20:1) 2978.011756 4149.970106 78366.81295 993448.0929 202404.7716 949344.3453 146770.503 54008.27466 192249.1278 207244.4993 3628.351284 144487.3298 159130.0946 474346.8377 209410.518 926372.4028 631715.7426 220092.5216 104795.3706 194829.712 421693.0844 198611.5881 26947.76264 26332.51943 2215.18666 95397.37501 61447.95869 196999.1134 259630.1969 114526.2689 332973.7713 99714.98202 213255.5478 200041.1847 122341.2416 614282.3387 2967.036712 101703.8141 122646.9309 22705.3138 256903.116 137183.9423 453293.0131 60782.2523 130711.9121 134276.6469 TG(18:0_18:0_18:1) 4361.387012 3772.913194 81585.97417 1540532.104 162428.1779 1462110.597 72387.70948 51195.9168 181814.9049 190038.3727 7725.665232 204659.2551 136409.5156 155201.3181 159313.0435 1206334.768 1410253.241 198649.1007 103173.4591 177296.0165 922743.2727 137808.9292 25916.54341 20528.99511 6012.970752 108943.6834 34974.94527 136379.7593 89904.95694 81380.49626 289089.9226 143901.923 159063.876 212018.1697 84936.37797 898351.9486 7099.319463 81817.15495 140657.4691 24024.07419 170545.3577 180691.6238 173545.516 46623.82435 106651.8924 45437.44068 TG(18:0_18:1_22:5) 0 0 89604.42626 90651.04031 42309.45927 78192.41864 20377.16849 30719.13008 214738.233 57606.94422 0 332146.1076 42013.23575 159020.2563 201305.1956 114031.4685 110114.53 100693.837 75984.12326 116763.4454 113997.1784 44676.6602 13579.2578 48560.37208 0 95568.81262 59298.34879 86094.52486 70956.96517 42979.56176 108926.0777 165136.6344 64593.28884 115313.3634 53534.60944 79993.64198 0 51814.51253 23067.61634 9481.61277 194445.664 128987.4647 213976.6836 12074.89167 52357.0207 28474.77245 TG(18:0_18:1_20:2) 8457.441043 5832.804714 212168.1005 1094480.391 312295.589 1735213.898 250481.5193 131363.5042 590068.0201 304237.711 6150.330901 289931.9921 260168.6416 1492446.602 353258.7011 1208850.402 1348690.761 536825.0606 279555.0068 402721.0324 1249886.673 285739.059 61501.50447 103019.9977 6278.72222 207781.0963 147714.4904 448348.9077 1363265.145 362272.7285 475633.558 393087.7327 358450.8531 154528.7619 310080.3784 1186263.71 5230.09704 261443.6009 222536.7597 59487.17875 503848.9406 264916.2086 1444152.874 118192.5401 249007.6164 201006.7101 TG(18:0_18:1_22:4) 0 3171.62533 188033.7101 184758.4904 122247.0716 197864.7693 107645.4266 142737.3035 408551.7762 148625.1844 1172.517959 235547.9706 100339.7248 585709.8471 328135.1552 254104.5986 218439.6691 237884.5487 177189.4032 162553.9273 192126.1015 118349.3327 31292.67288 112130.239 1839.577744 140880.3289 175126.0613 146440.672 382490.4041 138143.1108 262514.1515 288526.7247 194507.0944 258087.8432 241129.8385 212836.7686 1971.646499 154385.5698 73561.94922 29350.44536 279179.9335 256972.6763 624074.6671 42946.96758 135911.3042 70412.87447 TG(18:1_20:1_22:3) 0 0 16980.26145 19898.01718 29244.77461 17624.9827 11884.01555 14294.51604 36808.89536 19371.59209 0 27859.15506 13581.54475 71973.79808 33135.83924 22171.63646 14783.11658 22174.35835 17770.69193 13644.56606 13644.53517 15846.90374 5660.189035 10186.94509 788.3592418 15230.81944 15913.15977 6273.649677 14568.54215 20744.08541 30642.04646 88097.96969 12012.16282 27505.71935 24073.14776 19809.23896 0 19864.43909 19987.91742 3396.552291 29363.67876 31790.97885 84837.95473 7019.39502 22612.6089 5158.016713 TG(18:1_18:2_20:3) 2571.102887 1405.418784 213297.1626 235164.2994 156375.9402 202428.003 122372.9249 194896.5264 591914.1542 241738.2607 3955.27194 430644.2572 123988.6318 528354.5577 452835.6561 301249.3363 241089.6884 250550.7698 233762.7831 507482.3309 317993.1726 129336.3132 46219.9656 129142.6267 400.2472135 228134.9813 196380.7759 410944.2697 487344.2115 209257.2918 440616.3281 355405.0935 416738.4997 325016.0251 339210.0972 349424.469 3771.855991 121477.5698 121909.4805 35826.6599 604131.4014 299172.0049 624248.2049 75553.55819 192474.8902 145371.6744 TG(18:1_20:3_20:4) 0 0 17179.69749 28006.05882 8589.056426 30844.84859 9225.574858 15103.47732 19797.52641 13112.63795 0 40107.80304 17337.34403 67629.33011 38473.28509 19836.49221 23232.72127 16167.38364 23446.51654 54250.59961 22655.76256 6731.624659 5581.209996 24261.40422 0 24907.8366 22022.00868 97064.38928 39004.39899 23989.11539 21918.01303 45062.81454 161551.9021 27424.80981 21517.48155 17181.01362 0 16869.93193 13562.47564 8660.20716 36017.07034 30327.80819 190420.3205 10019.87445 18028.76574 15823.13316 TG(18:1_18:2_24:0) 633.5135518 183.6784827 77094.18806 554252.0995 271415.9706 570885.4295 167749.5493 104324.418 222325.1343 149689.0363 1218.274645 68505.38118 264624.9899 803134.3253 275734.1495 412436.9073 584653.4627 179282.4289 104566.0101 96800.10516 534475.3296 264421.1328 32194.00882 41749.55572 1233.612995 93350.06 62725.66109 135135.7603 706339.6718 80782.00367 267089.8383 56520.08093 123072.9418 125160.7758 64810.32282 612410.6674 1886.231878 106254.0072 255244.0821 44147.33015 246189.0302 84701.05441 762011.6404 76489.40283 99118.36664 107581.954 TG(18:1_20:2_20:4) 0 1423.892678 117605.5379 96901.52295 71182.26141 134328.6615 53676.94179 111541.5782 201701.4184 112083.872 371.8234675 227776.2384 62454.36678 313464.9692 214107.6714 152700.3606 126337.4714 112009.6123 103838.7594 141382.0714 119919.0023 72829.68303 22710.89106 83763.17259 0 122117.9689 126031.5842 172446.5775 249757.3207 106239.3588 172640.6987 208462.4009 149037.8472 149882.7466 206372.7612 140080.98 756.7691162 89697.88393 46411.07767 23530.69835 237363.7624 150912.7405 375058.7205 37140.59003 94360.24713 64378.06479 TG(18:1_18:2_24:1) 48.31117383 378.7087639 42738.30433 146574.0816 77583.62549 162917.9937 64175.57167 41050.92239 138250.5908 81916.46713 447.894535 62578.79918 89845.01357 237201.6334 117601.4427 194251.0343 183641.1054 91418.06182 51015.27931 38411.93388 185249.6388 93405.10841 10633.61804 34595.2416 0 51609.23246 45413.6314 37054.87302 152515.0859 42405.77543 115795.4397 60531.76268 45149.32542 93935.45766 38665.17748 190539.1357 480.4586102 35417.79344 68843.3454 9776.712084 123077.6289 88221.03799 221633.8729 30587.25797 62102.17568 28227.41265 TG(18:1_18:2_18:3) 3508.433831 4165.157511 116978.8422 153346.5879 123415.6074 138673.4926 84781.18798 90906.01618 248584.5461 127230.5958 4375.611369 87799.24825 82321.88659 252155.7011 234106.2129 219900.4763 132412.2964 126725.7171 115870.747 169334.8597 166990.0641 99372.75176 36740.67784 84026.3679 7067.12882 125034.6276 108477.4253 183845.8492 234749.639 113765.8332 153035.366 164285.6436 213325.0586 171314.0582 165987.5591 203933.2069 4560.674281 105881.4729 85075.77212 36766.71727 240889.1954 141168.9329 308448.1289 49970.45518 99258.09656 114404.8981 TG(18:1_18:2_20:4) 1145.19138 0 49945.24758 52233.60038 60876.84379 70131.01453 45461.99855 67559.6382 111881.5602 66219.11809 369.789611 65006.15084 38047.80803 172451.4117 93723.75425 93599.13931 49459.54227 37025.64764 57646.76853 176303.4334 70799.86868 39527.11902 25998.97922 55381.80071 0 59579.18973 88775.63366 224742.0362 122918.7576 62137.41128 74245.46998 75299.60614 259711.097 84653.74948 100890.0939 71605.09884 0 56347.12155 38907.83712 15064.34524 142640.9565 72388.85027 160889.8308 26255.98565 49037.56512 61132.87016 TG(18:1_20:4_22:1) 0 0 60525.21464 31976.17455 33635.08407 21940.91771 34308.38086 61229.21183 74569.71142 54069.16393 0 137744.7649 29126.6845 143468.5189 79608.39057 24041.00922 28573.39059 58503.99118 78971.72722 25559.32183 18039.38342 24988.45759 9084.36014 30984.48422 0 61198.82401 39648.44783 41122.49374 87019.95183 60153.0269 55397.32608 93760.14909 45985.22581 117906.5923 136381.0488 32413.47474 844.2669119 42703.96974 28292.39224 7558.174238 75553.56406 110618.1474 96951.07107 13582.1009 43907.27374 25038.18139 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 AcCar(16:0) 400.3422836 2.024262757 1_AcCar(16:0)+H 2761.90171 AcCar [M+H]+ Yes AcCar(18:1) 426.3591547 2.149526496 1_AcCar(18:1)+H 2294.93846 AcCar [M+H]+ Yes BMP(16:0_18:0) 768.5821027 11.69484268 1_BMP(16:0_18:0)+NH4 4499.98286 BMP [M+NH4]+ Yes BMP(16:0_20:1) 794.588044 13.96255854 1_BMP(16:0_20:1)+NH4 | 1_BMP(18:0_18:1)+NH4 1328.072149 | 967.050149 BMP [M+NH4]+ Yes BMP(18:0_18:1) 794.5966607 11.90093476 1_BMP(18:0_18:1)+NH4 3500.853186 BMP [M+NH4]+ Yes BMP(18:0_18:0) 796.6094032 14.16535479 1_BMP(18:0_18:0)+NH4 3036.982051 BMP [M+NH4]+ Yes CE(18:2) 666.6177277 17.6736687 1_CE(18:2)+NH4 17183.0067 CE [M+NH4]+ Yes Cer-NDS(d18:0/16:0) 540.533626 13.97381167 1_Cer-NDS(d18:0/16:0)+H 4448.04341 Cer-NDS [M+H]+ Yes Cer-NDS(d18:0/24:1) 650.6375443 15.29005641 1_Cer-NDS(d18:0/24:1)+H | 1_Cer-NS(d18:1/24:0)+H | 1_Cer-NDS(d17:0/25:1)+H 4327.11245 | 2743.04619 | 2539.04953 Cer-NDS [M+H]+ No Cer-NS(d18:1/16:0) 538.5175964 13.02664939 1_Cer-NS(d18:1/16:0)+H | 1_Cer-NS(d16:1/18:0)+H 6450.65219 | 292.99993 Cer-NS [M+H]+ Yes DG(16:0_18:0) 614.5698032 15.51891077 1_DG(16:0_18:0)+NH4 21431.0275 DG [M+NH4]+ Yes DG(18:0_18:0) 642.6012432 15.97558354 1_DG(18:0_18:0)+NH4 | 1_DG(16:0_20:0)+NH4 29004.707945 | 233.997126 DG [M+NH4]+ Yes DG(18:1_18:1) 638.568805 15.06904081 1_DG(18:1_18:1)+NH4 | 1_DG(16:0_20:2)+NH4 | 1_DG(18:0_18:2)+NH4 | 1_DG(16:1_20:1)+NH4 1570.06441 | 474.00558 | 121.998082 | 101.999602 DG [M+NH4]+ Yes HexCer-NS(d18:1/16:0) 700.5712236 10.35876809 1_HexCer-NS(d18:1/16:0)+H | 1_HexCer-NDS(d16:0/18:1)+H | 1_HexCer-NDS(d14:0/20:1)+H | 1_HexCer-NS(d17:1/17:0)+H | 1_CerP(d16:1/24:1)+H 75548.50414 | 11296.17805 | 5679.06228 | 5659.05965 | 2224.13514 HexCer-NS [M+H]+ No LPC(14:0) 468.3059217 1.447030556 1_LPC(14:0)+H 8451.16648 LPC [M+H]+ Yes LPC(15:1) 480.3074099 2.323133943 1_LPC(15:1)+H | 1_LPE(18:1)+H 1314.97652 | 1016.008172 LPC [M+H]+ No LPC(16:0) 496.33873 2.094699187 1_LPC(16:0)+H 106285.0142 LPC [M+H]+ Yes LPC(16:1) 494.3311492 1.724592308 1_LPC(16:1)+H 4558.91847 LPC [M+H]+ Yes LPC(18:0) 524.3693438 2.927064228 1_LPC(18:0)+H 98853.5634 LPC [M+H]+ Yes LPC(18:1) 522.3549406 2.208526829 1_LPC(18:1)+H 67850.0607 LPC [M+H]+ Yes LPC(20:3) 546.3581228 1.976434599 1_LPC(20:3)+H 4193.18013 LPC [M+H]+ Yes LPC(20:4) 544.334006 1.705318565 1_LPC(20:4)+H 3806.85832 LPC [M+H]+ Yes LPC(22:5) 570.3539838 1.796302193 1_LPC(22:5)+H 1084.025597 LPC [M+H]+ Yes LPC(24:1) 606.4477952 5.237311181 1_LPC(24:1)+H 2732.98938 LPC [M+H]+ Yes LPC(26:0) 636.4984169 8.956306584 1_LPC(26:0)+H 14700.2614 LPC [M+H]+ Yes LPE(16:0) 454.290891 2.201021519 1_LPE(16:0)+H 169.004649 LPE [M+H]+ Yes LPE(18:0) 482.3235783 3.094712083 1_LPE(18:0)+H 1858.044969 LPE [M+H]+ Yes LPE(20:4) 502.2936867 1.800674342 1_LPE(20:4)+H 117.00313 LPE [M+H]+ Yes MGDG(13:0_18:2) 702.5530588 14.22763971 1_MGDG(13:0_18:2)+NH4-CO | 1_MGDG(18:2_13:0)+NH4-CO | 1_MGDG(15:1_16:1)+NH4-CO | 1_MGDG(16:1_15:1)+NH4-CO 547.995852 | 547.995852 | 340.001142 | 340.001142 MGDG [M+NH4-CO]+ Yes MGDG(13:0_22:5) 752.5710583 14.05680427 1_MGDG(13:0_22:5)+NH4-CO | 1_MGDG(22:5_13:0)+NH4-CO | 1_MGDG(15:1_20:4)+NH4-CO | 1_MGDG(20:4_15:1)+NH4-CO 971.959166 | 971.959166 | 670.959806 | 670.959806 MGDG [M+NH4-CO]+ Yes MGDG(15:0_18:2) 730.5891905 14.85226582 1_MGDG(15:0_18:2)+NH4-CO | 1_MGDG(18:2_15:0)+NH4-CO | 1_MGDG(16:0_17:2)+NH4-CO | 1_MGDG(17:2_16:0)+NH4-CO 278.9886 | 278.9886 | 186.99835 | 186.99835 MGDG [M+NH4-CO]+ Yes MGDG(16:0_20:5) 766.5870203 11.18371008 1_MGDG(16:0_20:5)+NH4-CO | 1_MGDG(20:5_16:0)+NH4-CO | 1_MGDG(18:2_18:3)+NH4-CO | 1_MGDG(18:3_18:2)+NH4-CO 3446.762 | 3446.762 | 3346.772653 | 3346.772653 MGDG [M+NH4-CO]+ Yes MGDG(16:0_18:3) 742.5849883 11.2766 1_MGDG(16:0_18:3)+NH4-CO | 1_MGDG(18:3_16:0)+NH4-CO | 1_MGDG(16:1_18:2)+NH4-CO | 1_MGDG(18:2_16:1)+NH4-CO 992.03446 | 992.03446 | 969.034576 | 969.034576 MGDG [M+NH4-CO]+ Yes MGDG(16:0_22:6) 792.6010597 11.40145508 1_MGDG(16:0_22:6)+NH4-CO | 1_MGDG(22:6_16:0)+NH4-CO | 1_MGDG(18:2_20:4)+NH4-CO | 1_MGDG(20:4_18:2)+NH4-CO | 1_MGDG(16:1_22:5)+NH4-CO | 1_MGDG(22:5_16:1)+NH4-CO | 1_MGDG(18:1_20:5)+NH4-CO | 1_MGDG(20:5_18:1)+NH4-CO 2766.91642 | 2766.91642 | 2761.913766 | 2761.913766 | 2740.915938 | 2740.915938 | 2735.91586 | 2735.91586 MGDG [M+NH4-CO]+ Yes MGDG(16:1_22:5) 792.6001579 10.89604708 1_MGDG(16:1_22:5)+NH4-CO | 1_MGDG(22:5_16:1)+NH4-CO 1746.021643 | 1746.021643 MGDG [M+NH4-CO]+ Yes MGDG(18:1_20:3) 796.6312737 13.90955107 1_MGDG(18:1_20:3)+NH4-CO | 1_MGDG(20:3_18:1)+NH4-CO 1640.104179 | 1640.104179 MGDG [M+NH4-CO]+ Yes MGDG(18:1_20:4) 794.6149918 14.03456926 1_MGDG(18:1_20:4)+NH4-CO | 1_MGDG(20:4_18:1)+NH4-CO | 1_MGDG(18:0_20:5)+NH4-CO | 1_MGDG(20:5_18:0)+NH4-CO | 1_MGDG(18:3_20:2)+NH4-CO | 1_MGDG(20:2_18:3)+NH4-CO | 1_MGDG(16:0_22:5)+NH4-CO | 1_MGDG(22:5_16:0)+NH4-CO 877.97535 | 877.97535 | 872.975129 | 872.975129 | 836.973879 | 836.973879 | 820.976349 | 820.976349 MGDG [M+NH4-CO]+ Yes MGDG(9:0_22:0) 706.5763728 9.320399187 1_MGDG(9:0_22:0)+NH4-CO | 1_MGDG(22:0_9:0)+NH4-CO 286.00224 | 286.00224 MGDG [M+NH4-CO]+ Yes MGDG(9:0_9:0) 524.3806271 2.933568615 1_MGDG(9:0_9:0)+NH4-CO 2190.10388 MGDG [M+NH4-CO]+ Yes OxTG(16:1_18:1_15:0(CHO)) 848.7390747 17.44399573 1_OxTG(16:1_18:1_15:0(CHO))+NH4 | 1_OxTG(16:1_18:1_15:1(OH))+NH4 | 1_OxTG(16:0_18:2_15:0(CHO))+NH4 | 1_OxTG(16:0_18:2_15:1(OH))+NH4 | 1_OxTG(16:0_18:1_15:1(CHO))+NH4 | 1_OxTG(16:0_18:1_15:1(Ke))+NH4 | 1_OxTG(16:1_18:0_15:1(CHO))+NH4 | 1_OxTG(16:1_18:0_15:1(Ke))+NH4 | 1_OxTG(14:0_18:1_17:2(OH))+NH4 | 1_OxTG(14:0_18:1_17:1(Ke))+NH4 | 1_OxTG(16:0_16:1_17:2(OH))+NH4 | 1_OxTG(16:0_16:1_17:1(Ke))+NH4 | 1_OxTG(14:1_18:0_17:2(OH))+NH4 | 1_OxTG(14:1_18:0_17:1(Ke))+NH4 | 1_OxTG(14:0_18:0_17:2(Ke))+NH4 | 1_OxTG(16:0_16:0_17:2(Ke))+NH4 | 1_OxTG(18:1_18:1_13:0(CHO))+NH4 | 1_OxTG(18:0_18:2_13:0(CHO))+NH4 | 1_OxTG(14:0_18:2_17:1(OH))+NH4 | 1_OxTG(14:1_18:1_17:1(OH))+NH4 | 1_OxTG(16:1_16:1_17:1(OH))+NH4 | 1_OxTG(18:0_18:1_13:1(CHO))+NH4 | 1_OxTG(16:0_18:0_15:2(CHO))+NH4 18340.2522 | 18340.2522 | 18027.2561 | 18027.2561 | 16983.9305 | 16983.9305 | 16695.9569 | 16695.9569 | 16387.7153 | 16387.7153 | 16252.7249 | 16252.7249 | 15696.7565 | 15696.7565 | 9966.507 | 9737.5118 | 4756.1941 | 4655.2001 | 3705.9699 | 3615.9808 | 3420.9855 | 1605.9379 | 1066.944 OxTG [M+NH4]+ Yes OxTG(16:0_16:0_18:1(OOO)) 898.7767587 17.3184689 1_OxTG(16:0_16:0_18:1(OOO))+NH4 | 1_OxTG(14:0_18:0_18:1(OOO))+NH4 1743.04023 | 1526.97403 OxTG [M+NH4]+ Yes OxTG(16:0_18:1_20:1(OOO)) 952.8215491 17.59291147 1_OxTG(16:0_18:1_20:1(OOO))+NH4 | 1_OxTG(16:1_18:0_20:1(OOO))+NH4 | 1_OxTG(18:0_18:1_18:1(OOO))+NH4 | 1_OxTG(14:0_18:1_22:1(OOO))+NH4 | 1_OxTG(16:0_18:0_20:2(OOO))+NH4 | 1_OxTG(16:0_16:1_22:1(OOO))+NH4 | 1_OxTG(16:0_16:0_22:2(OOO))+NH4 | 1_OxTG(14:0_18:0_22:2(OOO))+NH4 | 1_OxTG(14:1_18:0_22:1(OOO))+NH4 10034.619 | 7146.7951 | 6886.746 | 4744.8706 | 4176.94322 | 3437.9914 | 2989.9915 | 2889.9858 | 2873.99932 OxTG [M+NH4]+ Yes OxTG(16:1_18:0_17:2(OH)) 876.7712147 17.68559093 1_OxTG(16:1_18:0_17:2(OH))+NH4 | 1_OxTG(16:1_18:0_17:1(Ke))+NH4 | 1_OxTG(16:0_18:1_17:2(OH))+NH4 | 1_OxTG(16:0_18:1_17:1(Ke))+NH4 | 1_OxTG(18:0_18:2_15:0(CHO))+NH4 | 1_OxTG(18:0_18:2_15:1(OH))+NH4 | 1_OxTG(18:1_18:1_15:0(CHO))+NH4 | 1_OxTG(18:1_18:1_15:1(OH))+NH4 | 1_OxTG(16:0_18:2_17:1(OH))+NH4 | 1_OxTG(16:1_18:1_17:1(OH))+NH4 | 1_OxTG(18:0_18:1_15:1(CHO))+NH4 | 1_OxTG(18:0_18:1_15:1(Ke))+NH4 | 1_OxTG(16:0_18:0_17:2(Ke))+NH4 | 1_OxTG(18:0_18:0_15:2(CHO))+NH4 24791.3399 | 24791.3399 | 24522.2511 | 24522.2511 | 16711.5676 | 16711.5676 | 15413.5178 | 15413.5178 | 12690.5907 | 11920.6167 | 8779.911 | 8779.911 | 8657.3953 | 1091.04217 OxTG [M+NH4]+ Yes OxTG(16:0_18:0_18:1(OOO)) 926.80217 17.54407561 1_OxTG(16:0_18:0_18:1(OOO))+NH4 | 1_OxTG(14:0_16:0_22:1(OOO))+NH4 | 1_OxTG(16:0_16:0_20:1(OOO))+NH4 | 1_OxTG(14:0_18:0_20:1(OOO))+NH4 5900.7924 | 5445.7827 | 5084.7603 | 2999.9575 OxTG [M+NH4]+ Yes PC(13:0_16:1) 690.5094832 10.55500041 1_PC(13:0_16:1)+H | 1_PE(16:0_16:1)+H | 1_PE(14:0_18:1)+H | 3_PE(32:1)+H 20945.168068 | 12231.483414 | 10166.411904 | 9756.419914 PC [M+H]+ No PC(14:0_16:1) 704.5208495 7.673951829 1_PC(14:0_16:1)+H | 1_PC(14:1_16:0)+H 101807.1135 | 101132.115072 PC [M+H]+ Yes PC(14:0_14:1) 676.4892702 6.008085391 1_PC(14:0_14:1)+H 12593.71731 PC [M+H]+ Yes PC(14:0_17:1) 718.5367339 8.865461585 1_PC(14:0_17:1)+H | 1_PC(15:0_16:1)+H 63291.40316 | 63281.401148 PC [M+H]+ Yes PC(14:0_26:0) 846.6926485 15.84422244 1_PC(14:0_26:0)+H 18995.32183 PC [M+H]+ Yes PC(14:0_20:4) 754.535457 7.663960366 1_PC(14:0_20:4)+H 35615.67753 PC [M+H]+ Yes PC(14:1_16:1) 702.5086738 6.214919547 1_PC(14:1_16:1)+H 15000.00883 PC [M+H]+ Yes PC(15:0_18:2) 744.5518728 9.12034187 1_PC(15:0_18:2)+H | 1_PC(16:1_17:1)+H 87777.167677 | 87746.159007 PC [M+H]+ Yes PC(15:0_22:4) 796.5848262 13.94551565 1_PC(15:0_22:4)+H | 1_PE(18:0_22:4)+H | 1_PE(20:1_20:3)+H | 1_PE(20:0_20:4)+H | 1_PE(18:1_22:3)+H | 3_PE(40:4)+H | 1_PE(18:1_20:0)+Na | 1_PC(17:0_18:1)+Na | 1_PEtOH(18:0_22:5)+NH4 | 1_PEtOH(16:1_24:4)+NH4 | 1_PEtOH(18:1_22:4)+NH4 | 3_PEtOH(40:5)+NH4 32245.986669 | 4643.944079 | 4592.946069 | 4577.947179 | 4561.949469 | 4546.949309 | 4370.143259 | 3194.04716 | 1588.934379 | 1522.93738 | 1506.939769 | 1486.9393 PC [M+H]+ No PC(15:0_16:0) 720.5523864 10.29066402 1_PC(15:0_16:0)+H | 1_PC(14:0_17:0)+H 90655.036102 | 90560.038262 PC [M+H]+ Yes PC(15:0_16:1) 718.5393721 8.551664228 1_PC(15:0_16:1)+H | 1_PC(14:0_17:1)+H | 1_PC(15:1_16:0)+H 83927.811911 | 83799.82415 | 83554.820541 PC [M+H]+ Yes PC(15:0_22:5) 794.5689988 13.92839085 1_PC(15:0_22:5)+H | 1_PC(17:1_20:4)+H | 1_PE(20:1_20:4)+H | 1_PE(18:0_22:5)+H | 1_PE(18:1_22:4)+H | 1_PE(20:2_20:3)+H | 1_PE(18:2_22:3)+H | 3_PE(40:5)+H | 1_PEtOH(20:1_20:5)+NH4 | 1_PEtOH(18:0_22:6)+NH4 | 1_PEtOH(18:1_22:5)+NH4 | 3_PEtOH(40:6)+NH4 8659.21441 | 8586.211369 | 6434.01302 | 6226.99485 | 5888.986689 | 5843.981849 | 5827.983779 | 5807.9829 | 951.028349 | 611.009379 | 503.001789 | 334.99919 PC [M+H]+ No PC(15:0_20:3) 770.5698804 13.99687181 1_PC(15:0_20:3)+H | 1_PE(18:0_20:3)+H | 1_PE(18:1_20:2)+H | 3_PE(38:3)+H | 1_PEtOH(18:0_20:4)+NH4 | 1_PEtOH(14:0_24:4)+NH4 | 1_PEtOH(18:1_20:3)+NH4 | 3_PEtOH(38:4)+NH4 21280.993671 | 3168.069171 | 2706.054749 | 2691.054299 | 1057.015929 | 822.0056 | 595.001391 | 565.0016 PC [M+H]+ No PC(15:1_22:5) 792.5496092 12.32650464 1_PC(15:1_22:5)+H | 1_PE(18:1_22:5)+H | 3_PE(40:6)+H | 1_PEtOH(18:1_22:6)+NH4 | 1_PEtOH(18:2_22:5)+NH4 | 3_PEtOH(40:7)+NH4 6624.761969 | 6062.8134 | 5472.79863 | 846.01921 | 509.007769 | 359.00721 PC [M+H]+ No PC(15:1_16:1) 716.5219477 10.9089374 1_PC(15:1_16:1)+H | 1_PE(16:1_18:1)+H | 1_PE(16:0_18:2)+H | 3_PE(34:2)+H 20719.2548 | 14825.62602 | 11824.515924 | 11793.51812 PC [M+H]+ No PC(15:1_18:2) 742.5375891 11.53158496 1_PC(15:1_18:2)+H | 1_PE(18:1_18:2)+H | 1_PE(16:0_18:0)+Na | 3_PE(36:3)+H 29440.508842 | 14449.555799 | 12004.538062 | 11968.537799 PC [M+H]+ No PC(15:1_22:6) 790.5390041 10.34122215 1_PC(15:1_22:6)+H | 1_PE(18:1_22:6)+H | 1_PE(20:3_20:4)+H | 1_PE(16:0_22:4)+Na | 3_PE(40:7)+H | 1_PEtOH(18:2_22:6)+NH4 | 3_PEtOH(40:8)+NH4 29477.03918 | 4499.94194 | 4121.96806 | 4055.96246 | 4024.9641 | 429.988992 | 343.99181 PC [M+H]+ No PC(15:1_20:1) 772.5858182 14.59967398 1_PC(15:1_20:1)+H | 1_PC(17:1_18:1)+H | 1_PC(15:0_20:2)+H | 1_PE(18:1_20:1)+H | 1_PE(18:0_20:2)+H | 1_PE(16:0_22:2)+H | 1_PE(16:1_22:1)+H | 3_PE(38:2)+H | 1_PEtOH(18:1_20:2)+NH4 | 1_PEtOH(20:1_18:2)+NH4 | 1_PEtOH(18:0_20:3)+NH4 | 1_PEtOH(16:1_22:2)+NH4 | 1_PEtOH(16:0_22:3)+NH4 | 1_PEtOH(22:1_16:2)+NH4 | 3_PEtOH(38:3)+NH4 77893.66976 | 77684.66632 | 77427.65919 | 9710.55482 | 9355.55795 | 9100.55897 | 9069.55768 | 8967.5574 | 1065.05126 | 966.02881 | 675.04601 | 624.04563 | 624.04465 | 613.0439 | 542.04411 PC [M+H]+ No PC(15:1_16:0) 718.5379802 13.71526362 1_PC(15:1_16:0)+H | 1_PC(13:0_18:1)+H | 1_PC(15:0_16:1)+H | 1_PE(16:0_18:1)+H | 1_PE(16:1_18:0)+H | 3_PE(34:1)+H 72343.83211 | 71690.77 | 70524.87544 | 35552.78276 | 28739.89276 | 24665.00776 PC [M+H]+ No PC(15:1_20:3) 768.5529533 12.40303807 1_PC(15:1_20:3)+H | 1_PE(18:1_20:3)+H | 1_PE(16:0_20:1)+Na | 3_PE(38:4)+H 26104.180683 | 3311.17867 | 3097.18443 | 3071.1824 PC [M+H]+ No PC(15:1_18:1) 744.5557619 13.91766992 1_PC(15:1_18:1)+H | 1_PC(16:0_17:2)+H | 1_PC(13:0_20:2)+H | 1_PE(18:1_18:1)+H | 1_PE(16:0_20:2)+H | 1_PE(18:0_18:2)+H | 1_PE(16:1_20:1)+H | 3_PE(36:2)+H 113655.541033 | 107736.324573 | 107624.329013 | 28007.18274 | 19791.37322 | 19688.370483 | 19678.367753 | 19617.36874 PC [M+H]+ No PC(15:1_22:4) 794.5759999 13.45885325 1_PC(15:1_22:4)+H | 1_PE(18:1_22:4)+H | 3_PE(40:5)+H 44305.6929 | 4859.89833 | 4453.919 PC [M+H]+ No PC(16:0_16:1) 732.5530135 10.19386565 1_PC(16:0_16:1)+H 141702.2446 PC [M+H]+ Yes PC(16:0_20:5) 780.552785 8.321182724 1_PC(16:0_20:5)+H 74174.41381 PC [M+H]+ Yes PC(16:0_22:6) 806.5675607 9.335814837 1_PC(16:0_22:6)+H 91841.74255 PC [M+H]+ Yes PC(16:0_18:1) 760.5865211 12.72163415 1_PC(16:0_18:1)+H 160198.8348 PC [M+H]+ Yes PC(16:0_18:0) 762.602069 12.74003963 1_PC(16:0_18:0)+H 116981.0015 PC [M+H]+ Yes PC(16:0_24:1) 844.6769848 15.38618293 1_PC(16:0_24:1)+H | 1_PC(18:0_22:1)+H | 1_PC(18:1_22:0)+H 78007.4614 | 77986.4636 | 77966.46404 PC [M+H]+ Yes PC(16:0_26:0) 874.7243293 16.21842764 1_PC(16:0_26:0)+H 69562.04974 PC [M+H]+ Yes PC(16:0_20:3) 784.5839674 11.05769756 1_PC(16:0_20:3)+H | 1_PC(18:1_18:2)+H | 1_PC(16:1_20:2)+H 122396.172325 | 121883.123959 | 121299.127943 PC [M+H]+ Yes PC(16:0_20:1) 788.6153051 14.37387439 1_PC(16:0_20:1)+H | 1_PC(18:0_18:1)+H 142440.52927 | 142402.48288 PC [M+H]+ Yes PC(16:0_18:2) 758.5681204 10.31965366 1_PC(16:0_18:2)+H | 1_PC(16:1_18:1)+H | 1_PC(14:0_20:2)+H 138903.36273 | 137045.28393 | 135967.2812 PC [M+H]+ Yes PC(16:0_17:0) 748.5836528 13.88246584 1_PC(16:0_17:0)+H | 1_PC(15:0_18:0)+H | 1_PE(18:0_18:0)+H | 3_PE(36:0)+H | 1_PEtOH(18:0_18:1)+NH4 | 3_PEtOH(36:1)+NH4 67183.366989 | 67070.374279 | 2587.09073 | 2552.0916 | 2422.072169 | 2382.0733 PC [M+H]+ No PC(16:0_16:0) 734.5619451 9.776113821 1_PC(16:0_16:0)+H 104443.9078 PC [M+H]+ Yes PC(16:0_20:0) 790.6255936 14.37522134 1_PC(16:0_20:0)+H | 1_PC(18:0_18:0)+H 102581.771035 | 102560.77897 PC [M+H]+ Yes PC(16:0_17:1) 746.571052 13.96815467 1_PC(16:0_17:1)+H | 1_PE(18:0_18:1)+H | 3_PE(36:1)+H | 1_PEtOH(18:0_18:2)+NH4 | 1_PEtOH(18:1_18:1)+NH4 | 1_PEtOH(15:1_21:1)+NH4 | 3_PEtOH(36:2)+NH4 84875.530703 | 4743.09961 | 4505.1055 | 1195.00352 | 1072.002898 | 998.009875 | 955.0062 PC [M+H]+ No PC(16:1_17:0) 746.5669373 10.69806972 1_PC(16:1_17:0)+H | 1_PC(15:0_18:1)+H 59312.903898 | 59178.903509 PC [M+H]+ Yes PC(16:1_18:0) 760.5832103 13.3697628 1_PC(16:1_18:0)+H | 1_PC(16:0_18:1)+H 110978.525873 | 110892.527923 PC [M+H]+ Yes PC(16:1_18:2) 756.5569845 8.515211179 1_PC(16:1_18:2)+H | 1_PC(14:0_20:3)+H 92498.559288 | 92294.580188 PC [M+H]+ Yes PC(16:1_16:1) 730.5373215 8.009781707 1_PC(16:1_16:1)+H | 1_PC(14:0_18:2)+H 107336.59493 | 106479.560762 PC [M+H]+ Yes PC(16:1_18:3) 754.5312203 7.186311688 1_PC(16:1_18:3)+H 18509.28149 PC [M+H]+ Yes PC(16:1_22:5) 806.5674515 8.082305625 1_PC(16:1_22:5)+H 27275.13449 PC [M+H]+ Yes PC(16:1_22:4) 808.5829027 9.628869547 1_PC(16:1_22:4)+H | 1_PC(18:2_20:3)+H 39049.008546 | 38971.009356 PC [M+H]+ Yes PC(16:1_20:3) 782.5681245 9.131418902 1_PC(16:1_20:3)+H | 1_PC(18:1_18:3)+H 58708.757611 | 58667.757457 PC [M+H]+ Yes PC(17:0_18:0) 776.6110428 13.81661125 1_PC(17:0_18:0)+H 26195.92384 PC [M+H]+ Yes PC(17:0_18:2) 772.5837875 11.81848171 1_PC(17:0_18:2)+H | 1_PC(17:1_18:1)+H 92598.264588 | 92553.254728 PC [M+H]+ Yes PC(17:0_18:1) 774.5983429 14.01165183 1_PC(17:0_18:1)+H | 1_PC(17:1_18:0)+H | 3_PE(38:1)+H 89954.988714 | 89717.96865 | 3718.287314 PC [M+H]+ No PC(17:0_20:4) 796.5808236 11.45880955 1_PC(17:0_20:4)+H | 1_PC(17:0_18:1)+Na | 3_PE(40:4)+H 53482.06735 | 3197.16585 | 2622.16859 PC [M+H]+ No PC(17:1_18:2) 770.5677032 9.430513008 1_PC(17:1_18:2)+H 23694.88067 PC [M+H]+ Yes PC(17:1_18:1) 772.5798997 14.18992215 1_PC(17:1_18:1)+H | 1_PC(17:0_18:2)+H | 1_PE(18:1_20:1)+H | 3_PE(38:2)+H | 1_PEtOH(18:1_20:2)+NH4 | 1_PEtOH(21:1_17:2)+NH4 | 3_PEtOH(38:3)+NH4 88362.030005 | 88206.041225 | 1087.03429 | 1067.0356 | 577.992275 | 567.99243 | 547.99374 PC [M+H]+ No PC(17:1_20:1) 800.615451 14.06447012 1_PC(17:1_20:1)+H 79075.64193 PC [M+H]+ Yes PC(17:2_20:4) 792.5596399 11.28594146 1_PC(17:2_20:4)+H | 1_PE(18:1_22:5)+H | 1_PE(20:2_20:4)+H | 1_PE(18:2_22:4)+H | 3_PE(40:6)+H 66454.437644 | 2525.898138 | 2422.898828 | 2412.898088 | 2356.900178 PC [M+H]+ No PC(18:0_18:1) 788.6166447 13.06041504 1_PC(18:0_18:1)+H 89449.85847 PC [M+H]+ Yes PC(18:0_18:2) 786.5993358 13.58772215 1_PC(18:0_18:2)+H | 1_PC(18:1_18:1)+H | 1_PC(17:2_19:0)+H | 1_PC(16:0_20:2)+H 135781.75007 | 131285.85788 | 131170.844307 | 131142.846857 PC [M+H]+ Yes PC(18:0_20:4) 810.5990262 13.09407337 1_PC(18:0_20:4)+H 135465.4571 PC [M+H]+ Yes PC(18:0_20:2) 814.6307511 14.40623557 1_PC(18:0_20:2)+H | 1_PC(18:1_20:1)+H | 1_PC(16:0_22:2)+H | 1_PC(16:1_22:1)+H | 1_PC(17:2_21:0)+H 100096.2925 | 99797.2613 | 99323.275171 | 99278.279981 | 99232.27737 PC [M+H]+ Yes PC(18:0_22:5) 836.6147748 13.2577128 1_PC(18:0_22:5)+H | 1_PC(20:1_20:4)+H 106908.722674 | 106232.66965 PC [M+H]+ Yes PC(18:0_22:2) 842.6611622 14.95864 1_PC(18:0_22:2)+H | 1_PC(16:1_24:1)+H | 1_PC(18:1_22:1)+H 76224.557173 | 76158.555229 | 76117.560853 PC [M+H]+ Yes PC(18:1_19:0) 802.6318162 14.64819578 1_PC(18:1_19:0)+H | 1_PE(18:0_22:1)+H | 3_PE(40:1)+H 79145.33169 | 3285.742245 | 3282.74242 PC [M+H]+ No PC(18:1_18:2) 784.583898 10.74631402 1_PC(18:1_18:2)+H | 1_PC(16:1_20:2)+H 139089.98184 | 135658.941405 PC [M+H]+ Yes PC(18:1_20:4) 808.5839661 10.27304512 1_PC(18:1_20:4)+H | 1_PC(16:0_22:5)+H 120204.309791 | 118595.243561 PC [M+H]+ Yes PC(18:1_18:1) 786.5992201 13.07988028 1_PC(18:1_18:1)+H | 1_PC(16:0_20:2)+H | 1_PC(16:1_20:1)+H 135947.4924 | 130652.589452 | 130549.590312 PC [M+H]+ Yes PC(18:1_20:0) 816.6461411 14.93812896 1_PC(18:1_20:0)+H | 1_PC(16:0_22:1)+H | 1_PC(18:0_20:1)+H 106468.81959 | 106242.82778 | 106232.81151 PC [M+H]+ Yes PC(18:1_24:1) 870.6922638 15.42948621 1_PC(18:1_24:1)+H 104446.2294 PC [M+H]+ Yes PC(18:1_22:6) 832.5830182 9.56027561 1_PC(18:1_22:6)+H 67870.24511 PC [M+H]+ Yes PC(18:1_22:5) 834.5989559 10.39814533 1_PC(18:1_22:5)+H 72819.04655 PC [M+H]+ Yes PC(18:1_22:2) 840.6464271 14.59574654 1_PC(18:1_22:2)+H | 1_PC(18:2_22:1)+H 89582.907255 | 89566.903875 PC [M+H]+ Yes PC(18:1_20:3) 810.5935728 11.31826037 1_PC(18:1_20:3)+H | 1_PC(18:2_20:2)+H 107528.685485 | 107086.698824 PC [M+H]+ Yes PC(18:1_26:0) 900.7398693 16.24340894 1_PC(18:1_26:0)+H 94785.84948 PC [M+H]+ Yes PC(18:1_22:3) 838.6307872 14.22768577 1_PC(18:1_22:3)+H | 1_PC(20:1_20:3)+H | 1_PC(18:0_22:4)+H | 1_PC(18:2_22:2)+H 62534.42434 | 62462.424273 | 62441.429173 | 62431.42926 PC [M+H]+ Yes PC(18:1_20:5) 806.5676307 8.684080488 1_PC(18:1_20:5)+H | 1_PC(18:2_20:4)+H 36130.438858 | 36114.436628 PC [M+H]+ Yes PC(18:1_20:2) 812.6149835 13.73605285 1_PC(18:1_20:2)+H | 1_PC(18:2_20:1)+H 101656.024844 | 101650.07549 PC [M+H]+ Yes PC(18:2_24:1) 868.6763051 15.02578526 1_PC(18:2_24:1)+H 64502.7895 PC [M+H]+ Yes PC(18:2_20:2) 810.595402 11.06007358 1_PC(18:2_20:2)+H 65888.67045 PC [M+H]+ Yes PC(18:2_18:2) 782.5751083 8.806704938 1_PC(18:2_18:2)+H | 1_PC(16:1_20:3)+H 90732.02385 | 90622.041977 PC [M+H]+ Yes PC(20:1_22:5) 862.6242508 13.42762398 1_PC(20:1_22:5)+H 34725.6032 PC [M+H]+ Yes PC(20:2_20:3) 836.6152321 12.0209981 1_PC(20:2_20:3)+H 17910.09666 PC [M+H]+ Yes PC(20:3_22:1) 866.6605938 14.65097271 1_PC(20:3_22:1)+H 53625.95145 PC [M+H]+ Yes PC(20:3_20:4) 832.5839427 9.037702033 1_PC(20:3_20:4)+H 21978.60753 PC [M+H]+ Yes PE(16:0_20:4) 740.5203705 10.75820589 1_PE(16:0_20:4)+H | 1_PE(16:1_20:3)+H | 1_PE(18:1_18:3)+H | 3_PE(36:4)+H | 1_PC(13:0_20:4)+H 28444.70188 | 11225.622366 | 10903.610596 | 10862.61148 | 1282.044045 PE [M+H]+ No PE(16:0_16:1) 690.5037555 10.97832541 1_PE(16:0_16:1)+H | 1_PE(14:1_18:0)+H | 3_PE(32:1)+H | 1_PC(13:0_16:1)+H 6918.305065 | 4747.245625 | 4706.245965 | 1871.97346 PE [M+H]+ No PE(16:0_22:4) 768.5594567 13.0178403 1_PE(16:0_22:4)+H | 1_PE(18:1_20:3)+H | 3_PE(38:4)+H | 1_PC(13:0_22:4)+H | 1_PEtOH(16:0_22:5)+NH4 | 1_PEtOH(16:1_22:4)+NH4 | 3_PEtOH(38:5)+NH4 9968.355654 | 8804.354338 | 8730.357834 | 1618.005134 | 1349.97903 | 585.003948 | 290.99363 PE [M+H]+ No PE(16:0_22:6) 764.523465 10.03360604 1_PE(16:0_22:6)+H | 1_PE(16:1_22:5)+H | 1_PE(18:2_20:4)+H | 3_PE(38:6)+H | 1_PC(13:0_22:6)+H 6205.148121 | 5551.136651 | 5522.134298 | 5479.134741 | 448.009119 PE [M+H]+ No PE(16:1_24:0) 802.6316564 15.61261754 1_PE(16:1_24:0)+H | 1_PE(16:0_24:1)+H | 3_PE(40:1)+H 2326.04905 | 2034.05853 | 2014.05747 PE [M+H]+ Yes PE(16:1_20:4) 738.5053178 8.493639451 1_PE(16:1_20:4)+H | 3_PE(36:5)+H 4303.8993 | 2679.8477 PE [M+H]+ Yes PE(17:1_18:1) 730.536866 12.40214033 1_PE(17:1_18:1)+H | 3_PE(35:2)+H 3314.92236 | 2987.9264 PE [M+H]+ Yes PE(18:0_22:5) 794.5691279 14.22324805 1_PE(18:0_22:5)+H | 3_PE(40:5)+H 2609.043125 | 2374.041 PE [M+H]+ Yes PE(18:0_18:1) 746.5688856 14.56145793 1_PE(18:0_18:1)+H | 1_PE(14:0_22:1)+H | 1_PE(16:0_20:1)+H | 3_PE(36:1)+H | 1_PMeOH(18:1_19:1)+NH4 | 1_PEtOH(18:1_18:1)+NH4 | 1_PEtOH(18:0_18:2)+NH4 | 1_PMeOH(18:0_19:2)+NH4 | 1_PC(15:0_18:1)+H | 1_PC(15:1_18:0)+H | 1_PMeOH(13:1_24:1)+NH4 | 1_PMeOH(15:1_22:1)+NH4 | 1_PEtOH(15:1_21:1)+NH4 | 1_PEtOH(14:1_22:1)+NH4 | 1_PMeOH(17:1_20:1)+NH4 | 1_PEtOH(12:0_24:2)+NH4 | 1_PMeOH(19:0_18:2)+NH4 | 1_PMeOH(16:1_21:1)+NH4 | 1_PEtOH(16:1_20:1)+NH4 | 1_PEtOH(14:0_22:2)+NH4 | 1_PMeOH(13:0_24:2)+NH4 | 3_PMeOH(37:2)+NH4 | 3_PEtOH(36:2)+NH4 75199.9931 | 38892.29378 | 38891.300809 | 38815.2971 | 21954.240415 | 21933.239345 | 17030.32745 | 16974.330415 | 10929.791 | 10860.999885 | 1378.939115 | 1359.93981 | 1342.93877 | 1338.93874 | 1337.941305 | 1337.929745 | 1317.933875 | 1306.937665 | 1301.939775 | 1291.93292 | 1271.937415 | 1266.93753 | 1245.93646 PE [M+H]+ No PE(18:0_20:4) 768.5521683 13.88381972 1_PE(18:0_20:4)+H | 1_PEtOH(18:0_20:5)+NH4 | 1_PE(18:1_20:3)+H | 1_PE(18:0_18:1)+Na | 3_PE(38:4)+H | 1_PEtOH(18:1_20:4)+NH4 | 1_PC(15:0_20:4)+H | 1_PEtOH(22:1_16:4)+NH4 | 1_PEtOH(20:1_18:4)+NH4 | 1_PEtOH(22:2_16:3)+NH4 | 1_PEtOH(14:1_24:4)+NH4 | 3_PEtOH(38:5)+NH4 65982.78554 | 46741.8122 | 19906.944916 | 19131.96312 | 18736.95524 | 4950.104176 | 4201.141256 | 1783.044736 | 1737.043096 | 1641.043805 | 1589.04552 | 1574.0452 PE [M+H]+ No PE(18:0_20:3) 770.5718456 14.2253725 1_PE(18:0_20:3)+H | 1_PE(16:0_22:3)+H | 1_PE(18:1_20:2)+H | 1_PE(18:2_20:1)+H | 3_PE(38:3)+H | 1_PC(15:0_20:3)+H | 1_PEtOH(18:0_20:4)+NH4 | 1_PEtOH(18:1_20:3)+NH4 | 1_PEtOH(16:0_22:4)+NH4 | 1_PEtOH(16:1_22:3)+NH4 | 3_PEtOH(38:4)+NH4 13505.460729 | 12361.486949 | 12079.490118 | 12049.490378 | 12008.492129 | 4077.868648 | 1482.96826 | 1005.013329 | 702.998678 | 575.008589 | 437.00687 PE [M+H]+ No PE(18:1_18:2) 742.5358332 11.87851728 1_PE(18:1_18:2)+H | 1_PE(16:0_20:3)+H | 1_PE(16:1_20:2)+H | 3_PE(36:3)+H | 1_PC(13:0_20:3)+H | 1_PC(15:1_18:2)+H 7265.850337 | 6939.870167 | 6524.874207 | 6499.873177 | 3255.120147 | 3255.120147 PE [M+H]+ No PE(18:1_20:5) 764.5205341 9.190744937 1_PE(18:1_20:5)+H | 1_PE(18:2_20:4)+H | 3_PE(38:6)+H 3219.04004 | 2494.05687 | 2258.0594 PE [M+H]+ Yes PE(18:1_22:1) 800.6156271 15.13409632 1_PE(18:1_22:1)+H | 1_PE(18:0_22:2)+H | 1_PE(16:1_24:1)+H | 3_PE(40:2)+H | 1_PEtOH(18:1_22:2)+NH4 | 1_PEtOH(22:1_18:2)+NH4 | 1_PEtOH(24:1_16:2)+NH4 | 1_PEtOH(18:0_22:3)+NH4 | 1_PEtOH(16:1_24:2)+NH4 | 3_PEtOH(40:3)+NH4 6487.02208 | 6108.03113 | 6082.03156 | 5985.0345 | 774.97971 | 682.961749 | 513.97456 | 477.976049 | 462.977999 | 431.97762 PE [M+H]+ No PE(18:1_24:1) 828.6455474 15.57181082 1_PE(18:1_24:1)+H | 3_PE(42:2)+H 4495.98053 | 4199.9935 PE [M+H]+ Yes PE(18:1_22:5) 792.5603506 13.5590179 1_PE(18:1_22:5)+H | 1_PE(18:0_22:6)+H | 3_PE(40:6)+H 255.00582 | 163.00542 | 65.99996 PE [M+H]+ Yes PE(18:1_20:3) 768.5506413 13.34285793 1_PE(18:1_20:3)+H | 1_PE(16:0_22:4)+H | 1_PE(18:0_20:4)+H | 1_PE(18:2_20:2)+H | 3_PE(38:4)+H 4711.04335 | 3280.048531 | 3198.043731 | 3198.043731 | 3162.0425 PE [M+H]+ Yes PE(18:2_22:6) 788.529308 11.02617846 1_PE(18:2_22:6)+H | 3_PE(40:8)+H 3449.162639 | 3247.156 PE [M+H]+ Yes PG(18:1_18:1) 792.5725273 11.35704024 1_PG(18:1_18:1)+NH4 | 1_BMP(18:1_18:1)+NH4 | 1_PG(16:0_20:2)+NH4 | 1_PG(18:0_18:2)+NH4 | 3_PG(36:2)+NH4 2726.00534 | 2655.00741 | 2649.007178 | 2598.009388 | 2578.00845 PG [M+NH4]+ No Plasmanyl-PC(O-16:0/17:0) 734.6028102 14.2409173 1_Plasmanyl-PC(O-16:0/17:0)+H | 1_Plasmanyl-PC(O-18:0/15:0)+H | 3_Plasmanyl-PE(36:0)+H 31783.04559 | 31757.048029 | 1584.011909 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-16:0/22:6) 792.5885963 10.89058272 1_Plasmanyl-PC(O-16:0/22:6)+H | 1_Plasmenyl-PC(P-16:0/22:5)+H 40149.63612 | 40102.639975 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-16:0/16:1) 718.5750811 11.4792313 1_Plasmanyl-PC(O-16:0/16:1)+H | 3_Plasmanyl-PE(35:1)+H 91627.18519 | 3221.11289 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-22:1/18:2) 826.6674944 14.90640823 1_Plasmanyl-PC(O-22:1/18:2)+H | 1_Plasmenyl-PC(P-22:0/18:2)+H 24509.64704 | 24509.64704 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-16:0/18:2) 744.5882472 12.12436931 1_Plasmanyl-PC(O-16:0/18:2)+H | 1_Plasmanyl-PC(O-18:1/16:1)+H | 1_Plasmenyl-PC(P-18:0/16:1)+H | 3_Plasmanyl-PE(37:2)+H 111754.6806 | 111342.66732 | 111337.6677 | 4530.65599 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-24:1/18:1) 856.7141343 15.70951435 1_Plasmanyl-PC(O-24:1/18:1)+H | 1_Plasmenyl-PC(P-24:0/18:1)+H 19644.439231 | 19644.439231 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-16:1/26:0) 858.7286964 16.07873074 1_Plasmanyl-PC(O-16:1/26:0)+H 25603.79808 Plasmanyl-PC [M+H]+ Yes Plasmanyl-PC(O-18:1/22:5) 820.6199754 13.98423841 1_Plasmanyl-PC(O-18:1/22:5)+H | 1_Plasmenyl-PC(P-18:1/22:4)+H 3515.972581 | 3500.972051 Plasmanyl-PC [M+H]+ No Plasmanyl-LPC(O-16:1) 480.3437703 2.343489474 1_Plasmanyl-LPC(O-16:1)+H 547.9919 ether-LPC [M+H]+ Yes Plasmanyl-LPC(O-16:0) 482.3577765 2.437141983 1_Plasmanyl-LPC(O-16:0)+H 639.9996 ether-LPC [M+H]+ Yes Plasmanyl-PC(O-16:0/20:4) 768.5893238 11.69492114 1_Plasmanyl-PC(O-16:0/20:4)+H 116384.7765 Plasmanyl-PC [M+H]+ Yes Plasmanyl-PC(O-16:0/22:3) 798.6345836 14.50685976 1_Plasmanyl-PC(O-16:0/22:3)+H | 1_Plasmanyl-PC(O-18:0/20:3)+H | 1_Plasmenyl-PC(P-18:1/20:1)+H 44037.643167 | 44026.6405 | 43985.636457 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-22:0/20:4) 852.6817163 15.31124262 1_Plasmanyl-PC(O-22:0/20:4)+H 20961.12142 Plasmanyl-PC [M+H]+ Yes Plasmanyl-PC(O-18:0/22:4) 824.6551915 14.62359852 1_Plasmanyl-PC(O-18:0/22:4)+H 13941.13296 Plasmanyl-PC [M+H]+ Yes Plasmanyl-PC(O-22:1/20:3) 852.6799027 14.96449351 1_Plasmanyl-PC(O-22:1/20:3)+H | 1_Plasmenyl-PC(P-22:0/20:3)+H 13301.084933 | 13301.084933 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-16:0/16:0) 720.5878259 13.98686728 1_Plasmanyl-PC(O-16:0/16:0)+H | 1_Plasmanyl-PC(O-18:0/14:0)+H | 1_Plasmanyl-PE(O-16:0/19:0)+H | 3_Plasmanyl-PE(35:0)+H 101387.17172 | 100376.19036 | 5467.28393 | 5447.28255 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-16:0/20:2) 772.6134843 14.6565187 1_Plasmanyl-PC(O-16:0/20:2)+H | 1_Plasmanyl-PC(O-18:0/18:2)+H 80272.52681 | 79940.52427 Plasmanyl-PC [M+H]+ Yes Plasmanyl-PC(O-18:0/20:2) 800.6526889 14.76584239 1_Plasmanyl-PC(O-18:0/20:2)+H | 1_Plasmanyl-PC(O-16:0/22:2)+H | 1_Plasmanyl-PC(O-20:1/18:1)+H | 1_Plasmanyl-PC(O-22:1/16:1)+H | 1_Plasmenyl-PC(P-20:0/18:1)+H | 1_Plasmenyl-PC(P-22:0/16:1)+H 76236.632454 | 76215.62229 | 76164.627565 | 76164.627565 | 76164.627565 | 76164.627565 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-22:0/16:0) 804.6797373 15.69934852 1_Plasmanyl-PC(O-22:0/16:0)+H 19261.35584 Plasmanyl-PC [M+H]+ Yes Plasmanyl-PC(O-18:0/18:1) 774.6364419 14.74758089 1_Plasmanyl-PC(O-18:0/18:1)+H | 1_Plasmanyl-PC(O-16:0/20:1)+H | 1_Plasmenyl-PC(P-20:0/16:0)+H | 1_Plasmanyl-PC(O-20:1/16:0)+H | 1_Plasmanyl-PC(O-16:1/20:0)+H | 1_Plasmanyl-PC(O-18:1/18:0)+H | 1_Plasmenyl-PC(P-18:0/18:0)+H 111505.271 | 111312.24128 | 111110.25531 | 111105.254985 | 111100.255835 | 111090.253155 | 111090.253155 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-18:1/22:4) 822.6333576 13.98446034 1_Plasmanyl-PC(O-18:1/22:4)+H | 1_Plasmenyl-PC(P-18:0/22:4)+H 18183.453009 | 18183.453009 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-18:0/20:4) 796.6194919 14.16406545 1_Plasmanyl-PC(O-18:0/20:4)+H | 1_Plasmenyl-PC(P-16:0/22:3)+H | 1_Plasmenyl-PC(P-18:1/20:2)+H | 1_Plasmanyl-PC(O-16:0/22:4)+H | 1_Plasmanyl-PC(O-18:1/20:3)+H 80638.187261 | 80593.187931 | 80527.187531 | 80495.185571 | 80486.186551 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-16:0/22:4) 796.6189084 13.91807317 1_Plasmanyl-PC(O-16:0/22:4)+H | 1_Plasmanyl-PC(O-18:1/20:3)+H | 1_Plasmenyl-PC(P-18:0/20:3)+H 32290.100529 | 32244.103769 | 32244.103769 Plasmanyl-PC [M+H]+ No Plasmanyl-PC(O-16:0/20:3) 770.6026168 13.07613008 1_Plasmanyl-PC(O-16:0/20:3)+H 46277.54095 Plasmanyl-PC [M+H]+ Yes Plasmanyl-PC(O-20:0/16:0) 776.6496779 15.23443586 1_Plasmanyl-PC(O-20:0/16:0)+H | 1_Plasmanyl-PC(O-16:0/20:0)+H | 1_Plasmanyl-PC(O-18:0/18:0)+H 59854.353529 | 59798.348019 | 59782.347955 Plasmanyl-PC [M+H]+ Yes Plasmenyl-PE(P-18:1/22:5) 776.5514431 13.76462294 1_Plasmenyl-PE(P-18:1/22:5)+H | 3_PS(35:1)+H 2070.135788 | 75.00285 ether-PE [M+H]+ No Plasmenyl-PE(P-16:0/22:2) 756.5858011 14.91829852 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-20:1/18:1)+H | 1_Plasmenyl-PE(P-16:1/22:1)+H | 3_Plasmanyl-PE(38:3)+H 3792.1373 | 1569.03112 | 817.01001 | 672.998101 | 357.004713 | 306.0046 ether-PE [M+H]+ Yes Plasmenyl-PE(P-16:0/22:1) 758.602784 15.35941034 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 | 1_Plasmenyl-PE(P-16:1/22:0)+H | 3_Plasmanyl-PE(38:2)+H | 1_Plasmanyl-PC(O-18:0/17:2)+H | 1_Plasmenyl-PC(P-18:0/17:1)+H 8159.72229 | 3993.94535 | 2567.00419 | 1191.97299 | 688.99191 | 668.99329 | 428.0134 | 428.0134 ether-PE [M+H]+ No Plasmenyl-PE(P-20:0/18:1) 758.6032772 14.25101813 1_Plasmenyl-PE(P-20:0/18:1)+H | 3_Plasmanyl-PE(38:2)+H 2385.991502 | 2212.9862 ether-PE [M+H]+ Yes Plasmenyl-PC(P-16:0/20:4) 766.5696586 11.18933537 1_Plasmenyl-PC(P-16:0/20:4)+H | 1_Plasmanyl-PC(O-16:0/20:5)+H | 1_Plasmanyl-PC(O-16:1/20:4)+H 106530.407109 | 105988.443402 | 105694.392162 ether-PC [M+H]+ No Plasmenyl-PE(P-16:0/22:4) 752.5578613 14.07449858 1_Plasmenyl-PE(P-16:0/22:4)+H | 1_Plasmenyl-PE(P-18:1/20:3)+H | 1_Plasmenyl-PE(P-18:0/20:4)+H | 1_Plasmenyl-PE(P-16:1/22:3)+H | 1_Plasmenyl-PE(P-20:1/18:3)+H | 3_Plasmanyl-PE(38:5)+H 19693.82159 | 2739.02144 | 1945.94735 | 1695.947336 | 1675.94456 | 1644.94555 ether-PE [M+H]+ Yes Plasmenyl-PC(P-16:1/24:0) 828.6841449 15.26720427 1_Plasmenyl-PC(P-16:1/24:0)+H | 1_Plasmenyl-PC(P-24:1/16:0)+H | 1_Plasmanyl-PC(O-16:1/24:1)+H | 1_Plasmanyl-PC(O-24:2/16:0)+H | 1_Plasmanyl-PC(O-18:0/22:2)+H | 1_Plasmanyl-PC(O-22:1/18:1)+H | 1_Plasmenyl-PC(P-22:0/18:1)+H | 1_Plasmanyl-PC(O-18:1/22:1)+H | 1_Plasmenyl-PC(P-18:0/22:1)+H 29608.49817 | 29608.49817 | 29598.49836 | 29598.49836 | 29577.49768 | 29577.49768 | 29577.49768 | 29567.49787 | 29567.49787 ether-PC [M+H]+ No Plasmenyl-PC(P-18:0/20:4) 794.6030035 11.90282337 1_Plasmenyl-PC(P-18:0/20:4)+H | 1_Plasmanyl-PC(O-18:1/20:4)+H | 1_Plasmanyl-PC(O-18:0/20:5)+H 82431.49087 | 82379.491696 | 82188.46905 ether-PC [M+H]+ No Plasmenyl-PC(P-18:0/22:6) 818.6040087 11.1006872 1_Plasmenyl-PC(P-18:0/22:6)+H | 1_Plasmanyl-PC(O-18:1/22:6)+H 12637.760045 | 12629.759713 ether-PC [M+H]+ No Plasmenyl-PC(P-18:0/22:5) 820.6194611 12.10466809 1_Plasmenyl-PC(P-18:0/22:5)+H | 1_Plasmanyl-PC(O-18:1/22:5)+H | 1_Plasmanyl-PC(O-18:0/22:6)+H 17487.999426 | 17472.998816 | 17426.99558 ether-PC [M+H]+ No Plasmenyl-PC(P-18:0/18:1) 772.6179921 14.17608984 1_Plasmenyl-PC(P-18:0/18:1)+H | 1_Plasmanyl-PC(O-18:1/18:1)+H | 1_Plasmanyl-PC(O-18:0/18:2)+H | 1_Plasmanyl-PC(O-16:1/20:1)+H | 1_Plasmenyl-PC(P-16:1/20:0)+H | 1_Plasmenyl-PC(P-20:1/16:0)+H | 1_Plasmanyl-PC(O-16:0/20:2)+H | 1_Plasmanyl-PC(O-20:1/16:1)+H | 1_Plasmenyl-PC(P-20:0/16:1)+H 93782.22129 | 93680.227035 | 93000.25853 | 92899.2562 | 92899.2562 | 92899.2562 | 92878.25974 | 92857.260635 | 92857.260635 ether-PC [M+H]+ No Plasmenyl-PE(P-18:1/22:6) 774.5389159 11.54226138 1_Plasmenyl-PE(P-18:1/22:6)+H 5818.341411 ether-PE [M+H]+ Yes Plasmenyl-PE(P-18:0/22:2) 784.6146777 15.3954858 1_Plasmenyl-PE(P-18:0/22:2)+H | 1_Plasmenyl-PE(P-18:1/22:1)+H | 1_Plasmenyl-PE(P-20:0/20:2)+H | 1_Plasmenyl-PE(P-20:1/20:1)+H | 3_Plasmanyl-PE(40:3)+H 2802.092152 | 613.993191 | 292.003312 | 241.006032 | 215.005482 ether-PE [M+H]+ Yes Plasmenyl-PE(P-16:0/18:1) 702.5420212 14.22841646 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 | 3_Plasmanyl-PE(34:2)+H | 1_Plasmenyl-PC(P-16:0/15:1)+H | 1_Plasmanyl-PC(O-16:1/15:1)+H | 1_Plasmenyl-PC(P-16:1/15:0)+H | 1_Plasmenyl-PC(P-18:1/13:0)+H 16002.924212 | 7102.929812 | 815.99329 | 729.99995 | 689.0001 | 441.011242 | 421.009742 | 411.00993 | 360.011322 ether-PE [M+H]+ No Plasmenyl-PE(P-16:0/20:4) 724.5255667 12.14749614 1_Plasmenyl-PE(P-16:0/20:4)+H | 1_Plasmenyl-PE(P-16:1/20:3)+H | 3_Plasmanyl-PE(36:5)+H 19310.76694 | 2419.911916 | 2383.91448 ether-PE [M+H]+ Yes Plasmenyl-PE(P-18:0/22:5) 778.5740133 14.29016098 1_Plasmenyl-PE(P-18:0/22:5)+H | 1_Plasmenyl-PE(P-18:1/22:4)+H | 1_Plasmenyl-PE(P-20:1/20:4)+H | 3_Plasmanyl-PE(40:6)+H 1892.08296 | 453.999595 | 327.00237 | 193.99997 ether-PE [M+H]+ Yes Plasmenyl-PE(P-18:0/22:3) 782.6037927 15.12737792 1_Plasmenyl-PE(P-18:0/22:3)+H | 1_Plasmenyl-PE(P-20:0/20:3)+H | 1_Plasmenyl-PE(P-20:1/20:2)+H | 1_Plasmenyl-PE(P-18:1/22:2)+H | 3_Plasmanyl-PE(40:4)+H 2649.88913 | 542.97746 | 229.99761 | 213.996136 | 203.99626 ether-PE [M+H]+ Yes Plasmenyl-PC(P-16:0/16:1) 716.5558758 11.09139533 1_Plasmenyl-PC(P-16:0/16:1)+H | 1_Plasmanyl-PC(O-16:1/16:1)+H | 3_Plasmanyl-PE(35:2)+H 6455.987986 | 6429.988339 | 855.000052 ether-PC [M+H]+ No Plasmenyl-PC(P-18:1/22:4) 820.6139465 13.81370792 1_Plasmenyl-PC(P-18:1/22:4)+H | 1_Plasmanyl-PC(O-18:1/22:5)+H 14671.431932 | 14613.433762 ether-PC [M+H]+ No Plasmenyl-PE(P-18:0/18:1) 730.5726517 14.85243813 1_Plasmenyl-PE(P-18:0/18:1)+H | 1_Plasmenyl-PE(P-16:0/20:1)+H | 1_Plasmenyl-PE(P-20:0/16:1)+H | 1_Plasmenyl-PE(P-20:1/16:0)+H | 1_Plasmenyl-PE(P-18:1/18:0)+H | 1_Plasmenyl-PE(P-16:1/20:0)+H | 3_Plasmanyl-PE(36:2)+H | 1_Plasmenyl-PC(P-18:0/15:1)+H 9724.859139 | 3078.946689 | 812.986139 | 529.996019 | 519.992109 | 498.995529 | 478.994639 | 386.99954 ether-PE [M+H]+ No Plasmenyl-PC(P-16:0/20:1) 772.6192456 14.65744492 1_Plasmenyl-PC(P-16:0/20:1)+H | 1_Plasmenyl-PC(P-18:0/18:1)+H | 1_Plasmanyl-PC(O-16:1/20:1)+H | 1_Plasmanyl-PC(O-16:0/20:2)+H | 1_Plasmanyl-PC(O-18:1/18:1)+H | 1_Plasmanyl-PC(O-18:0/18:2)+H 80655.51097 | 80392.53448 | 80281.49735 | 80272.52681 | 80146.52897 | 79940.52427 ether-PC [M+H]+ No Plasmenyl-PE(P-18:1/22:3) 780.5880425 14.70163374 1_Plasmenyl-PE(P-18:1/22:3)+H | 1_Plasmenyl-PE(P-18:0/22:4)+H | 1_Plasmenyl-PE(P-20:1/20:3)+H | 3_Plasmanyl-PE(40:5)+H 4551.80739 | 2872.01236 | 742.99106 | 609.9918 ether-PE [M+H]+ Yes Plasmenyl-PC(P-18:0/22:4) 822.636348 14.51641708 1_Plasmenyl-PC(P-18:0/22:4)+H | 1_Plasmanyl-PC(O-18:0/22:5)+H | 1_Plasmanyl-PC(O-18:1/22:4)+H | 1_Plasmenyl-PC(P-18:1/22:3)+H 53758.60828 | 53491.60916 | 53389.61888 | 53152.62168 ether-PC [M+H]+ No Plasmenyl-PC(P-24:0/18:2) 854.6972256 15.34830084 1_Plasmenyl-PC(P-24:0/18:2)+H | 1_Plasmanyl-PC(O-24:1/18:2)+H | 1_Plasmanyl-PC(O-24:0/18:3)+H 29664.12379 | 29644.12231 | 29613.1212 ether-PC [M+H]+ No Plasmenyl-PE(P-18:1/18:1) 728.5568407 14.30313089 1_Plasmenyl-PE(P-18:1/18:1)+H | 1_Plasmenyl-PE(P-16:0/20:2)+H | 1_Plasmenyl-PE(P-18:0/18:2)+H | 1_Plasmenyl-PE(P-20:1/16:1)+H | 1_Plasmenyl-PE(P-16:1/20:1)+H | 3_Plasmanyl-PE(36:3)+H 11156.627039 | 2271.003479 | 717.999593 | 640.001373 | 629.003363 | 589.002829 ether-PE [M+H]+ Yes Plasmenyl-PC(P-16:1/18:1) 742.5716888 11.28718415 1_Plasmenyl-PC(P-16:1/18:1)+H | 1_Plasmanyl-PC(O-16:1/18:2)+H | 1_Plasmenyl-PC(P-16:0/18:2)+H | 1_Plasmenyl-PC(P-18:1/16:1)+H | 1_Plasmanyl-PC(O-16:0/18:3)+H 17090.784229 | 17059.774039 | 17049.815143 | 16973.783015 | 16949.775429 ether-PC [M+H]+ No Plasmenyl-PC(P-22:0/16:0) 802.66885 15.23938252 1_Plasmenyl-PC(P-22:0/16:0)+H | 1_Plasmanyl-PC(O-22:1/16:0)+H | 1_Plasmanyl-PC(O-16:1/22:0)+H | 1_Plasmanyl-PC(O-16:0/22:1)+H | 1_Plasmanyl-PC(O-18:0/20:1)+H | 1_Plasmenyl-PC(P-24:0/14:0)+H | 1_Plasmanyl-PC(O-24:1/14:0)+H | 1_Plasmanyl-PC(O-22:0/16:1)+H | 1_Plasmanyl-PC(O-20:0/18:1)+H 79484.808165 | 79453.810535 | 79433.810415 | 79392.810025 | 79392.810025 | 79372.811795 | 79362.81238 | 79362.811245 | 79351.813735 ether-PC [M+H]+ No Plasmenyl-PC(P-16:0/18:1) 744.5861887 13.96448577 1_Plasmenyl-PC(P-16:0/18:1)+H | 1_Plasmanyl-PC(O-16:1/18:1)+H | 1_Plasmanyl-PC(O-16:0/18:2)+H | 1_Plasmenyl-PC(P-16:1/18:0)+H | 1_Plasmenyl-PC(P-18:1/16:0)+H | 1_Plasmanyl-PC(O-18:1/16:1)+H | 1_Plasmenyl-PC(P-18:0/16:1)+H | 3_Plasmanyl-PE(37:2)+H 125165.15451 | 122396.01931 | 115527.442313 | 112932.30445 | 112932.30445 | 112758.304973 | 112615.310173 | 5629.02234 ether-PC [M+H]+ No Plasmenyl-PC(P-18:1/20:4) 792.5878288 11.38092927 1_Plasmenyl-PC(P-18:1/20:4)+H | 1_Plasmenyl-PC(P-16:0/22:5)+H | 1_Plasmanyl-PC(O-18:1/20:5)+H | 1_Plasmanyl-PC(O-16:0/22:6)+H | 1_Plasmanyl-PC(O-16:1/22:5)+H 68926.306194 | 68893.281374 | 68798.304294 | 68740.286528 | 68676.286924 ether-PC [M+H]+ No Plasmenyl-PE(P-16:0/22:5) 750.5408608 13.46823638 1_Plasmenyl-PE(P-16:0/22:5)+H | 1_Plasmenyl-PE(P-18:1/20:4)+H | 1_Plasmenyl-PE(P-18:0/20:5)+H | 3_Plasmanyl-PE(38:6)+H 4982.957305 | 572.018441 | 516.018421 | 478.017421 ether-PE [M+H]+ Yes Plasmenyl-PC(P-18:1/18:2) 768.5941821 11.88640244 1_Plasmenyl-PC(P-18:1/18:2)+H | 1_Plasmanyl-PC(O-18:1/18:3)+H | 1_MGDG(18:1_18:3)+NH4-CO | 1_MGDG(18:3_18:1)+NH4-CO 48928.976178 | 48790.981918 | 2031.16401 | 2031.16401 ether-PC [M+H]+ No Plasmenyl-PC(P-16:0/22:1) 800.6501623 15.18736991 1_Plasmenyl-PC(P-16:0/22:1)+H | 1_Plasmenyl-PC(P-20:0/18:1)+H | 1_Plasmanyl-PC(O-16:1/22:1)+H | 1_Plasmanyl-PC(O-20:1/18:1)+H | 1_Plasmenyl-PC(P-18:0/20:1)+H | 1_Plasmanyl-PC(O-16:0/22:2)+H | 1_Plasmanyl-PC(O-18:0/20:2)+H | 1_Plasmanyl-PC(O-18:1/20:1)+H | 1_Plasmanyl-PC(O-20:0/18:2)+H 22517.415899 | 22466.440379 | 22441.419169 | 22430.441009 | 22297.433445 | 22297.432589 | 22241.436495 | 22220.434175 | 22190.436759 ether-PC [M+H]+ No Plasmenyl-PC(P-18:1/21:0) 814.669153 14.43353398 1_Plasmenyl-PC(P-18:1/21:0)+H | 1_Plasmenyl-PC(P-16:1/23:0)+H 92367.71227 | 92226.721831 ether-PC [M+H]+ Yes Plasmenyl-PC(P-16:0/22:6) 790.5718502 10.40396625 1_Plasmenyl-PC(P-16:0/22:6)+H | 1_Plasmanyl-PC(O-16:1/22:6)+H 30788.042878 | 30524.039318 ether-PC [M+H]+ No Plasmenyl-PC(P-16:1/21:0) 786.6322342 12.99647703 1_Plasmenyl-PC(P-16:1/21:0)+H 120586.6939 ether-PC [M+H]+ Yes Plasmenyl-PE(P-18:1/22:4) 778.5721476 14.11452396 1_Plasmenyl-PE(P-18:1/22:4)+H | 1_Plasmenyl-PE(P-18:0/22:5)+H | 3_Plasmanyl-PE(40:6)+H 9158.152775 | 1100.985005 | 876.982845 ether-PE [M+H]+ Yes Plasmenyl-PC(P-16:0/20:3) 768.586528 12.4953025 1_Plasmenyl-PC(P-16:0/20:3)+H | 1_Plasmanyl-PC(O-16:0/20:4)+H | 1_Plasmanyl-PC(O-16:1/20:3)+H 27304.234991 | 27154.235544 | 27103.235091 ether-PC [M+H]+ No Plasmenyl-PC(P-20:1/18:1) 798.6321149 14.6653002 1_Plasmenyl-PC(P-20:1/18:1)+H | 1_Plasmenyl-PC(P-16:0/22:2)+H | 1_Plasmanyl-PC(O-16:1/22:2)+H | 1_Plasmenyl-PC(P-18:1/20:1)+H | 1_Plasmanyl-PC(O-20:1/18:2)+H | 1_Plasmanyl-PC(O-18:1/20:2)+H | 1_Plasmanyl-PC(O-16:0/22:3)+H | 1_Plasmanyl-PC(O-18:0/20:3)+H 23159.596716 | 23088.60126 | 23047.60072 | 23016.61019 | 22955.6085 | 22940.60568 | 22930.609196 | 22874.60756 ether-PC [M+H]+ No Plasmenyl-PE(P-16:0/16:1) 674.5090358 11.9794937 1_Plasmenyl-PE(P-16:0/16:1)+H | 1_Plasmenyl-PE(P-18:1/14:0)+H | 1_Plasmenyl-PE(P-16:1/16:0)+H 3790.090116 | 276.011716 | 174.006116 ether-PE [M+H]+ Yes Plasmenyl-PC(P-16:1/17:0) 730.5673617 8.129359877 1_Plasmenyl-PC(P-16:1/17:0)+H 101997.9004 ether-PC [M+H]+ Yes Plasmenyl-PC(P-16:0/22:4) 794.5996838 13.57915691 1_Plasmenyl-PC(P-16:0/22:4)+H | 1_Plasmanyl-PC(O-16:0/22:5)+H | 1_Plasmanyl-PC(O-16:1/22:4)+H 45821.739469 | 45571.744839 | 45478.741359 ether-PC [M+H]+ No Plasmenyl-PC(P-22:0/20:4) 850.6657921 15.26598009 1_Plasmenyl-PC(P-22:0/20:4)+H | 1_Plasmanyl-PC(O-22:1/20:4)+H | 1_Plasmanyl-PC(O-22:0/20:5)+H 3763.930775 | 3743.930445 | 3727.930825 ether-PC [M+H]+ No Plasmenyl-PC(P-16:1/20:5) 762.5362602 10.33311667 1_Plasmenyl-PC(P-16:1/20:5)+H 4532.871136 ether-PC [M+H]+ Yes PS(16:0_18:1) 762.5261517 10.3369872 1_PS(16:0_18:1)+H | 1_PS(16:1_18:0)+H | 3_PS(34:1)+H 11600.21674 | 9613.1335 | 9480.13734 PS [M+H]+ Yes PS(17:0_23:0) 848.6363564 15.12331208 1_PS(17:0_23:0)+H | 3_PS(40:0)+H 10762.38444 | 10731.3866 PS [M+H]+ Yes PS(18:0_18:1) 790.5531225 10.37119106 1_PS(18:0_18:1)+H | 3_PS(36:1)+H 1859.89327 | 1486.91127 PS [M+H]+ Yes PS(18:0_22:4) 840.5730066 12.83514146 1_PS(18:0_22:4)+H | 3_PS(40:4)+H 15146.6852 | 13073.6529 PS [M+H]+ Yes PS(18:0_22:5) 838.5579082 10.77903333 1_PS(18:0_22:5)+H | 1_PS(20:1_20:4)+H | 3_PS(40:5)+H 10515.05613 | 9337.056097 | 9282.0594 PS [M+H]+ Yes PS(18:1_18:1) 788.541719 11.04128577 1_PS(18:1_18:1)+H | 1_PS(18:0_18:2)+H | 1_PS(16:1_20:1)+H | 3_PS(36:2)+H | 1_BMP(18:2_18:2)+NH4 7073.2487 | 7003.23487 | 6592.227929 | 6564.2288 | 934.965889 PS [M+H]+ No PS(19:0_20:4) 826.5571706 10.99659065 1_PS(19:0_20:4)+H | 3_PS(39:4)+H 339.99996 | 189.00339 PS [M+H]+ Yes SM(d16:1/24:1) 785.6533554 14.29124354 1_SM(d16:1/24:1)+H | 1_SM(d18:1/22:1)+H 77600.67193 | 77562.67858 SM [M+H]+ Yes SM(d16:1/24:0) 787.6678448 14.92584733 1_SM(d16:1/24:0)+H | 1_SM(d18:1/22:0)+H 57254.76337 | 57254.76337 SM [M+H]+ Yes SM(d17:1/24:1) 799.6670692 14.61701402 1_SM(d17:1/24:1)+H 92322.53596 SM [M+H]+ Yes SM(d18:0/16:0) 705.5893886 10.22799289 1_SM(d18:0/16:0)+H 113048.1067 SM [M+H]+ Yes SM(d18:0/24:0) 817.7084141 15.44631229 1_SM(d18:0/24:0)+H 23390.76725 SM [M+H]+ Yes SM(d18:1/12:0) 647.5106927 5.451525 1_SM(d18:1/12:0)+H 22284.15498 SM [M+H]+ Yes SM(d18:1/16:0) 703.5736419 8.890393902 1_SM(d18:1/16:0)+H 49586.40222 SM [M+H]+ Yes SM(d18:1/18:0) 731.6049369 12.14703882 1_SM(d18:1/18:0)+H 121356.6012 SM [M+H]+ Yes SM(d18:1/24:1) 813.6834097 14.89723679 1_SM(d18:1/24:1)+H 117247.3722 SM [M+H]+ Yes SM(d18:1/24:0) 815.6981756 15.44114146 1_SM(d18:1/24:0)+H 89738.9252 SM [M+H]+ Yes SM(d18:1/17:0) 717.5858719 10.60206049 1_SM(d18:1/17:0)+H 82110.06703 SM [M+H]+ Yes SM(d18:1/18:1) 729.5897946 9.671963008 1_SM(d18:1/18:1)+H | 1_SM(d18:2/18:0)+H 70438.074484 | 70438.074484 SM [M+H]+ Yes SM(d18:1/26:0) 843.7285183 15.89013565 1_SM(d18:1/26:0)+H | 1_SM(d20:1/24:0)+H 11158.75376 | 11158.75376 SM [M+H]+ Yes SM(d18:2/14:0) 673.5267659 5.658474561 1_SM(d18:2/14:0)+H 40306.20143 SM [M+H]+ Yes SM(d18:2/16:0) 701.5581431 7.363140447 1_SM(d18:2/16:0)+H | 1_SM(d18:1/16:1)+H 94531.361314 | 94284.34464 SM [M+H]+ Yes SM(d18:2/24:1) 811.6672047 14.39592459 1_SM(d18:2/24:1)+H 100654.6892 SM [M+H]+ Yes SM(d18:2/18:3) 723.541168 7.360242917 1_SM(d18:2/18:3)+H 13961.49357 SM [M+H]+ Yes SM(d20:2/24:1) 839.696865 14.97134388 1_SM(d20:2/24:1)+H 19000.79202 SM [M+H]+ Yes TG(14:0_16:0_18:0) 824.7685644 17.68674715 1_TG(14:0_16:0_18:0)+NH4 | 1_TG(15:0_16:0_17:0)+NH4 | 1_TG(16:0_16:0_16:0)+NH4 | 1_TG(15:0_15:0_18:0)+NH4 | 1_TG(12:0_18:0_18:0)+NH4 | 1_TG(14:0_17:0_17:0)+NH4 4944.97225 | 3728.92396 | 3615.92895 | 869.01297 | 859.01274 | 737.02324 TG [M+NH4]+ Yes TG(14:0_16:1_18:1) 820.7355328 17.14584146 1_TG(14:0_16:1_18:1)+NH4 | 1_TG(14:0_16:0_18:2)+NH4 | 1_TG(16:0_16:1_16:1)+NH4 | 1_TG(14:1_16:0_18:1)+NH4 | 1_TG(14:1_16:1_18:0)+NH4 | 1_TG(12:0_16:1_20:1)+NH4 | 1_TG(15:1_16:1_17:0)+NH4 | 1_TG(15:0_16:1_17:1)+NH4 | 1_TG(12:0_16:0_20:2)+NH4 | 1_TG(14:0_14:1_20:1)+NH4 | 1_TG(15:1_16:0_17:1)+NH4 | 1_TG(14:0_14:0_20:2)+NH4 | 1_TG(12:0_18:0_18:2)+NH4 | 1_TG(12:0_18:1_18:1)+NH4 | 1_TG(14:0_17:1_17:1)+NH4 | 1_TG(15:0_15:1_18:1)+NH4 | 1_TG(13:0_17:1_18:1)+NH4 | 1_TG(15:0_15:0_18:2)+NH4 | 1_TG(13:0_17:0_18:2)+NH4 | 1_TG(12:0_14:1_22:1)+NH4 | 1_TG(14:1_17:0_17:1)+NH4 | 1_TG(13:0_15:0_20:2)+NH4 | 1_TG(15:1_15:1_18:0)+NH4 | 1_TG(13:0_15:1_20:1)+NH4 13817.0874 | 11450.9214 | 11029.7594 | 9364.8814 | 8373.9495 | 7373.96936 | 6931.99077 | 6930.9844 | 5471.7732 | 5465.90896 | 4880.78162 | 4411.9698 | 4380.1939 | 4353.1408 | 4211.9554 | 4064.16062 | 4012.15645 | 3748.1974 | 3697.1996 | 2262.93785 | 1912.95555 | 930.01685 | 849.02572 | 680.01323 TG [M+NH4]+ Yes TG(14:0_16:1_18:2) 818.7211522 16.86132058 1_TG(14:0_16:1_18:2)+NH4 | 1_TG(14:1_16:1_18:1)+NH4 | 1_TG(12:0_16:1_20:2)+NH4 | 1_TG(12:0_18:1_18:2)+NH4 | 1_TG(14:1_16:0_18:2)+NH4 | 1_TG(15:1_16:1_17:1)+NH4 | 1_TG(16:1_16:1_16:1)+NH4 | 1_TG(14:0_14:1_20:2)+NH4 | 1_TG(14:0_16:0_18:3)+NH4 | 1_TG(14:0_14:0_20:3)+NH4 | 1_TG(12:0_16:0_20:3)+NH4 | 1_TG(14:0_17:1_17:2)+NH4 | 1_TG(15:1_15:1_18:1)+NH4 | 1_TG(14:1_17:1_17:1)+NH4 | 1_TG(12:0_18:0_18:3)+NH4 | 1_TG(15:1_16:0_17:2)+NH4 3946.0454 | 3156.0604 | 2326.09896 | 2303.9575 | 2238.9495 | 2007.08773 | 1961.0874 | 1602.98186 | 1530.962 | 1226.9855 | 1084.9927 | 1068.98473 | 871.97499 | 730.99514 | 627.00529 | 591.98109 TG [M+NH4]+ Yes TG(14:0_16:0_16:1) 794.720191 17.12783333 1_TG(14:0_16:0_16:1)+NH4 | 1_TG(12:0_16:0_18:1)+NH4 | 1_TG(14:0_14:0_18:1)+NH4 | 1_TG(12:0_14:0_20:1)+NH4 | 1_TG(12:0_16:1_18:0)+NH4 | 1_TG(14:0_14:1_18:0)+NH4 | 1_TG(14:1_16:0_16:0)+NH4 | 1_TG(10:0_16:0_20:1)+NH4 | 1_TG(15:0_15:1_16:0)+NH4 | 1_TG(13:0_16:0_17:1)+NH4 | 1_TG(14:0_15:1_17:0)+NH4 | 1_TG(14:0_15:0_17:1)+NH4 | 1_TG(10:0_18:0_18:1)+NH4 | 1_TG(13:0_16:1_17:0)+NH4 | 1_TG(15:0_15:0_16:1)+NH4 | 1_TG(13:0_15:0_18:1)+NH4 | 1_TG(12:0_17:0_17:1)+NH4 | 1_TG(14:1_15:0_17:0)+NH4 | 1_TG(13:0_15:1_18:0)+NH4 | 1_TG(13:0_13:0_20:1)+NH4 14481.1605 | 11274.0805 | 8977.2275 | 7203.10638 | 6634.1497 | 6315.031 | 6311.8808 | 5645.92698 | 5625.9297 | 5625.92254 | 5338.09454 | 5276.0897 | 4487.1273 | 4365.14534 | 4334.1465 | 4094.13634 | 2371.01754 | 1109.95564 | 745.98874 | 341.99622 TG [M+NH4]+ Yes TG(14:0_16:0_18:1) 822.7516658 17.42251362 1_TG(14:0_16:0_18:1)+NH4 | 1_TG(16:0_16:0_16:1)+NH4 | 1_TG(14:0_16:1_18:0)+NH4 | 1_TG(14:1_16:0_18:0)+NH4 | 1_TG(12:0_16:0_20:1)+NH4 | 1_TG(15:0_16:0_17:1)+NH4 | 1_TG(15:1_16:0_17:0)+NH4 | 1_TG(12:0_18:0_18:1)+NH4 | 1_TG(15:0_15:0_18:1)+NH4 | 1_TG(12:0_16:1_20:0)+NH4 | 1_TG(15:0_16:1_17:0)+NH4 | 1_TG(14:0_14:1_20:0)+NH4 | 1_TG(14:0_17:0_17:1)+NH4 | 1_TG(14:0_14:0_20:1)+NH4 | 1_TG(15:0_15:1_18:0)+NH4 | 1_TG(14:1_17:0_17:0)+NH4 30559.7989 | 21947.6059 | 18350.9019 | 16007.8875 | 14481.9741 | 14239.0136 | 14020.00933 | 11851.204 | 9755.3559 | 9251.5497 | 9069.5981 | 8797.4062 | 8714.4238 | 8561.417 | 2724.87513 | 1084.9867 TG [M+NH4]+ Yes TG(14:1_16:0_16:1) 792.7032497 16.84898191 1_TG(14:1_16:0_16:1)+NH4 | 1_TG(12:0_16:1_18:1)+NH4 | 1_TG(14:0_16:1_16:1)+NH4 | 1_TG(15:0_15:1_16:1)+NH4 | 1_TG(13:0_16:1_17:1)+NH4 | 1_TG(14:0_14:1_18:1)+NH4 | 1_TG(12:0_16:0_18:2)+NH4 | 1_TG(14:0_14:0_18:2)+NH4 | 1_TG(12:0_14:0_20:2)+NH4 | 1_TG(14:0_15:1_17:1)+NH4 | 1_TG(14:1_15:0_17:1)+NH4 | 1_TG(15:1_15:1_16:0)+NH4 | 1_TG(14:1_14:1_18:0)+NH4 | 1_TG(10:0_16:0_20:2)+NH4 | 1_TG(13:0_15:1_18:1)+NH4 | 1_TG(10:0_18:0_18:2)+NH4 | 1_TG(10:0_18:1_18:1)+NH4 | 1_TG(13:0_15:0_18:2)+NH4 | 1_TG(12:0_17:1_17:1)+NH4 | 1_TG(13:0_13:0_20:2)+NH4 2349.9326 | 2045.9499 | 1998.9399 | 1558.95681 | 1527.95512 | 1428.9551 | 1114.9861 | 974.9735 | 897.98211 | 751.98365 | 622.97722 | 606.99322 | 592.97567 | 580.98948 | 533.98991 | 473.98717 | 472.98667 | 462.98769 | 391.99783 | 141.9943 TG [M+NH4]+ Yes TG(15:0_16:0_18:1) 836.7655561 17.55122033 1_TG(15:0_16:0_18:1)+NH4 | 1_TG(16:0_16:1_17:0)+NH4 | 1_TG(16:0_16:0_17:1)+NH4 | 1_TG(15:1_16:0_18:0)+NH4 | 1_TG(15:0_17:0_17:1)+NH4 | 1_TG(14:0_17:0_18:1)+NH4 | 1_TG(13:0_16:0_20:1)+NH4 | 1_TG(14:1_16:0_19:0)+NH4 | 1_TG(15:0_16:1_18:0)+NH4 | 1_TG(13:0_18:0_18:1)+NH4 | 1_TG(14:0_17:1_18:0)+NH4 | 1_TG(12:0_18:1_19:0)+NH4 | 1_TG(14:0_15:0_20:1)+NH4 | 1_TG(14:0_16:1_19:0)+NH4 | 1_TG(13:0_17:1_19:0)+NH4 | 1_TG(15:0_15:1_19:0)+NH4 | 1_TG(14:1_17:0_18:0)+NH4 | 1_TG(15:1_17:0_17:0)+NH4 | 1_TG(12:0_17:0_20:1)+NH4 7596.9915 | 5892.9582 | 5447.9735 | 4418.01416 | 4240.0015 | 4160.8237 | 4060.01531 | 3986.01503 | 2962.0389 | 2861.88716 | 2806.9114 | 2447.88747 | 2428.03255 | 1823.92193 | 1802.94799 | 1782.06799 | 1707.96473 | 1357.96246 | 1347.96479 TG [M+NH4]+ Yes TG(16:0_16:1_20:4) 870.7494302 17.06281878 1_TG(16:0_16:1_20:4)+NH4 | 1_TG(14:0_18:1_20:4)+NH4 | 1_TG(14:1_18:0_20:4)+NH4 | 1_TG(16:0_18:1_18:4)+NH4 | 1_TG(16:1_18:1_18:3)+NH4 | 1_TG(14:1_18:1_20:3)+NH4 | 1_TG(16:0_18:2_18:3)+NH4 | 1_TG(14:0_18:2_20:3)+NH4 | 1_TG(16:1_18:2_18:2)+NH4 | 1_TG(16:1_16:1_20:3)+NH4 | 1_TG(16:0_16:0_20:5)+NH4 | 1_TG(14:0_16:0_22:5)+NH4 | 1_TG(16:1_18:0_18:4)+NH4 | 1_TG(14:1_16:0_22:4)+NH4 | 1_TG(14:0_16:1_22:4)+NH4 | 1_TG(14:1_16:1_22:3)+NH4 | 1_TG(14:1_18:2_20:2)+NH4 | 1_TG(14:0_18:0_20:5)+NH4 | 1_TG(14:0_18:3_20:2)+NH4 2074.053 | 1908.05666 | 1490.04446 | 1204.01867 | 1146.01736 | 1045.02812 | 1041.00166 | 938.00836 | 921.0021 | 900.0167 | 878.0145 | 802.00391 | 784.00241 | 781.00687 | 779.00281 | 728.00516 | 698.99897 | 644.0069 | 469.99911 TG [M+NH4]+ Yes TG(16:0_18:1_18:2) 874.7828053 17.45407602 1_TG(16:0_18:1_18:2)+NH4 | 1_TG(16:1_18:1_18:1)+NH4 | 1_TG(16:1_18:0_18:2)+NH4 | 1_TG(16:0_16:1_20:2)+NH4 | 1_TG(14:0_18:1_20:2)+NH4 | 1_TG(14:1_18:1_20:1)+NH4 | 1_TG(12:0_18:1_22:2)+NH4 | 1_TG(17:1_17:1_18:1)+NH4 | 1_TG(17:0_17:2_18:1)+NH4 | 1_TG(14:0_18:2_20:1)+NH4 | 1_TG(14:1_18:2_20:0)+NH4 | 1_TG(12:0_18:2_22:1)+NH4 | 1_TG(17:0_17:1_18:2)+NH4 | 1_TG(16:0_18:0_18:3)+NH4 | 1_TG(14:0_16:0_22:3)+NH4 | 1_TG(16:0_16:0_20:3)+NH4 | 1_TG(14:1_16:0_22:2)+NH4 | 1_TG(14:0_16:1_22:2)+NH4 | 1_TG(16:1_16:1_20:1)+NH4 | 1_TG(14:1_16:1_22:1)+NH4 | 1_TG(14:1_18:0_20:2)+NH4 | 1_TG(14:0_18:0_20:3)+NH4 | 1_TG(12:0_20:1_20:2)+NH4 | 1_TG(15:0_17:1_20:2)+NH4 | 1_TG(15:1_17:0_20:2)+NH4 | 1_TG(12:0_18:0_22:3)+NH4 | 1_TG(17:1_17:2_18:0)+NH4 | 1_TG(14:0_18:3_20:0)+NH4 | 1_TG(12:0_20:0_20:3)+NH4 | 1_TG(15:0_17:0_20:3)+NH4 | 1_TG(15:1_17:1_20:1)+NH4 | 1_TG(15:0_17:2_20:1)+NH4 | 1_TG(13:0_18:3_21:0)+NH4 | 1_TG(14:1_17:2_21:0)+NH4 | 1_TG(14:1_14:1_24:1)+NH4 | 1_TG(13:0_17:0_22:3)+NH4 | 1_TG(17:0_17:0_18:3)+NH4 | 1_TG(15:0_15:0_22:3)+NH4 | 1_TG(13:0_17:1_22:2)+NH4 | 1_TG(15:0_15:1_22:2)+NH4 | 1_TG(15:1_15:1_22:1)+NH4 | 1_TG(13:0_17:2_22:1)+NH4 | 1_TG(15:1_17:2_20:0)+NH4 66402.313 | 42680.253 | 40417.398 | 36225.381 | 33247.309 | 29217.4604 | 28631.44365 | 28571.44262 | 28539.44467 | 25585.3492 | 23692.45283 | 23574.45374 | 23555.45366 | 21882.7257 | 20697.4563 | 20454.509 | 19137.58315 | 18058.77195 | 16924.9112 | 16633.89324 | 8341.2052 | 8166.022 | 5981.0889 | 5473.07125 | 5410.07267 | 5285.213 | 5100.21825 | 4078.96933 | 3913.00933 | 3831.01067 | 2847.10145 | 2764.10183 | 2486.09237 | 2473.08387 | 2463.08315 | 2461.07997 | 2455.09174 | 2441.07893 | 2368.0842 | 2285.08458 | 2264.08467 | 2264.08467 | 2244.08363 TG [M+NH4]+ Yes TG(16:0_18:1_24:1) 960.8917685 18.33347114 1_TG(16:0_18:1_24:1)+NH4 | 1_TG(16:1_18:1_24:0)+NH4 | 1_TG(18:0_18:1_22:1)+NH4 | 1_TG(16:1_18:0_24:1)+NH4 | 1_TG(18:1_18:1_22:0)+NH4 | 1_TG(18:1_20:0_20:1)+NH4 | 1_TG(14:1_18:1_26:0)+NH4 | 1_TG(16:0_20:1_22:1)+NH4 | 1_TG(16:0_20:2_22:0)+NH4 | 1_TG(16:0_18:2_24:0)+NH4 | 1_TG(16:1_20:1_22:0)+NH4 | 1_TG(16:0_20:0_22:2)+NH4 | 1_TG(16:1_20:0_22:1)+NH4 | 1_TG(14:0_20:1_24:1)+NH4 | 1_TG(16:1_16:1_26:0)+NH4 | 1_TG(12:0_22:1_24:1)+NH4 | 1_TG(14:1_20:0_24:1)+NH4 | 1_TG(18:0_18:2_22:0)+NH4 | 1_TG(14:1_22:0_22:1)+NH4 | 1_TG(14:0_22:0_22:2)+NH4 | 1_TG(18:0_20:1_20:1)+NH4 | 1_TG(18:0_20:0_20:2)+NH4 | 1_TG(14:0_20:2_24:0)+NH4 | 1_TG(14:0_22:1_22:1)+NH4 | 1_TG(18:0_18:0_22:2)+NH4 | 1_TG(14:1_20:1_24:0)+NH4 | 1_TG(14:0_18:2_26:0)+NH4 | 1_TG(12:0_22:2_24:0)+NH4 | 1_TG(17:1_17:1_24:0)+NH4 | 1_TG(12:0_20:2_26:0)+NH4 | 1_TG(18:2_20:0_20:0)+NH4 17333.156 | 13947.217 | 11506.0645 | 10425.946 | 10252.047 | 9660.1799 | 9339.1677 | 8071.9578 | 8061.85699 | 7782.0004 | 7421.9153 | 6875.96728 | 6632.9931 | 6082.9649 | 5777.0152 | 5584.95929 | 5017.9941 | 4690.8054 | 3859.848 | 3728.82828 | 3607.9143 | 3392.91159 | 3336.96759 | 3164.9111 | 3100.89068 | 3071.0198 | 2799.9572 | 2441.99447 | 2385.00134 | 1792.97998 | 1773.98 TG [M+NH4]+ Yes TG(16:0_17:1_18:1) 862.7829227 17.5624311 1_TG(16:0_17:1_18:1)+NH4 | 1_TG(16:1_17:0_18:1)+NH4 | 1_TG(16:1_17:1_18:0)+NH4 | 1_TG(16:0_17:0_18:2)+NH4 | 1_TG(17:0_17:1_17:1)+NH4 | 1_TG(15:1_18:0_18:1)+NH4 | 1_TG(15:0_18:1_18:1)+NH4 | 1_TG(15:1_17:1_19:0)+NH4 | 1_TG(14:0_17:1_20:1)+NH4 | 1_TG(15:0_16:0_20:2)+NH4 | 1_TG(16:0_17:2_18:0)+NH4 | 1_TG(14:1_18:1_19:0)+NH4 | 1_TG(15:1_16:0_20:1)+NH4 | 1_TG(15:0_16:1_20:1)+NH4 | 1_TG(15:0_18:0_18:2)+NH4 | 1_TG(16:1_16:1_19:0)+NH4 | 1_TG(14:0_17:0_20:2)+NH4 | 1_TG(14:1_17:0_20:1)+NH4 | 1_TG(17:0_17:0_17:2)+NH4 | 1_TG(14:0_18:2_19:0)+NH4 | 1_TG(15:0_17:2_19:0)+NH4 6089.1021 | 4022.0918 | 3796.012 | 3419.0919 | 3192.0238 | 2751.0563 | 2565.0728 | 2539.98962 | 2499.99565 | 2441.0624 | 2413.04923 | 2244.05661 | 2151.03563 | 1651.02203 | 1648.0428 | 1238.00332 | 1223.02572 | 1121.02532 | 1080.02303 | 953.01674 | 657.01325 TG [M+NH4]+ Yes TG(16:0_18:0_18:1) 878.8148824 17.91731809 1_TG(16:0_18:0_18:1)+NH4 | 1_TG(14:0_18:0_20:1)+NH4 | 1_TG(16:1_18:0_18:0)+NH4 | 1_TG(12:0_18:0_22:1)+NH4 | 1_TG(17:0_17:1_18:0)+NH4 | 1_TG(16:0_16:0_20:1)+NH4 | 1_TG(14:0_18:1_20:0)+NH4 | 1_TG(16:0_16:1_20:0)+NH4 | 1_TG(17:0_17:0_18:1)+NH4 | 1_TG(12:0_18:1_22:0)+NH4 | 1_TG(15:0_18:1_19:0)+NH4 | 1_TG(14:0_16:0_22:1)+NH4 | 1_TG(12:0_16:0_24:1)+NH4 | 1_TG(16:0_17:1_19:0)+NH4 | 1_TG(12:0_20:0_20:1)+NH4 | 1_TG(15:0_17:0_20:1)+NH4 | 1_TG(14:0_16:1_22:0)+NH4 | 1_TG(16:1_17:0_19:0)+NH4 | 1_TG(14:0_14:0_24:1)+NH4 | 1_TG(15:0_17:1_20:0)+NH4 | 1_TG(15:0_15:0_22:1)+NH4 90643.445 | 39914.9237 | 35531.654 | 34766.65704 | 34642.64615 | 33829.748 | 32247.423 | 31136.4063 | 30707.4962 | 30673.49728 | 30615.49464 | 30480.3681 | 29502.41644 | 29376.41695 | 7191.37494 | 6539.38684 | 3890.00734 | 3094.0672 | 2887.9975 | 2657.03489 | 2098.06004 TG [M+NH4]+ Yes TG(16:0_18:0_22:1) 934.8763115 18.35123598 1_TG(16:0_18:0_22:1)+NH4 | 1_TG(16:0_16:0_24:1)+NH4 | 1_TG(16:0_18:1_22:0)+NH4 | 1_TG(16:0_20:0_20:1)+NH4 | 1_TG(16:0_16:1_24:0)+NH4 | 1_TG(14:0_18:0_24:1)+NH4 | 1_TG(15:1_16:0_25:0)+NH4 | 1_TG(18:0_18:1_20:0)+NH4 | 1_TG(14:0_20:0_22:1)+NH4 | 1_TG(14:0_18:1_24:0)+NH4 | 1_TG(12:0_20:0_24:1)+NH4 | 1_TG(14:0_20:1_22:0)+NH4 | 1_TG(16:1_18:0_22:0)+NH4 | 1_TG(18:0_18:0_20:1)+NH4 | 1_TG(15:0_17:0_24:1)+NH4 | 1_TG(14:0_16:1_26:0)+NH4 | 1_TG(14:0_17:1_25:0)+NH4 | 1_TG(12:0_18:1_26:0)+NH4 | 1_TG(12:0_22:0_22:1)+NH4 | 1_TG(16:1_20:0_20:0)+NH4 | 1_TG(12:0_20:1_24:0)+NH4 | 1_TG(17:0_17:0_22:1)+NH4 | 1_TG(17:0_17:1_22:0)+NH4 | 1_TG(15:0_17:1_24:0)+NH4 | 1_TG(15:1_17:0_24:0)+NH4 | 1_TG(15:0_16:1_25:0)+NH4 | 1_TG(15:0_15:1_26:0)+NH4 8629.7741 | 8257.7545 | 7805.8102 | 7473.788 | 6755.8256 | 6273.8545 | 6212.83196 | 4468.8594 | 3777.991 | 3766.9716 | 3684.88597 | 3333.0048 | 3316.9302 | 2991.9151 | 2844.917 | 2628.02335 | 2373.00996 | 1901.98392 | 1900.02237 | 1761.9694 | 1556.98077 | 1300.01861 | 1230.99871 | 1092.9781 | 1031.98211 | 1010.00344 | 804.99785 TG [M+NH4]+ Yes TG(16:0_16:1_18:1) 848.7679522 17.43246992 1_TG(16:0_16:1_18:1)+NH4 | 1_TG(16:0_16:0_18:2)+NH4 | 1_TG(14:0_16:0_20:2)+NH4 | 1_TG(14:0_16:1_20:1)+NH4 | 1_TG(14:0_18:1_18:1)+NH4 | 1_TG(16:1_16:1_18:0)+NH4 | 1_TG(14:1_18:0_18:1)+NH4 | 1_TG(14:1_16:0_20:1)+NH4 | 1_TG(16:0_17:1_17:1)+NH4 | 1_TG(12:0_16:0_22:2)+NH4 | 1_TG(16:0_17:0_17:2)+NH4 | 1_TG(14:1_16:1_20:0)+NH4 | 1_TG(16:1_17:0_17:1)+NH4 | 1_TG(14:0_18:0_18:2)+NH4 | 1_TG(12:0_18:1_20:1)+NH4 | 1_TG(15:0_17:1_18:1)+NH4 | 1_TG(15:1_17:0_18:1)+NH4 | 1_TG(15:0_17:0_18:2)+NH4 | 1_TG(12:0_18:2_20:0)+NH4 | 1_TG(14:0_14:0_22:2)+NH4 | 1_TG(12:0_18:0_20:2)+NH4 | 1_TG(15:1_17:1_18:0)+NH4 | 1_TG(15:0_17:2_18:0)+NH4 | 1_TG(15:0_15:0_20:2)+NH4 | 1_TG(15:0_15:1_20:1)+NH4 | 1_TG(15:1_15:1_20:0)+NH4 48875.11 | 27109.897 | 23042.61 | 20965.2862 | 20041.052 | 19437.049 | 19328.8144 | 18959.3496 | 18349.3644 | 18265.34441 | 18235.34999 | 17485.02316 | 17125.05465 | 16557.838 | 16505.8272 | 16481.8274 | 16224.82025 | 10274.59025 | 10254.58776 | 5042.28341 | 4858.08 | 3981.07365 | 3867.05174 | 2289.071 | 1538.05745 | 1237.04801 TG [M+NH4]+ Yes TG(16:0_18:1_22:3) 928.8273007 17.73488232 1_TG(16:0_18:1_22:3)+NH4 | 1_TG(18:0_18:1_20:3)+NH4 | 1_TG(18:1_18:1_20:2)+NH4 | 1_TG(18:1_18:2_20:1)+NH4 | 1_TG(16:1_18:0_22:3)+NH4 | 1_TG(16:1_18:1_22:2)+NH4 | 1_TG(18:1_18:3_20:0)+NH4 | 1_TG(16:0_20:1_20:3)+NH4 | 1_TG(16:0_18:0_22:4)+NH4 | 1_TG(18:0_18:2_20:2)+NH4 | 1_TG(16:0_20:2_20:2)+NH4 | 1_TG(14:0_20:1_22:3)+NH4 | 1_TG(16:0_18:2_22:2)+NH4 | 1_TG(18:0_18:3_20:1)+NH4 | 1_TG(14:1_20:0_22:3)+NH4 | 1_TG(17:0_17:1_22:3)+NH4 | 1_TG(16:1_20:0_20:3)+NH4 | 1_TG(14:0_20:3_22:1)+NH4 | 1_TG(18:0_18:0_20:4)+NH4 | 1_TG(16:1_20:1_20:2)+NH4 | 1_TG(16:0_18:3_22:1)+NH4 | 1_TG(16:0_20:0_20:4)+NH4 | 1_TG(14:0_20:2_22:2)+NH4 | 1_TG(14:1_20:2_22:1)+NH4 | 1_TG(16:1_18:2_22:1)+NH4 | 1_TG(18:2_18:2_20:0)+NH4 | 1_TG(14:1_20:1_22:2)+NH4 | 1_TG(14:0_20:0_22:4)+NH4 | 1_TG(17:0_17:0_22:4)+NH4 | 1_TG(17:1_17:1_22:2)+NH4 20593.563 | 20272.628 | 13940.765 | 13700.8291 | 12301.9244 | 11936.7447 | 11312.72109 | 11217.9541 | 10722.0192 | 10670.135 | 8498.049 | 8300.9508 | 7503.0563 | 7295.0897 | 7234.88266 | 7183.88768 | 6943.94689 | 6538.93446 | 6263.03451 | 6049.1495 | 5854.00836 | 5789.002 | 4905.077 | 4578.06893 | 3968.10916 | 3372.07649 | 2852.07157 | 2447.03839 | 2178.02937 | 1896.01981 TG [M+NH4]+ Yes TG(16:0_16:0_18:1) 850.7826073 17.68403984 1_TG(16:0_16:0_18:1)+NH4 | 1_TG(16:0_16:1_18:0)+NH4 | 1_TG(14:0_18:0_18:1)+NH4 | 1_TG(14:0_16:0_20:1)+NH4 | 1_TG(14:1_16:0_20:0)+NH4 | 1_TG(16:0_17:0_17:1)+NH4 | 1_TG(12:0_18:1_20:0)+NH4 | 1_TG(15:0_17:0_18:1)+NH4 | 1_TG(14:0_16:1_20:0)+NH4 | 1_TG(12:0_18:0_20:1)+NH4 | 1_TG(15:0_17:1_18:0)+NH4 | 1_TG(14:1_18:0_18:0)+NH4 | 1_TG(16:1_17:0_17:0)+NH4 | 1_TG(15:0_15:0_20:1)+NH4 22585.6461 | 21329.3901 | 16121.9081 | 14291.3972 | 12963.43847 | 12953.43332 | 10591.19871 | 10581.19356 | 6068.1152 | 5420.77471 | 5214.75488 | 5173.75537 | 4834.16805 | 971.00471 TG [M+NH4]+ Yes TG(16:0_16:1_18:2) 846.7521262 17.1687628 1_TG(16:0_16:1_18:2)+NH4 | 1_TG(14:0_18:1_18:2)+NH4 | 1_TG(16:1_16:1_18:1)+NH4 | 1_TG(14:0_16:1_20:2)+NH4 | 1_TG(14:1_16:1_20:1)+NH4 | 1_TG(12:0_16:1_22:2)+NH4 | 1_TG(16:1_17:1_17:1)+NH4 | 1_TG(14:1_18:0_18:2)+NH4 | 1_TG(14:1_18:1_18:1)+NH4 | 1_TG(12:0_18:1_20:2)+NH4 | 1_TG(12:0_18:2_20:1)+NH4 | 1_TG(15:0_17:1_18:2)+NH4 | 1_TG(15:1_17:1_18:1)+NH4 | 1_TG(15:0_17:2_18:1)+NH4 | 1_TG(14:0_16:0_20:3)+NH4 | 1_TG(14:1_16:0_20:2)+NH4 | 1_TG(14:0_14:1_22:2)+NH4 | 1_TG(12:0_16:0_22:3)+NH4 | 1_TG(16:0_17:1_17:2)+NH4 | 1_TG(16:0_16:0_18:3)+NH4 | 1_TG(14:0_18:0_18:3)+NH4 | 1_TG(14:0_14:0_22:3)+NH4 | 1_TG(14:1_14:1_22:1)+NH4 | 1_TG(12:0_18:0_20:3)+NH4 | 1_TG(15:0_15:1_20:2)+NH4 | 1_TG(15:1_17:2_18:0)+NH4 | 1_TG(15:0_15:0_20:3)+NH4 | 1_TG(15:1_15:1_20:1)+NH4 21107.4496 | 18895.9826 | 16892.2966 | 13274.4416 | 10669.4209 | 9764.38709 | 9678.39224 | 9563.0777 | 9044.9324 | 8710.9365 | 8651.057 | 8493.05583 | 8191.90972 | 8124.90262 | 8091.0265 | 6126.0614 | 4968.04499 | 4880.00075 | 4799.00467 | 4782.9984 | 4295.0127 | 4023.01685 | 1754.0241 | 1342.9967 | 1293.02767 | 1035.99281 | 993.99809 | 906.00158 TG [M+NH4]+ Yes TG(16:0_18:1_22:4) 926.8121379 17.55131362 1_TG(16:0_18:1_22:4)+NH4 | 1_TG(18:1_18:1_20:3)+NH4 | 1_TG(16:0_20:2_20:3)+NH4 | 1_TG(18:0_18:2_20:3)+NH4 | 1_TG(16:1_20:1_20:3)+NH4 | 1_TG(14:0_20:3_22:2)+NH4 | 1_TG(14:1_20:3_22:1)+NH4 | 1_TG(16:1_18:1_22:3)+NH4 | 1_TG(18:1_18:2_20:2)+NH4 | 1_TG(18:0_18:1_20:4)+NH4 | 1_TG(18:1_18:3_20:1)+NH4 | 1_TG(16:1_18:0_22:4)+NH4 | 1_TG(14:0_20:1_22:4)+NH4 | 1_TG(14:1_20:0_22:4)+NH4 | 1_TG(17:0_17:1_22:4)+NH4 | 1_TG(16:0_18:2_22:3)+NH4 | 1_TG(16:0_18:0_22:5)+NH4 | 1_TG(16:0_20:1_20:4)+NH4 | 1_TG(16:0_18:3_22:2)+NH4 | 1_TG(16:1_18:2_22:2)+NH4 | 1_TG(18:0_18:3_20:2)+NH4 | 1_TG(14:0_20:2_22:3)+NH4 | 1_TG(16:1_20:2_20:2)+NH4 | 1_TG(18:2_18:3_20:0)+NH4 | 1_TG(18:2_18:2_20:1)+NH4 | 1_TG(16:1_20:0_20:4)+NH4 | 1_TG(16:1_18:3_22:1)+NH4 | 1_TG(14:1_20:1_22:3)+NH4 | 1_TG(17:1_17:1_22:3)+NH4 | 1_TG(14:0_20:4_22:1)+NH4 | 1_TG(14:1_20:2_22:2)+NH4 | 1_TG(14:0_20:0_22:5)+NH4 | 1_TG(14:1_18:3_24:1)+NH4 | 1_TG(17:0_17:0_22:5)+NH4 19403.921 | 18769.62 | 15964.7185 | 13248.5276 | 12420.5111 | 11688.54724 | 11411.55408 | 10813 | 10781.0705 | 10415.0322 | 9706.0678 | 9657.5956 | 8475.6849 | 8020.68643 | 7986.68718 | 7626.169 | 6759.1256 | 6400.1847 | 6141.16714 | 3671.96244 | 3503.9498 | 3428.9713 | 3163.9435 | 3106.0118 | 3019.0191 | 2986.9597 | 2905.94745 | 2842.99043 | 2589.98618 | 2433.00115 | 2432.99127 | 2163.9899 | 2110.99678 | 1893.99718 TG [M+NH4]+ Yes TG(16:0_16:1_18:3) 844.7360319 16.95517256 1_TG(16:0_16:1_18:3)+NH4 | 1_TG(14:0_18:1_18:3)+NH4 | 1_TG(14:0_16:1_20:3)+NH4 | 1_TG(14:1_18:1_18:2)+NH4 | 1_TG(16:1_16:1_18:2)+NH4 | 1_TG(14:0_18:2_18:2)+NH4 | 1_TG(14:1_16:1_20:2)+NH4 | 1_TG(12:0_18:1_20:3)+NH4 | 1_TG(14:0_16:0_20:4)+NH4 | 1_TG(14:1_16:0_20:3)+NH4 | 1_TG(12:0_16:0_22:4)+NH4 | 1_TG(12:0_18:2_20:2)+NH4 | 1_TG(14:0_14:0_22:4)+NH4 1876.9916 | 1836.9909 | 1344.9577 | 1329.9541 | 1266.9554 | 1021.9724 | 979.96295 | 969.98058 | 918.97979 | 828.9882 | 803.00668 | 764.98943 | 763.9972 TG [M+NH4]+ Yes TG(16:1_18:1_26:0) 988.921907 18.54255894 1_TG(16:1_18:1_26:0)+NH4 | 1_TG(18:1_18:1_24:0)+NH4 | 1_TG(18:0_18:1_24:1)+NH4 | 1_TG(18:1_20:1_22:0)+NH4 | 1_TG(18:1_20:0_22:1)+NH4 | 1_TG(17:1_18:1_25:0)+NH4 | 1_TG(16:0_18:2_26:0)+NH4 | 1_TG(16:1_20:1_24:0)+NH4 | 1_TG(16:0_20:2_24:0)+NH4 | 1_TG(18:0_18:2_24:0)+NH4 | 1_TG(14:0_20:2_26:0)+NH4 | 1_TG(14:1_20:1_26:0)+NH4 | 1_TG(16:1_20:0_24:1)+NH4 | 1_TG(12:0_22:2_26:0)+NH4 | 1_TG(17:1_17:1_26:0)+NH4 | 1_TG(16:1_22:0_22:1)+NH4 | 1_TG(14:0_22:2_24:0)+NH4 | 1_TG(14:1_22:1_24:0)+NH4 | 1_TG(16:0_20:1_24:1)+NH4 | 1_TG(16:0_22:0_22:2)+NH4 | 1_TG(16:0_22:1_22:1)+NH4 | 1_TG(18:2_20:0_22:0)+NH4 | 1_TG(18:0_20:2_22:0)+NH4 | 1_TG(18:0_20:1_22:1)+NH4 | 1_TG(18:0_20:0_22:2)+NH4 | 1_TG(14:0_22:1_24:1)+NH4 | 1_TG(14:1_22:0_24:1)+NH4 | 1_TG(12:0_24:1_24:1)+NH4 | 1_TG(20:0_20:0_20:2)+NH4 | 1_TG(20:0_20:1_20:1)+NH4 12108.364 | 9110.329 | 7919.3976 | 7417.40844 | 7292.41605 | 7281.41714 | 5915.8723 | 5412.9777 | 4655.8351 | 4168.9614 | 3838.9128 | 3726.91269 | 3653.07103 | 3583.92003 | 3580.92153 | 3479.07226 | 3058.93812 | 2987.93451 | 2970.9222 | 2680.93316 | 2640.93252 | 1907.06557 | 1713.99694 | 1663.99832 | 1548.00805 | 1415.02172 | 1353.02023 | 1275.02011 | 1227.01363 | 1200.01623 TG [M+NH4]+ Yes TG(16:1_18:1_18:2) 872.7632872 17.20747744 1_TG(16:1_18:1_18:2)+NH4 | 1_TG(16:0_18:2_18:2)+NH4 | 1_TG(16:0_18:1_18:3)+NH4 | 1_TG(16:0_16:1_20:3)+NH4 | 1_TG(14:0_18:2_20:2)+NH4 | 1_TG(14:1_18:2_20:1)+NH4 | 1_TG(17:1_17:1_18:2)+NH4 | 1_TG(14:0_18:1_20:3)+NH4 | 1_TG(14:1_18:1_20:2)+NH4 | 1_TG(16:1_18:0_18:3)+NH4 | 1_TG(12:0_18:1_22:3)+NH4 | 1_TG(14:0_16:0_22:4)+NH4 | 1_TG(17:1_17:2_18:1)+NH4 | 1_TG(14:0_16:1_22:3)+NH4 | 1_TG(14:1_16:0_22:3)+NH4 | 1_TG(16:1_16:1_20:2)+NH4 | 1_TG(14:0_18:3_20:1)+NH4 | 1_TG(14:1_18:0_20:3)+NH4 | 1_TG(12:0_20:1_20:3)+NH4 | 1_TG(15:1_17:1_20:2)+NH4 | 1_TG(12:0_20:2_20:2)+NH4 | 1_TG(12:0_18:0_22:4)+NH4 | 1_TG(17:2_17:2_18:0)+NH4 | 1_TG(15:1_17:2_20:1)+NH4 22421.755 | 16805.459 | 15343.986 | 13730.571 | 13126.6835 | 11664.67344 | 11489.68424 | 11293.282 | 8362.3197 | 8329.6976 | 7838.29934 | 7775.76524 | 7720.30876 | 7125.7611 | 6939.7713 | 6391.8185 | 4772.89424 | 4093.0038 | 3821.01624 | 1875.03806 | 1849.03974 | 1474.01508 | 1428.01512 | 1357.01508 TG [M+NH4]+ Yes TG(16:1_18:0_18:1) 876.7982688 17.68404187 1_TG(16:1_18:0_18:1)+NH4 | 1_TG(16:0_18:1_18:1)+NH4 | 1_TG(16:0_18:0_18:2)+NH4 | 1_TG(14:0_18:1_20:1)+NH4 | 1_TG(14:1_18:1_20:0)+NH4 | 1_TG(17:0_17:1_18:1)+NH4 | 1_TG(16:0_16:1_20:1)+NH4 | 1_TG(12:0_18:1_22:1)+NH4 | 1_TG(16:0_16:0_20:2)+NH4 | 1_TG(14:0_16:0_22:2)+NH4 | 1_TG(14:1_16:0_22:1)+NH4 | 1_TG(14:0_18:0_20:2)+NH4 | 1_TG(14:1_18:0_20:1)+NH4 | 1_TG(17:1_17:1_18:0)+NH4 | 1_TG(12:0_18:0_22:2)+NH4 | 1_TG(14:0_16:1_22:1)+NH4 | 1_TG(16:1_16:1_20:0)+NH4 | 1_TG(14:0_18:2_20:0)+NH4 | 1_TG(12:0_16:1_24:1)+NH4 | 1_TG(17:0_17:0_18:2)+NH4 | 1_TG(12:0_20:0_20:2)+NH4 | 1_TG(15:0_17:0_20:2)+NH4 | 1_TG(15:0_17:1_20:1)+NH4 | 1_TG(12:0_20:1_20:1)+NH4 | 1_TG(14:0_14:1_24:1)+NH4 | 1_TG(15:0_15:0_22:2)+NH4 42487.819 | 39174.846 | 33515.557 | 26068.3422 | 24695.32376 | 24613.32108 | 24608.419 | 24521.32582 | 18373.58 | 16728.58937 | 16221.55593 | 14784.7062 | 13061.62476 | 12032.64391 | 12021.64182 | 9464.95637 | 9007.918 | 8966.4622 | 8874.91765 | 8305.42417 | 3832.05765 | 3751.05719 | 2546.01393 | 2443.01465 | 2055.06961 | 1476.03319 TG [M+NH4]+ Yes TG(16:1_18:1_24:1) 958.8760865 18.12320874 1_TG(16:1_18:1_24:1)+NH4 | 1_TG(18:1_18:2_22:0)+NH4 | 1_TG(18:0_18:1_22:2)+NH4 | 1_TG(18:1_20:0_20:2)+NH4 | 1_TG(18:1_18:1_22:1)+NH4 | 1_TG(16:0_18:2_24:1)+NH4 | 1_TG(18:1_20:1_20:1)+NH4 | 1_TG(18:0_18:2_22:1)+NH4 | 1_TG(16:1_18:2_24:0)+NH4 | 1_TG(16:1_20:1_22:1)+NH4 | 1_TG(16:1_20:2_22:0)+NH4 | 1_TG(16:1_20:0_22:2)+NH4 | 1_TG(16:0_20:2_22:1)+NH4 | 1_TG(18:2_20:0_20:1)+NH4 | 1_TG(18:0_20:1_20:2)+NH4 | 1_TG(16:0_20:1_22:2)+NH4 | 1_TG(16:0_20:3_22:0)+NH4 | 1_TG(14:0_20:2_24:1)+NH4 | 1_TG(18:0_18:3_22:0)+NH4 | 1_TG(14:1_20:1_24:1)+NH4 | 1_TG(16:0_20:0_22:3)+NH4 | 1_TG(14:1_18:2_26:0)+NH4 | 1_TG(18:0_20:0_20:3)+NH4 | 1_TG(14:0_22:1_22:2)+NH4 | 1_TG(14:1_22:0_22:2)+NH4 | 1_TG(16:0_18:3_24:0)+NH4 | 1_TG(18:0_18:0_22:3)+NH4 | 1_TG(14:0_22:0_22:3)+NH4 | 1_TG(14:1_22:1_22:1)+NH4 | 1_TG(14:1_20:2_24:0)+NH4 | 1_TG(18:3_20:0_20:0)+NH4 | 1_TG(14:0_20:3_24:0)+NH4 | 1_TG(14:0_18:3_26:0)+NH4 4191.1028 | 3828.1274 | 3473.0693 | 3049.0645 | 3002.0519 | 2949.9818 | 2801.0932 | 2784.9974 | 2698.06176 | 2518.0112 | 2418.0163 | 2234.0115 | 2178.9158 | 2147.0389 | 1975.9856 | 1964.9621 | 1803.94613 | 1786.9676 | 1780.9757 | 1756.9817 | 1703.9419 | 1693.02804 | 1630.96483 | 1610.9597 | 1460.98363 | 1454.93956 | 1452.9768 | 1319.9906 | 1275.9515 | 1145.97099 | 923.9725 | 920.97739 | 838.98241 TG [M+NH4]+ Yes TG(17:0_18:1_20:2) 916.8295822 17.79792083 1_TG(17:0_18:1_20:2)+NH4 | 1_TG(18:1_18:2_19:0)+NH4 | 1_TG(17:1_18:1_20:1)+NH4 | 1_TG(15:0_18:1_22:2)+NH4 | 1_TG(15:1_18:1_22:1)+NH4 | 1_TG(17:1_18:0_20:2)+NH4 | 1_TG(17:0_18:2_20:1)+NH4 | 1_TG(17:0_18:0_20:3)+NH4 | 1_TG(17:1_18:2_20:0)+NH4 | 1_TG(16:1_19:0_20:2)+NH4 | 1_TG(16:0_17:1_22:2)+NH4 | 1_TG(15:0_20:1_20:2)+NH4 | 1_TG(16:0_17:0_22:3)+NH4 | 1_TG(15:0_18:0_22:3)+NH4 | 1_TG(15:1_18:0_22:2)+NH4 | 1_TG(16:0_19:0_20:3)+NH4 | 1_TG(15:1_20:0_20:2)+NH4 | 1_TG(16:1_17:1_22:1)+NH4 | 1_TG(15:0_18:2_22:1)+NH4 | 1_TG(16:1_17:0_22:2)+NH4 | 1_TG(14:0_19:0_22:3)+NH4 | 1_TG(15:1_20:1_20:1)+NH4 | 1_TG(14:1_19:0_22:2)+NH4 | 1_TG(15:0_20:0_20:3)+NH4 3340.0309 | 3169.0328 | 3162.0379 | 2734.01413 | 2673.01041 | 1744.0591 | 1319.0501 | 1277.04547 | 1188.04156 | 1179.03 | 1178.01498 | 1157.03815 | 1138.0094 | 1098.03675 | 1057.0339 | 984.00807 | 945.02118 | 926.02799 | 911.03104 | 906.02328 | 692.01358 | 680.02392 | 661.01667 | 559.01598 TG [M+NH4]+ Yes TG(17:0_18:1_18:2) 888.7998084 17.57417988 1_TG(17:0_18:1_18:2)+NH4 | 1_TG(17:1_18:1_18:1)+NH4 | 1_TG(15:0_18:1_20:2)+NH4 | 1_TG(17:2_18:0_18:1)+NH4 | 1_TG(15:1_18:1_20:1)+NH4 | 1_TG(17:1_18:0_18:2)+NH4 | 1_TG(16:0_17:1_20:2)+NH4 | 1_TG(16:1_17:1_20:1)+NH4 | 1_TG(16:0_17:0_20:3)+NH4 | 1_TG(16:1_18:2_19:0)+NH4 | 1_TG(16:1_17:0_20:2)+NH4 | 1_TG(17:1_17:2_19:0)+NH4 | 1_TG(14:0_17:1_22:2)+NH4 | 1_TG(15:0_18:2_20:1)+NH4 | 1_TG(16:0_17:2_20:1)+NH4 | 1_TG(15:0_16:0_22:3)+NH4 | 1_TG(17:0_18:0_18:3)+NH4 | 1_TG(15:1_16:0_22:2)+NH4 | 1_TG(16:0_18:3_19:0)+NH4 | 1_TG(14:0_17:0_22:3)+NH4 | 1_TG(15:1_18:0_20:2)+NH4 | 1_TG(15:0_16:1_22:2)+NH4 | 1_TG(15:0_18:0_20:3)+NH4 | 1_TG(14:0_19:0_20:3)+NH4 | 1_TG(12:0_19:0_22:3)+NH4 4887.0853 | 4471.0694 | 3693.064 | 3674.0867 | 3342.07414 | 3211.0055 | 3109.035 | 2395.0055 | 2247.0754 | 2080.99924 | 2072.0206 | 2004.01084 | 1922.00971 | 1770.0058 | 1649.058 | 1639.04644 | 1620.04217 | 1527.05031 | 1527.05031 | 1360.03108 | 1343.00944 | 1164.01067 | 1155.0246 | 783.01738 | 598.0148 TG [M+NH4]+ Yes TG(17:0_18:1_20:3) 914.8149431 17.60033565 1_TG(17:0_18:1_20:3)+NH4 | 1_TG(17:1_18:1_20:2)+NH4 | 1_TG(15:0_18:1_22:3)+NH4 | 1_TG(16:0_17:1_22:3)+NH4 | 1_TG(17:1_18:0_20:3)+NH4 | 1_TG(18:1_18:3_19:0)+NH4 | 1_TG(16:0_17:0_22:4)+NH4 | 1_TG(16:1_19:0_20:3)+NH4 | 1_TG(17:0_18:2_20:2)+NH4 | 1_TG(17:1_18:2_20:1)+NH4 | 1_TG(15:0_20:1_20:3)+NH4 | 1_TG(16:1_17:0_22:3)+NH4 | 1_TG(18:2_18:2_19:0)+NH4 | 1_TG(17:0_18:3_20:1)+NH4 | 1_TG(15:0_18:0_22:4)+NH4 | 1_TG(15:0_20:2_20:2)+NH4 | 1_TG(14:0_19:0_22:4)+NH4 1813.9902 | 1532.0049 | 1355.00589 | 1204.9956 | 1184.9908 | 1180.99731 | 1057.98114 | 940.98162 | 907.9872 | 895.00299 | 883.98729 | 751.99507 | 599.99065 | 586.99445 | 578.99203 | 527.99129 | 446.99634 TG [M+NH4]+ Yes TG(17:1_18:0_18:1) 890.8100443 17.79516362 1_TG(17:1_18:0_18:1)+NH4 | 1_TG(17:0_18:1_18:1)+NH4 | 1_TG(16:1_18:1_19:0)+NH4 | 1_TG(15:0_18:1_20:1)+NH4 | 1_TG(15:1_18:1_20:0)+NH4 | 1_TG(14:1_18:1_21:0)+NH4 | 1_TG(17:0_18:0_18:2)+NH4 | 1_TG(16:0_17:0_20:2)+NH4 | 1_TG(16:0_17:1_20:1)+NH4 | 1_TG(16:1_17:0_20:1)+NH4 | 1_TG(15:1_18:0_20:1)+NH4 | 1_TG(15:0_18:0_20:2)+NH4 | 1_TG(16:1_17:1_20:0)+NH4 | 1_TG(16:0_18:2_19:0)+NH4 | 1_TG(17:1_17:1_19:0)+NH4 | 1_TG(14:0_17:0_22:2)+NH4 | 1_TG(14:1_17:0_22:1)+NH4 | 1_TG(15:1_17:1_21:0)+NH4 | 1_TG(14:0_17:1_22:1)+NH4 | 1_TG(15:0_16:0_22:2)+NH4 | 1_TG(15:1_16:0_22:1)+NH4 | 1_TG(15:0_18:2_20:0)+NH4 | 1_TG(14:1_19:0_20:1)+NH4 | 1_TG(14:0_18:2_21:0)+NH4 | 1_TG(14:0_19:0_20:2)+NH4 | 1_TG(15:0_16:1_22:1)+NH4 | 1_TG(16:1_16:1_21:0)+NH4 6708.8979 | 5305.8059 | 4473.8129 | 4285.8052 | 4034.80469 | 3994.80454 | 3661.0157 | 3039.9229 | 3037.9948 | 2433.0004 | 2226.02579 | 2161.0083 | 2115.0543 | 2030.9251 | 1883.0463 | 1867.98788 | 1836.99065 | 1790.04536 | 1790.04388 | 1533.93188 | 1522.93347 | 919.9769 | 909.99237 | 899.97557 | 864.9737 | 850.99348 | 789.99397 TG [M+NH4]+ Yes TG(18:0_18:1_18:2) 902.8137211 17.68720874 1_TG(18:0_18:1_18:2)+NH4 | 1_TG(16:0_18:1_20:2)+NH4 | 1_TG(16:1_18:1_20:1)+NH4 | 1_TG(14:0_18:1_22:2)+NH4 | 1_TG(14:1_18:1_22:1)+NH4 | 1_TG(17:2_18:1_19:0)+NH4 | 1_TG(18:1_18:1_18:1)+NH4 | 1_TG(16:1_18:0_20:2)+NH4 | 1_TG(16:0_18:2_20:1)+NH4 | 1_TG(16:0_18:0_20:3)+NH4 | 1_TG(16:1_18:2_20:0)+NH4 | 1_TG(14:0_18:2_22:1)+NH4 | 1_TG(14:0_18:0_22:3)+NH4 | 1_TG(17:1_18:2_19:0)+NH4 | 1_TG(14:1_18:2_22:0)+NH4 | 1_TG(14:1_18:0_22:2)+NH4 | 1_TG(18:0_18:0_18:3)+NH4 | 1_TG(14:0_20:1_20:2)+NH4 | 1_TG(16:0_16:1_22:2)+NH4 | 1_TG(14:1_20:0_20:2)+NH4 | 1_TG(17:0_17:1_20:2)+NH4 | 1_TG(16:0_16:0_22:3)+NH4 | 1_TG(16:0_18:3_20:0)+NH4 | 1_TG(14:0_20:0_20:3)+NH4 | 1_TG(16:1_16:1_22:1)+NH4 | 1_TG(17:0_17:0_20:3)+NH4 | 1_TG(14:1_16:1_24:1)+NH4 | 1_TG(17:1_17:1_20:1)+NH4 | 1_TG(17:0_17:2_20:1)+NH4 | 1_TG(14:1_20:1_20:1)+NH4 | 1_TG(14:0_18:3_22:0)+NH4 | 1_TG(17:1_17:2_20:0)+NH4 | 1_TG(17:0_18:3_19:0)+NH4 53227.621 | 45439.775 | 34053.834 | 30409.5671 | 29924.60619 | 29852.61669 | 29760.611 | 24331.628 | 23505.751 | 22948.402 | 16600.1381 | 14795.0084 | 14739.9178 | 14425.0458 | 14303.04149 | 13882.93489 | 13694.9514 | 13270.6777 | 11748.6474 | 10946.57959 | 10925.58189 | 10071.5651 | 9569.5755 | 4981.8388 | 4507.0787 | 4489.86589 | 4456.08838 | 4429.124 | 4368.12489 | 4348.12149 | 2721.96459 | 2515.00199 | 2392.99709 TG [M+NH4]+ Yes TG(18:0_18:1_18:1) 904.8299118 17.9145935 1_TG(18:0_18:1_18:1)+NH4 | 1_TG(16:0_18:1_20:1)+NH4 | 1_TG(16:1_18:1_20:0)+NH4 | 1_TG(14:0_18:1_22:1)+NH4 | 1_TG(12:0_18:1_24:1)+NH4 | 1_TG(14:1_18:1_22:0)+NH4 | 1_TG(16:1_18:0_20:1)+NH4 | 1_TG(16:0_18:0_20:2)+NH4 | 1_TG(18:0_18:0_18:2)+NH4 | 1_TG(14:0_18:0_22:2)+NH4 | 1_TG(14:1_18:0_22:1)+NH4 | 1_TG(12:0_20:1_22:1)+NH4 | 1_TG(14:0_20:1_20:1)+NH4 | 1_TG(14:1_20:0_20:1)+NH4 | 1_TG(16:0_16:1_22:1)+NH4 | 1_TG(16:0_18:2_20:0)+NH4 | 1_TG(17:0_17:1_20:1)+NH4 | 1_TG(16:0_16:0_22:2)+NH4 | 1_TG(14:1_16:0_24:1)+NH4 | 1_TG(14:0_20:0_20:2)+NH4 | 1_TG(14:0_16:1_24:1)+NH4 | 1_TG(14:0_18:2_22:0)+NH4 | 1_TG(12:0_20:2_22:0)+NH4 | 1_TG(17:0_17:0_20:2)+NH4 | 1_TG(16:1_16:1_22:0)+NH4 | 1_TG(12:0_20:0_22:2)+NH4 | 1_TG(15:0_17:1_22:1)+NH4 | 1_TG(15:1_17:0_22:1)+NH4 | 1_TG(17:1_17:1_20:0)+NH4 | 1_TG(15:0_17:0_22:2)+NH4 | 1_TG(15:0_15:1_24:1)+NH4 | 1_TG(15:1_17:1_22:0)+NH4 100326.067 | 84125.417 | 62175.7463 | 61694.7887 | 60585.8392 | 60351.81305 | 56679.988 | 54999.221 | 43905.223 | 43730.364 | 43308.27132 | 16099.7964 | 15930.8718 | 15900.88272 | 15518.7449 | 15432.8413 | 15294.84676 | 13964.9192 | 13729.92412 | 5161.2041 | 4671.0125 | 4549.99643 | 4017.14213 | 3936.14076 | 3759.96663 | 3631.13 | 3212.02408 | 3212.02408 | 3023.11506 | 3015.08938 | 2627.09712 | 2488.07581 TG [M+NH4]+ Yes TG(18:0_18:1_20:1) 932.8583564 18.12629654 1_TG(18:0_18:1_20:1)+NH4 | 1_TG(16:1_18:1_22:0)+NH4 | 1_TG(16:0_18:1_22:1)+NH4 | 1_TG(18:1_18:1_20:0)+NH4 | 1_TG(14:0_18:1_24:1)+NH4 | 1_TG(16:1_20:0_20:1)+NH4 | 1_TG(16:1_18:0_22:1)+NH4 | 1_TG(14:1_18:1_24:0)+NH4 | 1_TG(18:0_18:2_20:0)+NH4 | 1_TG(16:0_18:0_22:2)+NH4 | 1_TG(16:0_16:1_24:1)+NH4 | 1_TG(16:0_20:1_20:1)+NH4 | 1_TG(14:1_18:0_24:1)+NH4 | 1_TG(16:0_20:0_20:2)+NH4 | 1_TG(18:0_18:0_20:2)+NH4 | 1_TG(14:0_20:1_22:1)+NH4 | 1_TG(14:1_20:1_22:0)+NH4 | 1_TG(16:0_18:2_22:0)+NH4 | 1_TG(12:0_20:1_24:1)+NH4 | 1_TG(14:1_20:0_22:1)+NH4 | 1_TG(14:0_20:0_22:2)+NH4 | 1_TG(14:1_16:1_26:0)+NH4 | 1_TG(16:1_16:1_24:0)+NH4 | 1_TG(15:1_16:1_25:0)+NH4 | 1_TG(14:0_20:2_22:0)+NH4 | 1_TG(14:0_18:2_24:0)+NH4 | 1_TG(12:0_22:0_22:2)+NH4 | 1_TG(12:0_20:2_24:0)+NH4 | 1_TG(12:0_22:1_22:1)+NH4 | 1_TG(12:0_18:2_26:0)+NH4 | 1_TG(17:1_17:1_22:0)+NH4 | 1_TG(15:1_17:1_24:0)+NH4 | 1_TG(14:1_17:1_25:0)+NH4 | 1_TG(15:1_15:1_26:0)+NH4 9273.0937 | 7054.1168 | 6897.1014 | 6299.1377 | 5706.0561 | 5556.0827 | 5463.1694 | 5420.0654 | 5178.177 | 4883.1546 | 4114.1259 | 3992.9917 | 3938.1186 | 3875.1379 | 3661.1249 | 3619.9266 | 3442.9365 | 3241.0381 | 3138.94672 | 3004.0831 | 2758.0738 | 2643.09265 | 2624.0747 | 2404.0884 | 2095.9972 | 1940.9922 | 1688.99852 | 1506.01672 | 1489.00922 | 1466.01507 | 1441.00228 | 1178.00974 | 1084.03102 | 938.01951 TG [M+NH4]+ Yes TG(18:0_18:0_18:1) 906.8446676 18.13578333 1_TG(18:0_18:0_18:1)+NH4 | 1_TG(16:0_18:0_20:1)+NH4 | 1_TG(16:1_18:0_20:0)+NH4 | 1_TG(14:0_18:0_22:1)+NH4 | 1_TG(14:1_18:0_22:0)+NH4 | 1_TG(12:0_18:0_24:1)+NH4 | 1_TG(17:1_18:0_19:0)+NH4 | 1_TG(16:0_18:1_20:0)+NH4 | 1_TG(14:0_18:1_22:0)+NH4 | 1_TG(12:0_18:1_24:0)+NH4 | 1_TG(17:0_18:1_19:0)+NH4 | 1_TG(16:0_16:1_22:0)+NH4 | 1_TG(14:0_20:0_20:1)+NH4 | 1_TG(14:0_16:0_24:1)+NH4 | 1_TG(14:1_16:0_24:0)+NH4 | 1_TG(16:0_16:0_22:1)+NH4 | 1_TG(12:0_20:0_22:1)+NH4 | 1_TG(12:0_20:1_22:0)+NH4 | 1_TG(17:0_17:1_20:0)+NH4 | 1_TG(14:1_20:0_20:0)+NH4 | 1_TG(15:0_19:0_20:1)+NH4 | 1_TG(17:0_17:0_20:1)+NH4 | 1_TG(14:0_16:1_24:0)+NH4 | 1_TG(12:0_16:1_26:0)+NH4 | 1_TG(14:0_14:1_26:0)+NH4 | 1_TG(15:0_16:1_23:0)+NH4 | 1_TG(16:1_19:0_19:0)+NH4 | 1_TG(14:0_17:1_23:0)+NH4 | 1_TG(15:0_17:1_22:0)+NH4 | 1_TG(15:0_17:0_22:1)+NH4 | 1_TG(12:0_17:1_25:0)+NH4 | 1_TG(15:0_15:0_24:1)+NH4 | 1_TG(14:1_15:0_25:0)+NH4 | 1_TG(14:1_17:0_23:0)+NH4 17544.2172 | 15174.1292 | 13516.0096 | 12210.0389 | 11920.06242 | 11763.05364 | 11630.04635 | 10582.1732 | 7417.169 | 7045.1667 | 6745.16689 | 3986.074 | 3757.9666 | 3647.03954 | 3432.04602 | 3422.0545 | 2544.959 | 2344.0451 | 2244.94935 | 2234.95102 | 1983.02695 | 1952.02589 | 1862.989 | 1375.0111 | 1304.98992 | 1294.00766 | 1283.00629 | 1213.98512 | 1122.01212 | 1050.00225 | 923.00085 | 863.0002 | 861.99954 | 861.99954 TG [M+NH4]+ Yes TG(18:0_18:1_22:5) 952.8305934 17.57615087 1_TG(18:0_18:1_22:5)+NH4 | 1_TG(18:1_20:2_20:3)+NH4 | 1_TG(18:1_20:1_20:4)+NH4 | 1_TG(18:1_18:1_22:4)+NH4 | 1_TG(18:1_18:2_22:3)+NH4 | 1_TG(16:0_20:2_22:4)+NH4 | 1_TG(16:0_20:3_22:3)+NH4 | 1_TG(16:0_20:1_22:5)+NH4 | 1_TG(18:1_18:3_22:2)+NH4 | 1_TG(18:0_18:2_22:4)+NH4 | 1_TG(18:1_20:0_20:5)+NH4 | 1_TG(18:0_20:2_20:4)+NH4 | 1_TG(16:0_20:4_22:2)+NH4 | 1_TG(18:0_20:3_20:3)+NH4 | 1_TG(18:2_20:1_20:3)+NH4 | 1_TG(16:1_20:1_22:4)+NH4 | 1_TG(18:2_20:0_20:4)+NH4 | 1_TG(18:0_20:1_20:5)+NH4 | 1_TG(16:0_20:5_22:1)+NH4 | 1_TG(16:1_20:3_22:2)+NH4 | 1_TG(18:0_18:3_22:3)+NH4 | 1_TG(16:1_20:4_22:1)+NH4 | 1_TG(16:1_20:0_22:5)+NH4 | 1_TG(18:3_20:0_20:3)+NH4 | 1_TG(14:1_20:4_24:1)+NH4 | 1_TG(14:0_22:2_22:4)+NH4 | 1_TG(14:1_22:1_22:4)+NH4 | 1_TG(14:0_22:1_22:5)+NH4 | 1_TG(16:1_20:2_22:3)+NH4 | 1_TG(18:2_20:2_20:2)+NH4 | 1_TG(18:3_20:1_20:2)+NH4 | 1_TG(18:2_18:3_22:1)+NH4 | 1_TG(18:2_18:2_22:2)+NH4 | 1_TG(14:0_22:3_22:3)+NH4 | 1_TG(14:1_22:2_22:3)+NH4 | 1_TG(14:0_20:5_24:1)+NH4 | 1_TG(14:1_20:5_24:0)+NH4 8070.967 | 7407.0478 | 7349.0193 | 6741.954 | 6381.9889 | 5757.0998 | 5727.1469 | 5519.9933 | 5459.95791 | 5406.211 | 5368.95635 | 5366.2918 | 5360.15881 | 4838.251 | 4505.1853 | 4130.0666 | 4019.21896 | 3814.16669 | 3796.07539 | 3791.15411 | 3786.19 | 3752.16669 | 3465.02226 | 3464.17606 | 3384.19277 | 3346.11401 | 3275.1082 | 3128.04859 | 3123.117 | 2981.1628 | 2915.1172 | 2577.13649 | 2485.13881 | 2249.1191 | 2198.11571 | 1922.11455 | 1850.11022 TG [M+NH4]+ Yes TG(18:0_18:1_20:2) 930.8441826 17.90137927 1_TG(18:0_18:1_20:2)+NH4 | 1_TG(18:1_18:1_20:1)+NH4 | 1_TG(16:0_18:1_22:2)+NH4 | 1_TG(16:0_20:1_20:2)+NH4 | 1_TG(18:0_18:2_20:1)+NH4 | 1_TG(18:1_18:2_20:0)+NH4 | 1_TG(16:1_18:1_22:1)+NH4 | 1_TG(14:1_18:1_24:1)+NH4 | 1_TG(16:0_18:0_22:3)+NH4 | 1_TG(16:1_18:0_22:2)+NH4 | 1_TG(16:1_20:0_20:2)+NH4 | 1_TG(14:0_20:2_22:1)+NH4 | 1_TG(18:0_18:3_20:0)+NH4 | 1_TG(14:0_20:1_22:2)+NH4 | 1_TG(14:1_20:2_22:0)+NH4 | 1_TG(16:1_20:1_20:1)+NH4 | 1_TG(18:0_18:0_20:3)+NH4 | 1_TG(12:0_20:2_24:1)+NH4 | 1_TG(14:1_20:1_22:1)+NH4 | 1_TG(17:1_19:0_20:2)+NH4 | 1_TG(16:0_18:2_22:1)+NH4 | 1_TG(17:2_19:0_20:1)+NH4 | 1_TG(16:0_20:0_20:3)+NH4 | 1_TG(16:1_18:2_22:0)+NH4 | 1_TG(14:1_20:0_22:2)+NH4 | 1_TG(14:0_18:2_24:1)+NH4 | 1_TG(16:0_18:3_22:0)+NH4 | 1_TG(12:0_22:1_22:2)+NH4 | 1_TG(14:0_20:0_22:3)+NH4 | 1_TG(16:1_16:1_24:1)+NH4 | 1_TG(17:0_17:1_22:2)+NH4 | 1_TG(17:0_17:2_22:1)+NH4 | 1_TG(17:1_17:1_22:1)+NH4 | 1_TG(17:0_17:0_22:3)+NH4 | 1_TG(14:0_20:3_22:0)+NH4 | 1_TG(12:0_22:0_22:3)+NH4 | 1_TG(17:0_19:0_20:3)+NH4 | 1_TG(17:1_17:2_22:0)+NH4 | 1_TG(18:3_19:0_19:0)+NH4 21205.832 | 14862.911 | 13447.069 | 13425.844 | 13127.426 | 13057.0723 | 12171.1998 | 10735.1462 | 9301.6128 | 8960.766 | 8869.1873 | 7732.1258 | 7717.69471 | 7161.845 | 7074.13541 | 7030.903 | 6976.6872 | 6961.12561 | 6852.8688 | 6807.11741 | 5938.9438 | 5899.83841 | 4561.9875 | 4314.06041 | 3572.0813 | 3535.9972 | 3440.98441 | 3100.07321 | 2946.0351 | 2636.1202 | 2425.06015 | 2088.06195 | 2057.06121 | 1807.03454 | 1800.04261 | 1796.03521 | 1592.04735 | 1351.04741 | 1351.04741 TG [M+NH4]+ Yes TG(18:0_18:1_22:4) 954.8429543 17.77256728 1_TG(18:0_18:1_22:4)+NH4 | 1_TG(18:1_20:1_20:3)+NH4 | 1_TG(18:0_20:2_20:3)+NH4 | 1_TG(18:0_20:1_20:4)+NH4 | 1_TG(16:0_20:1_22:4)+NH4 | 1_TG(18:1_20:0_20:4)+NH4 | 1_TG(16:0_20:3_22:2)+NH4 | 1_TG(18:0_18:2_22:3)+NH4 | 1_TG(18:0_18:0_22:5)+NH4 | 1_TG(18:0_18:4_22:1)+NH4 | 1_TG(18:0_18:3_22:2)+NH4 | 1_TG(18:1_18:1_22:3)+NH4 | 1_TG(16:0_20:4_22:1)+NH4 | 1_TG(18:2_20:0_20:3)+NH4 | 1_TG(16:1_20:3_22:1)+NH4 | 1_TG(18:1_18:2_22:2)+NH4 | 1_TG(18:1_20:2_20:2)+NH4 | 1_TG(18:1_18:3_22:1)+NH4 | 1_TG(16:1_20:0_22:4)+NH4 | 1_TG(14:0_22:1_22:4)+NH4 | 1_TG(16:0_20:2_22:3)+NH4 | 1_TG(16:0_20:0_22:5)+NH4 | 1_TG(16:1_20:1_22:3)+NH4 | 1_TG(16:0_18:4_24:1)+NH4 | 1_TG(14:0_20:4_24:1)+NH4 | 1_TG(18:2_20:1_20:2)+NH4 | 1_TG(18:4_20:0_20:1)+NH4 | 1_TG(18:3_20:1_20:1)+NH4 | 1_TG(14:0_22:2_22:3)+NH4 | 1_TG(16:1_20:2_22:2)+NH4 | 1_TG(18:3_20:0_20:2)+NH4 | 1_TG(16:1_18:3_24:1)+NH4 | 1_TG(18:2_18:2_22:1)+NH4 4093.0429 | 3366.0664 | 3337.0433 | 3112.9968 | 2781.9485 | 2615.99774 | 2605.99934 | 2523.0075 | 2364.9999 | 2259.01134 | 2255.00626 | 2187.0198 | 2184.94004 | 2168.00104 | 2152.01044 | 2134.01474 | 2098.0133 | 2087.01656 | 1998.95024 | 1927.94665 | 1883.9563 | 1796.95144 | 1626.9802 | 1599.96321 | 1599.94682 | 1553.9643 | 1378.97464 | 1343.97062 | 1226.96725 | 1208.96434 | 1177.95676 | 1141.96923 | 1131.96204 TG [M+NH4]+ Yes TG(18:1_20:1_22:3) 982.8774289 17.97023782 1_TG(18:1_20:1_22:3)+NH4 | 1_TG(18:1_20:3_22:1)+NH4 | 1_TG(18:1_20:0_22:4)+NH4 | 1_TG(18:1_18:3_24:1)+NH4 | 1_TG(18:1_20:2_22:2)+NH4 | 1_TG(16:0_22:2_22:3)+NH4 | 1_TG(16:0_22:1_22:4)+NH4 | 1_TG(18:0_20:1_22:4)+NH4 | 1_TG(18:0_20:2_22:3)+NH4 | 1_TG(18:0_20:3_22:2)+NH4 | 1_TG(16:0_20:4_24:1)+NH4 | 1_TG(18:0_20:4_22:1)+NH4 | 1_TG(18:2_20:0_22:3)+NH4 | 1_TG(18:2_20:1_22:2)+NH4 | 1_TG(16:1_22:1_22:3)+NH4 | 1_TG(18:3_20:1_22:1)+NH4 | 1_TG(20:1_20:1_20:3)+NH4 | 1_TG(18:2_20:2_22:1)+NH4 | 1_TG(20:0_20:2_20:3)+NH4 | 1_TG(20:1_20:2_20:2)+NH4 | 1_TG(16:1_20:3_24:1)+NH4 | 1_TG(20:0_20:1_20:4)+NH4 | 1_TG(14:0_22:4_24:1)+NH4 | 1_TG(18:2_18:2_24:1)+NH4 | 1_TG(18:3_20:0_22:2)+NH4 | 1_TG(16:1_22:2_22:2)+NH4 4249.9416 | 3760.9483 | 3731.9142 | 3527.9376 | 3519.9383 | 3093.8779 | 3085.855 | 3073.9103 | 2918.9255 | 2592.9399 | 2566.88691 | 2281.91331 | 2216.9079 | 2159.9168 | 2138.9322 | 2129.9246 | 2097.9597 | 1996.9091 | 1962.952 | 1951.943 | 1922.9678 | 1814.93311 | 1814.92059 | 1653.9191 | 1619.9201 | 1464.9408 TG [M+NH4]+ Yes TG(18:1_18:2_20:3) 924.7977008 17.36045691 1_TG(18:1_18:2_20:3)+NH4 | 1_TG(16:1_18:1_22:4)+NH4 | 1_TG(16:0_18:2_22:4)+NH4 | 1_TG(16:1_20:2_20:3)+NH4 | 1_TG(16:0_18:1_22:5)+NH4 | 1_TG(18:1_18:3_20:2)+NH4 | 1_TG(16:1_18:2_22:3)+NH4 | 1_TG(18:1_18:1_20:4)+NH4 | 1_TG(14:0_20:2_22:4)+NH4 | 1_TG(16:0_20:3_20:3)+NH4 | 1_TG(14:1_20:1_22:4)+NH4 | 1_TG(18:0_18:2_20:4)+NH4 | 1_TG(18:0_18:3_20:3)+NH4 | 1_TG(18:2_18:3_20:1)+NH4 | 1_TG(18:2_18:2_20:2)+NH4 | 1_TG(14:0_20:3_22:3)+NH4 | 1_TG(16:1_20:1_20:4)+NH4 | 1_TG(16:1_18:0_22:5)+NH4 | 1_TG(16:0_20:2_20:4)+NH4 | 1_TG(16:0_18:3_22:3)+NH4 | 1_TG(16:0_18:0_22:6)+NH4 | 1_TG(14:1_20:2_22:3)+NH4 | 1_TG(14:0_20:1_22:5)+NH4 | 1_TG(12:0_22:3_22:3)+NH4 5526.993 | 5426.025 | 4222.0438 | 3483.9497 | 3337.9852 | 3315.0081 | 3286.0667 | 3066.9912 | 2809.9867 | 2616.9058 | 2477.97225 | 2464.04246 | 2447.91866 | 2433.04632 | 2433.0447 | 2400.9067 | 2137.00512 | 1943.99866 | 1814.9857 | 1600.9789 | 1286.96394 | 1219.97573 | 1043.96632 | 946.96449 TG [M+NH4]+ Yes TG(18:1_20:3_20:4) 948.7988789 17.2389461 1_TG(18:1_20:3_20:4)+NH4 | 1_TG(18:1_18:2_22:5)+NH4 | 1_TG(18:2_20:2_20:4)+NH4 | 1_TG(16:0_20:3_22:5)+NH4 | 1_TG(16:0_20:4_22:4)+NH4 | 1_TG(16:1_20:4_22:3)+NH4 | 1_TG(16:1_20:2_22:5)+NH4 | 1_TG(18:0_18:3_22:5)+NH4 | 1_TG(18:0_20:4_20:4)+NH4 | 1_TG(18:1_18:3_22:4)+NH4 | 1_TG(18:1_18:1_22:6)+NH4 | 1_TG(18:2_20:3_20:3)+NH4 | 1_TG(18:1_20:2_20:5)+NH4 | 1_TG(18:0_18:2_22:6)+NH4 | 1_TG(18:3_20:2_20:3)+NH4 | 1_TG(16:1_20:3_22:4)+NH4 | 1_TG(18:2_18:3_22:3)+NH4 | 1_TG(18:2_18:2_22:4)+NH4 | 1_TG(18:0_20:3_20:5)+NH4 | 1_TG(16:0_20:2_22:6)+NH4 | 1_TG(16:0_20:5_22:3)+NH4 1577.9806 | 1511.9955 | 1323.97359 | 1301.98339 | 1233.98779 | 1203.98563 | 1174.99289 | 1119.98794 | 1091.98219 | 924.98645 | 898.9884 | 898.971 | 847.98368 | 833.97529 | 819.96804 | 788.9751 | 782.97568 | 761.9748 | 758.97188 | 727.98288 | 544.97802 TG [M+NH4]+ Yes TG(18:1_18:2_24:0) 986.907384 18.32519858 1_TG(18:1_18:2_24:0)+NH4 | 1_TG(18:1_18:1_24:1)+NH4 | 1_TG(18:1_20:2_22:0)+NH4 | 1_TG(18:1_20:1_22:1)+NH4 | 1_TG(18:1_20:0_22:2)+NH4 | 1_TG(18:0_18:2_24:1)+NH4 | 1_TG(16:1_18:2_26:0)+NH4 | 1_TG(16:1_20:1_24:1)+NH4 | 1_TG(16:0_20:2_24:1)+NH4 | 1_TG(16:1_20:2_24:0)+NH4 | 1_TG(16:1_22:1_22:1)+NH4 | 1_TG(18:2_20:1_22:0)+NH4 | 1_TG(16:1_22:0_22:2)+NH4 | 1_TG(18:2_20:0_22:1)+NH4 | 1_TG(16:0_22:1_22:2)+NH4 | 1_TG(14:1_22:1_24:1)+NH4 | 1_TG(14:0_22:2_24:1)+NH4 | 1_TG(18:0_20:2_22:1)+NH4 | 1_TG(18:0_20:1_22:2)+NH4 | 1_TG(20:0_20:1_20:2)+NH4 | 1_TG(14:1_20:2_26:0)+NH4 | 1_TG(14:1_22:2_24:0)+NH4 | 1_TG(20:1_20:1_20:1)+NH4 9064.1321 | 8234.104 | 7140.14426 | 7135.1919 | 6761.16781 | 5529.9453 | 5518.0082 | 5364.0055 | 4838.8508 | 4329.0289 | 3623.0564 | 3507.98296 | 3504.04646 | 3371.97875 | 3055.93986 | 2993.95157 | 2971.93496 | 2566.0285 | 2323.05626 | 1948.00065 | 1723.97617 | 1716.00273 | 1437.0155 TG [M+NH4]+ Yes TG(18:1_20:2_20:4) 950.8134392 17.36644146 1_TG(18:1_20:2_20:4)+NH4 | 1_TG(18:1_18:2_22:4)+NH4 | 1_TG(18:1_20:3_20:3)+NH4 | 1_TG(16:0_20:3_22:4)+NH4 | 1_TG(18:0_20:3_20:4)+NH4 | 1_TG(18:1_18:1_22:5)+NH4 | 1_TG(18:2_20:2_20:3)+NH4 | 1_TG(18:2_20:1_20:4)+NH4 | 1_TG(16:0_20:4_22:3)+NH4 | 1_TG(18:1_18:3_22:3)+NH4 | 1_TG(18:0_18:1_22:6)+NH4 | 1_TG(18:1_20:1_20:5)+NH4 | 1_TG(16:1_20:3_22:3)+NH4 | 1_TG(16:0_20:2_22:5)+NH4 | 1_TG(16:1_20:2_22:4)+NH4 | 1_TG(18:0_18:2_22:5)+NH4 | 1_TG(18:3_20:1_20:3)+NH4 | 1_TG(16:1_20:1_22:5)+NH4 | 1_TG(18:0_18:3_22:4)+NH4 | 1_TG(14:0_22:3_22:4)+NH4 | 1_TG(18:2_18:2_22:3)+NH4 | 1_TG(16:0_20:1_22:6)+NH4 | 1_TG(18:0_20:2_20:5)+NH4 | 1_TG(18:3_20:2_20:2)+NH4 | 1_TG(14:1_22:3_22:3)+NH4 3673.9786 | 3627.0144 | 3235.9077 | 3062.0045 | 3057.986 | 2889.9743 | 2863.9924 | 2667.0647 | 2604.0469 | 2553.9576 | 2483.94629 | 2409.94924 | 2397.9731 | 2382.037 | 2361.0475 | 2331.0543 | 2051.9655 | 1979.0355 | 1901.0394 | 1849.04527 | 1717.0419 | 1528.01509 | 1496.00114 | 1406.012 | 1101.01261 TG [M+NH4]+ Yes TG(18:1_18:2_24:1) 984.8908428 18.13833025 1_TG(18:1_18:2_24:1)+NH4 | 1_TG(18:1_20:2_22:1)+NH4 | 1_TG(18:1_20:3_22:0)+NH4 | 1_TG(18:1_20:1_22:2)+NH4 | 1_TG(18:1_20:0_22:3)+NH4 | 1_TG(16:0_20:3_24:1)+NH4 | 1_TG(18:1_18:3_24:0)+NH4 | 1_TG(18:0_18:3_24:1)+NH4 | 1_TG(18:2_20:1_22:1)+NH4 | 1_TG(18:0_20:3_22:1)+NH4 | 1_TG(18:0_20:1_22:3)+NH4 | 1_TG(18:2_20:2_22:0)+NH4 | 1_TG(18:2_20:0_22:2)+NH4 | 1_TG(18:0_20:2_22:2)+NH4 | 1_TG(16:1_20:2_24:1)+NH4 | 1_TG(18:2_18:2_24:0)+NH4 | 1_TG(16:0_22:1_22:3)+NH4 | 1_TG(16:1_20:3_24:0)+NH4 | 1_TG(14:0_22:3_24:1)+NH4 | 1_TG(16:0_22:2_22:2)+NH4 | 1_TG(20:0_20:1_20:3)+NH4 | 1_TG(16:1_22:1_22:2)+NH4 | 1_TG(14:1_22:2_24:1)+NH4 | 1_TG(16:1_22:0_22:3)+NH4 | 1_TG(20:1_20:1_20:2)+NH4 | 1_TG(18:3_20:0_22:1)+NH4 | 1_TG(20:0_20:2_20:2)+NH4 | 1_TG(18:3_20:1_22:0)+NH4 | 1_TG(14:1_22:3_24:0)+NH4 3637.0477 | 2585.0246 | 2583.01568 | 2512.01 | 2511.0366 | 2367.0173 | 2343.01708 | 2235.0376 | 2191.0425 | 2175.0325 | 2088.045 | 2069.07008 | 2011.0639 | 1982.0544 | 1941.0486 | 1878.0569 | 1862.0303 | 1639.03598 | 1629.03238 | 1581.0277 | 1570.0184 | 1450.0345 | 1450.02096 | 1434.05268 | 1316.0295 | 1212.024 | 1198.045 | 1197.01558 | 1134.03544 TG [M+NH4]+ Yes TG(18:1_18:2_18:3) 896.7671159 17.05441037 1_TG(18:1_18:2_18:3)+NH4 | 1_TG(16:1_18:2_20:3)+NH4 | 1_TG(14:0_18:2_22:4)+NH4 | 1_TG(16:1_18:3_20:2)+NH4 | 1_TG(16:0_18:3_20:3)+NH4 | 1_TG(16:0_18:2_20:4)+NH4 | 1_TG(16:1_18:1_20:4)+NH4 | 1_TG(14:0_18:3_22:3)+NH4 | 1_TG(14:1_18:1_22:4)+NH4 | 1_TG(14:1_18:2_22:3)+NH4 | 1_TG(18:0_18:2_18:4)+NH4 | 1_TG(18:2_18:2_18:2)+NH4 | 1_TG(18:0_18:3_18:3)+NH4 | 1_TG(14:0_18:1_22:5)+NH4 | 1_TG(16:1_16:1_22:4)+NH4 | 1_TG(18:1_18:1_18:4)+NH4 | 1_TG(16:0_16:1_22:5)+NH4 | 1_TG(14:0_20:3_20:3)+NH4 | 1_TG(12:0_20:2_22:4)+NH4 | 1_TG(14:1_20:2_20:3)+NH4 | 1_TG(14:0_20:2_20:4)+NH4 | 1_TG(12:0_20:3_22:3)+NH4 | 1_TG(14:1_18:0_22:5)+NH4 | 1_TG(16:0_18:4_20:2)+NH4 2297.9506 | 1696.9975 | 1601.9851 | 1413.01481 | 1389.00383 | 1324.96633 | 1252.0073 | 1206.99616 | 1191.00936 | 1176.97312 | 1130.97279 | 1084.9747 | 1071.99669 | 1020.99337 | 975.039 | 808.99619 | 803.0217 | 730.015 | 710.0252 | 692.01667 | 658.00221 | 599.01895 | 503.00462 | 472.00713 TG [M+NH4]+ Yes TG(18:1_18:2_20:4) 922.782198 17.20585316 1_TG(18:1_18:2_20:4)+NH4 | 1_TG(16:0_20:3_20:4)+NH4 | 1_TG(16:1_20:2_20:4)+NH4 | 1_TG(18:0_18:3_20:4)+NH4 | 1_TG(14:0_20:4_22:3)+NH4 | 1_TG(16:1_18:1_22:5)+NH4 | 1_TG(18:1_18:3_20:3)+NH4 | 1_TG(16:0_18:2_22:5)+NH4 | 1_TG(18:1_18:1_20:5)+NH4 | 1_TG(16:1_18:2_22:4)+NH4 | 1_TG(14:0_20:3_22:4)+NH4 | 1_TG(18:2_18:2_20:3)+NH4 | 1_TG(18:0_18:2_20:5)+NH4 | 1_TG(16:1_20:3_20:3)+NH4 | 1_TG(18:1_18:4_20:2)+NH4 | 1_TG(16:0_18:3_22:4)+NH4 | 1_TG(16:0_20:2_20:5)+NH4 | 1_TG(14:0_20:2_22:5)+NH4 | 1_TG(18:2_18:3_20:2)+NH4 | 1_TG(18:0_18:4_20:3)+NH4 | 1_TG(16:1_18:3_22:3)+NH4 | 1_TG(16:0_18:4_22:3)+NH4 2922.9434 | 2676.9546 | 2323.92437 | 2207.93981 | 2141.93273 | 1878.9819 | 1712.036 | 1594.0032 | 1485.0043 | 1404.0138 | 1329.03233 | 1301.0407 | 1253.01221 | 1222.0217 | 1219.0171 | 1217.0233 | 1182.00627 | 1165.9915 | 1074.02707 | 1044.03424 | 1006.0068 | 866.01813 TG [M+NH4]+ Yes TG(18:1_20:4_22:1) 980.8599404 17.80176603 1_TG(18:1_20:4_22:1)+NH4 | 1_TG(18:1_20:3_22:2)+NH4 | 1_TG(18:1_20:2_22:3)+NH4 | 1_TG(18:0_20:4_22:2)+NH4 | 1_TG(18:0_20:3_22:3)+NH4 | 1_TG(18:1_20:1_22:4)+NH4 | 1_TG(18:0_20:2_22:4)+NH4 | 1_TG(18:1_20:0_22:5)+NH4 | 1_TG(18:1_18:4_24:1)+NH4 | 1_TG(18:0_20:1_22:5)+NH4 | 1_TG(20:0_20:2_20:4)+NH4 | 1_TG(20:1_20:2_20:3)+NH4 | 1_TG(20:1_20:1_20:4)+NH4 | 1_TG(16:1_20:4_24:1)+NH4 | 1_TG(16:0_22:2_22:4)+NH4 | 1_TG(16:0_22:3_22:3)+NH4 | 1_TG(16:0_22:1_22:5)+NH4 | 1_TG(18:2_20:3_22:1)+NH4 | 1_TG(18:2_20:1_22:3)+NH4 | 1_TG(20:0_20:3_20:3)+NH4 | 1_TG(16:1_22:2_22:3)+NH4 | 1_TG(16:1_22:1_22:4)+NH4 | 1_TG(18:2_20:2_22:2)+NH4 | 1_TG(18:3_20:2_22:1)+NH4 | 1_TG(18:2_20:0_22:4)+NH4 | 1_TG(18:4_20:1_22:1)+NH4 | 1_TG(18:3_20:1_22:2)+NH4 | 1_TG(18:3_20:0_22:3)+NH4 | 1_TG(20:2_20:2_20:2)+NH4 | 1_TG(14:0_22:5_24:1)+NH4 | 1_TG(18:2_18:3_24:1)+NH4 | 1_TG(18:4_20:0_22:2)+NH4 2937.916 | 2747.94727 | 2680.9222 | 2646.94387 | 2626.9601 | 2616.9328 | 2383.9629 | 2381.91985 | 2304.92513 | 2266.94166 | 1866.94729 | 1852.9725 | 1812.9414 | 1794.93719 | 1784.95727 | 1743.9361 | 1725.93826 | 1690.9712 | 1565.9439 | 1506.97059 | 1495.94437 | 1489.9572 | 1453.96117 | 1406.95669 | 1383.96279 | 1367.95134 | 1348.95446 | 1316.94589 | 1273.9569 | 1227.94788 | 1202.95259 | 1191.9574 TG [M+NH4]+ Yes METABOLITES_END #END