#METABOLOMICS WORKBENCH cwang_20220917_105845 DATATRACK_ID:3462 STUDY_ID:ST002284 ANALYSIS_ID:AN003732 VERSION 1 CREATED_ON 01-26-2024 #PROJECT PR:PROJECT_TITLE Comparing water-soluble metabolites and lipid changes on human organoids and PR:PROJECT_TITLE corresponding culture medium with different genotypes at different culturing PR:PROJECT_TITLE stages PR:PROJECT_SUMMARY Quantitative metabolome and lipidome analysis of human brain organoids with PR:PROJECT_SUMMARY different genetic mutations. Water-soluble metabolites were extracted from 1- PR:PROJECT_SUMMARY and 4-month-old WT, PT, PTCC, and PTN organoids and their respective culture PR:PROJECT_SUMMARY medium. PR:INSTITUTE DKFZ PR:DEPARTMENT Molecular Neurogenetics PR:LABORATORY Molecular Neurogenetics PR:LAST_NAME Wang PR:FIRST_NAME Changwen PR:ADDRESS Im Neuenheimer Feld 581, Heidelberg, Baden-Wurttemberg, 69120, Germany PR:EMAIL c.wang@dkfz-heidelberg.de PR:PHONE +49 6221 42 3455 PR:PUBLICATIONS https://www.nature.com/articles/s41698-024-00500-5, PR:PUBLICATIONS https://pubmed.ncbi.nlm.nih.gov/38273014/ PR:DOI http://dx.doi.org/10.21228/M8GT5D #STUDY ST:STUDY_TITLE Genetically defined human GBM organoids reveal principles of GBM development and ST:STUDY_TITLE actionable targets ST:STUDY_SUMMARY Recent advances in glioblastoma (GBM) studies provide a comprehensive catalog of ST:STUDY_SUMMARY its genetic aberrations and cellular heterogeneity. However, a solid ST:STUDY_SUMMARY understanding of genotype-based analysis of cancer pathway dependency and ST:STUDY_SUMMARY actionable target identification is required to transform GBM treatment into a ST:STUDY_SUMMARY personalized era. Here, we generated a spectrum of mutant iPSCs harboring ST:STUDY_SUMMARY frequent GBM mutations with CRISPR/Cas9 and profiled the organoids (LEGO: ST:STUDY_SUMMARY Laboratory Engineered Glioblastoma Organoid) derived from these iPSCs temporally ST:STUDY_SUMMARY on transcriptome, methylome, metabolome, lipidome, proteome, and ST:STUDY_SUMMARY phospho-proteome levels. We found that LEGOs form brain tumors in vivo and ST:STUDY_SUMMARY recapitulate critical features of human GBM. The multi-omics analysis discovered ST:STUDY_SUMMARY essential milestones driven by genetic heterogeneity during GBM progressions, ST:STUDY_SUMMARY such as lineage alteration, methylome rewriting, and metabolome/lipidome ST:STUDY_SUMMARY reprogramming, in concordance with altered pathway activity and drug response. ST:STUDY_SUMMARY This study provides a tool and research path to realizing genome-based ST:STUDY_SUMMARY personalized GBM therapy using novel advanced models. ST:INSTITUTE DKFZ ST:DEPARTMENT Molecular Neurogenetics ST:LABORATORY Molecular Neurogenetics ST:LAST_NAME Wang ST:FIRST_NAME Changwen ST:ADDRESS Im Neuenheimer Feld 581 ST:EMAIL c.wang@dkfz-heidelberg.de ST:PHONE +49 6221 42 3455 ST:SUBMIT_DATE 2022-09-17 #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]Additional sample data SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S21_1m_woCells_1 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S21_1m_woCells_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S22_1m_woCells_2 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S22_1m_woCells_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S23_1m_woCells_3 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S23_1m_woCells_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S24_1m_woCells_4 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S24_1m_woCells_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S25_1m_woCells_5 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S25_1m_woCells_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S21_1m_woCells_1 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S21_1m_woCells_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S22_1m_woCells_2 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S22_1m_woCells_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S23_1m_woCells_3 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S23_1m_woCells_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S24_1m_woCells_4 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S24_1m_woCells_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S25_1m_woCells_5 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S25_1m_woCells_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S46_4m_woCells_1 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S46_4m_woCells_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S47_4m_woCells_2 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S47_4m_woCells_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S48_4m_woCells_3 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S48_4m_woCells_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S49_4m_woCells_4 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S49_4m_woCells_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S50_4m_woCells_5 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S50_4m_woCells_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S46_4m_woCells_1 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S46_4m_woCells_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S47_4m_woCells_2 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S47_4m_woCells_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S48_4m_woCells_3 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S48_4m_woCells_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S49_4m_woCells_4 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S49_4m_woCells_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S50_4m_woCells_5 Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S50_4m_woCells_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S11_1m_PTCC_1 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S11_1m_PTCC_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S12_1m_PTCC_2 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S12_1m_PTCC_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S13_1m_PTCC_3 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S13_1m_PTCC_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S14_1m_PTCC_4 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S14_1m_PTCC_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S15_1m_PTCC_5 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S15_1m_PTCC_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S11_1m_PTCC_1 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S11_1m_PTCC_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S12_1m_PTCC_2 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S12_1m_PTCC_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S13_1m_PTCC_3 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S13_1m_PTCC_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S14_1m_PTCC_4 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S14_1m_PTCC_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S15_1m_PTCC_5 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S15_1m_PTCC_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S11_1m_PTCC_1 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S11_1m_PTCC_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S12_1m_PTCC_2 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S12_1m_PTCC_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S13_1m_PTCC_3 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S13_1m_PTCC_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S14_1m_PTCC_4 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S14_1m_PTCC_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S15_1m_PTCC_5 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S15_1m_PTCC_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S11_1m_PTCC_1 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S11_1m_PTCC_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S12_1m_PTCC_2 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S12_1m_PTCC_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S13_1m_PTCC_3 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S13_1m_PTCC_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S14_1m_PTCC_4 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S14_1m_PTCC_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S15_1m_PTCC_5 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S15_1m_PTCC_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S36_4m_PTCC_1 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S36_4m_PTCC_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S37_4m_PTCC_2 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S37_4m_PTCC_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S38_4m_PTCC_3 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S38_4m_PTCC_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S39_4m_PTCC_4 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S39_4m_PTCC_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S40_4m_PTCC_5 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S40_4m_PTCC_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S36_4m_PTCC_1 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S36_4m_PTCC_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S37_4m_PTCC_2 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S37_4m_PTCC_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S38_4m_PTCC_3 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S38_4m_PTCC_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S39_4m_PTCC_4 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S39_4m_PTCC_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S40_4m_PTCC_5 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S40_4m_PTCC_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S31_4m_PTCC_1 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S31_4m_PTCC_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S32_4m_PTCC_2 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S32_4m_PTCC_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S33_4m_PTCC_3 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S33_4m_PTCC_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S34_4m_PTCC_4 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S34_4m_PTCC_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S35_4m_PTCC_5 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S35_4m_PTCC_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S31_4m_PTCC_1 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S31_4m_PTCC_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S32_4m_PTCC_2 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S32_4m_PTCC_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S33_4m_PTCC_3 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S33_4m_PTCC_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S34_4m_PTCC_4 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S34_4m_PTCC_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S35_4m_PTCC_5 Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S35_4m_PTCC_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S16_1m_PTN_1 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S16_1m_PTN_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S17_1m_PTN_2 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S17_1m_PTN_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S18_1m_PTN_3 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S18_1m_PTN_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S19_1m_PTN_4 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S19_1m_PTN_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S20_1m_PTN_5 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S20_1m_PTN_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S16_1m_PTN_1 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S16_1m_PTN_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S17_1m_PTN_2 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S17_1m_PTN_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S18_1m_PTN_3 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S18_1m_PTN_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S19_1m_PTN_4 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S19_1m_PTN_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S20_1m_PTN_5 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S20_1m_PTN_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S16_1m_PTN_1 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S16_1m_PTN_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S17_1m_PTN_2 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S17_1m_PTN_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S18_1m_PTN_3 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S18_1m_PTN_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S19_1m_PTN_4 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S19_1m_PTN_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S20_1m_PTN_5 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S20_1m_PTN_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S16_1m_PTN_1 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S16_1m_PTN_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S17_1m_PTN_2 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S17_1m_PTN_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S18_1m_PTN_3 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S18_1m_PTN_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S19_1m_PTN_4 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S19_1m_PTN_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S20_1m_PTN_5 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S20_1m_PTN_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S41_4m_PTN_1 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S41_4m_PTN_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S42_4m_PTN_2 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S42_4m_PTN_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S43_4m_PTN_3 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S43_4m_PTN_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S44_4m_PTN_4 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S44_4m_PTN_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S45_4m_PTN_5 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S45_4m_PTN_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S41_4m_PTN_1 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S41_4m_PTN_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S42_4m_PTN_2 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S42_4m_PTN_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S43_4m_PTN_3 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S43_4m_PTN_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S44_4m_PTN_4 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S44_4m_PTN_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S45_4m_PTN_5 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S45_4m_PTN_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S36_4m_PTN_1 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S36_4m_PTN_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S37_4m_PTN_2 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S37_4m_PTN_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S38_4m_PTN_3 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S38_4m_PTN_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S39_4m_PTN_4 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S39_4m_PTN_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S40_4m_PTN_5 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S40_4m_PTN_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S36_4m_PTN_1 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S36_4m_PTN_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S37_4m_PTN_2 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S37_4m_PTN_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S38_4m_PTN_3 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S38_4m_PTN_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S39_4m_PTN_4 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S39_4m_PTN_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S40_4m_PTN_5 Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S40_4m_PTN_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S06_1m_PT_1 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S06_1m_PT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S07_1m_PT_2 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S07_1m_PT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S08_1m_PT_3 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S08_1m_PT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S09_1m_PT_4 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S09_1m_PT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S10_1m_PT_5 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S10_1m_PT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S06_1m_PT_1 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S06_1m_PT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S07_1m_PT_2 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S07_1m_PT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S08_1m_PT_3 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S08_1m_PT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S09_1m_PT_4 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S09_1m_PT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S10_1m_PT_5 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S10_1m_PT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S06_1m_PT_1 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S06_1m_PT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S07_1m_PT_2 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S07_1m_PT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S08_1m_PT_3 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S08_1m_PT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S09_1m_PT_4 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S09_1m_PT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S10_1m_PT_5 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S10_1m_PT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S06_1m_PT_1 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S06_1m_PT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S07_1m_PT_2 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S07_1m_PT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S08_1m_PT_3 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S08_1m_PT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S08_1m_PT_4 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S08_1m_PT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S10_1m_PT_5 Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S10_1m_PT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S31_4m_PT_1 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S31_4m_PT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S32_4m_PT_2 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S32_4m_PT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S33_4m_PT_3 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S33_4m_PT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S34_4m_PT_4 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S34_4m_PT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S35_4m_PT_5 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S35_4m_PT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S31_4m_PT_1 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S31_4m_PT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S32_4m_PT_2 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S32_4m_PT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S33_4m_PT_3 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S33_4m_PT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S34_4m_PT_4 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S34_4m_PT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S35_4m_PT_5 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S35_4m_PT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S26_4m_PT_1 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S26_4m_PT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S27_4m_PT_2 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S27_4m_PT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S28_4m_PT_3 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S28_4m_PT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S29_4m_PT_4 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S29_4m_PT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S30_4m_PT_5 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S30_4m_PT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S26_4m_PT_1 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S26_4m_PT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S27_4m_PT_2 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S27_4m_PT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S28_4m_PT_3 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S28_4m_PT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S29_4m_PT_4 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S29_4m_PT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S30_4m_PT_5 Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S30_4m_PT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S01_1m_WT_1 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S01_1m_WT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S02_1m_WT_2 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S02_1m_WT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S03_1m_WT_3 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S03_1m_WT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S04_1m_WT_4 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S04_1m_WT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S05_1m_WT_5 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S05_1m_WT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S01_1m_WT_1 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S01_1m_WT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S02_1m_WT_2 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S02_1m_WT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S03_1m_WT_3 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S03_1m_WT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S04_1m_WT_4 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S04_1m_WT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S05_1m_WT_5 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S05_1m_WT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S01_1m_WT_1 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S01_1m_WT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S02_1m_WT_2 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S02_1m_WT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S03_1m_WT_3 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S03_1m_WT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S04_1m_WT_4 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S04_1m_WT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S05_1m_WT_5 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S05_1m_WT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S01_1m_WT_1 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S01_1m_WT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S02_1m_WT_2 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S02_1m_WT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S03_1m_WT_3 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S03_1m_WT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S04_1m_WT_4 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S04_1m_WT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S05_1m_WT_5 Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S05_1m_WT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S26_4m_WT_1 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S26_4m_WT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S27_4m_WT_2 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S27_4m_WT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S28_4m_WT_3 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S28_4m_WT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S29_4m_WT_4 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S29_4m_WT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_Lip_S30_4m_WT_5 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Med_Lip_S30_4m_WT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S26_4m_WT_1 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S26_4m_WT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S27_4m_WT_2 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S27_4m_WT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S28_4m_WT_3 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S28_4m_WT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S29_4m_WT_4 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S29_4m_WT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Med_S30_4m_WT_5 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Med_S30_4m_WT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S21_4m_WT_1 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S21_4m_WT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S22_4m_WT_2 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S22_4m_WT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S23_4m_WT_3 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S23_4m_WT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S24_4m_WT_4 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S24_4m_WT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Lip_Org_S25_4m_WT_5 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Lipids; RAW_FILE_NAME=LS21_049_Lip_Org_S25_4m_WT_5.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S21_4m_WT_1 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S21_4m_WT_1.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S22_4m_WT_2 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S22_4m_WT_2.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S23_4m_WT_3 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S23_4m_WT_3.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S24_4m_WT_4 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S24_4m_WT_4.mzML SUBJECT_SAMPLE_FACTORS - LS21_049_Org_S25_4m_WT_5 Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Analyzed target=Water-soluble metabolites; RAW_FILE_NAME=LS21_049_Org_S25_4m_WT_5.mzML #COLLECTION CO:COLLECTION_SUMMARY Organoid samples were quickly washed with 154 mM ammonium acetate on ice and CO:COLLECTION_SUMMARY snap-frozen in liquid nitrogen. The medium samples were collected from each well CO:COLLECTION_SUMMARY and snap-frozen in liquid nitrogen. All samples were stored at -80°C before CO:COLLECTION_SUMMARY extraction. CO:SAMPLE_TYPE Organoid CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY Not applicable #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Water-soluble metabolites and lipids were extracted from the organoids and SP:SAMPLEPREP_SUMMARY corresponding culture medium. Details are described in the Sampleprep Protocol SP:SAMPLEPREP_SUMMARY Files (WSplusLipid.pdf) #CHROMATOGRAPHY CH:METHODS_FILENAME WSplusLipid.pdf CH:INSTRUMENT_NAME Thermo Dionex Ultimate 3000 CH:COLUMN_NAME Thermo Accucore HILIC (100 x 2.1mm,2.6um) CH:CHROMATOGRAPHY_TYPE HILIC #ANALYSIS AN:ANALYSIS_TYPE MS AN:ANALYSIS_PROTOCOL_FILE WSplusLipid.pdf #MS MS:INSTRUMENT_NAME Thermo Q Exactive Plus Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:MS_COMMENTS - MS:ION_MODE POSITIVE #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS peak intensity MS_METABOLITE_DATA_START Samples LS21_049_Med_Lip_S21_1m_woCells_1 LS21_049_Med_Lip_S22_1m_woCells_2 LS21_049_Med_Lip_S23_1m_woCells_3 LS21_049_Med_Lip_S24_1m_woCells_4 LS21_049_Med_Lip_S25_1m_woCells_5 LS21_049_Med_S21_1m_woCells_1 LS21_049_Med_S22_1m_woCells_2 LS21_049_Med_S23_1m_woCells_3 LS21_049_Med_S24_1m_woCells_4 LS21_049_Med_S25_1m_woCells_5 LS21_049_Med_Lip_S46_4m_woCells_1 LS21_049_Med_Lip_S47_4m_woCells_2 LS21_049_Med_Lip_S48_4m_woCells_3 LS21_049_Med_Lip_S49_4m_woCells_4 LS21_049_Med_Lip_S50_4m_woCells_5 LS21_049_Med_S46_4m_woCells_1 LS21_049_Med_S47_4m_woCells_2 LS21_049_Med_S48_4m_woCells_3 LS21_049_Med_S49_4m_woCells_4 LS21_049_Med_S50_4m_woCells_5 LS21_049_Med_Lip_S11_1m_PTCC_1 LS21_049_Med_Lip_S12_1m_PTCC_2 LS21_049_Med_Lip_S13_1m_PTCC_3 LS21_049_Med_Lip_S14_1m_PTCC_4 LS21_049_Med_Lip_S15_1m_PTCC_5 LS21_049_Med_S11_1m_PTCC_1 LS21_049_Med_S12_1m_PTCC_2 LS21_049_Med_S13_1m_PTCC_3 LS21_049_Med_S14_1m_PTCC_4 LS21_049_Med_S15_1m_PTCC_5 LS21_049_Lip_Org_S11_1m_PTCC_1 LS21_049_Lip_Org_S12_1m_PTCC_2 LS21_049_Lip_Org_S13_1m_PTCC_3 LS21_049_Lip_Org_S14_1m_PTCC_4 LS21_049_Lip_Org_S15_1m_PTCC_5 LS21_049_Org_S11_1m_PTCC_1 LS21_049_Org_S12_1m_PTCC_2 LS21_049_Org_S13_1m_PTCC_3 LS21_049_Org_S14_1m_PTCC_4 LS21_049_Org_S15_1m_PTCC_5 LS21_049_Med_Lip_S36_4m_PTCC_1 LS21_049_Med_Lip_S37_4m_PTCC_2 LS21_049_Med_Lip_S38_4m_PTCC_3 LS21_049_Med_Lip_S39_4m_PTCC_4 LS21_049_Med_Lip_S40_4m_PTCC_5 LS21_049_Med_S36_4m_PTCC_1 LS21_049_Med_S37_4m_PTCC_2 LS21_049_Med_S38_4m_PTCC_3 LS21_049_Med_S39_4m_PTCC_4 LS21_049_Med_S40_4m_PTCC_5 LS21_049_Lip_Org_S31_4m_PTCC_1 LS21_049_Lip_Org_S32_4m_PTCC_2 LS21_049_Lip_Org_S33_4m_PTCC_3 LS21_049_Lip_Org_S34_4m_PTCC_4 LS21_049_Lip_Org_S35_4m_PTCC_5 LS21_049_Org_S31_4m_PTCC_1 LS21_049_Org_S32_4m_PTCC_2 LS21_049_Org_S33_4m_PTCC_3 LS21_049_Org_S34_4m_PTCC_4 LS21_049_Org_S35_4m_PTCC_5 LS21_049_Med_Lip_S16_1m_PTN_1 LS21_049_Med_Lip_S17_1m_PTN_2 LS21_049_Med_Lip_S18_1m_PTN_3 LS21_049_Med_Lip_S19_1m_PTN_4 LS21_049_Med_Lip_S20_1m_PTN_5 LS21_049_Med_S16_1m_PTN_1 LS21_049_Med_S17_1m_PTN_2 LS21_049_Med_S18_1m_PTN_3 LS21_049_Med_S19_1m_PTN_4 LS21_049_Med_S20_1m_PTN_5 LS21_049_Lip_Org_S16_1m_PTN_1 LS21_049_Lip_Org_S17_1m_PTN_2 LS21_049_Lip_Org_S18_1m_PTN_3 LS21_049_Lip_Org_S19_1m_PTN_4 LS21_049_Lip_Org_S20_1m_PTN_5 LS21_049_Org_S16_1m_PTN_1 LS21_049_Org_S17_1m_PTN_2 LS21_049_Org_S18_1m_PTN_3 LS21_049_Org_S19_1m_PTN_4 LS21_049_Org_S20_1m_PTN_5 LS21_049_Med_Lip_S41_4m_PTN_1 LS21_049_Med_Lip_S42_4m_PTN_2 LS21_049_Med_Lip_S43_4m_PTN_3 LS21_049_Med_Lip_S44_4m_PTN_4 LS21_049_Med_Lip_S45_4m_PTN_5 LS21_049_Med_S41_4m_PTN_1 LS21_049_Med_S42_4m_PTN_2 LS21_049_Med_S43_4m_PTN_3 LS21_049_Med_S44_4m_PTN_4 LS21_049_Med_S45_4m_PTN_5 LS21_049_Lip_Org_S36_4m_PTN_1 LS21_049_Lip_Org_S37_4m_PTN_2 LS21_049_Lip_Org_S38_4m_PTN_3 LS21_049_Lip_Org_S39_4m_PTN_4 LS21_049_Lip_Org_S40_4m_PTN_5 LS21_049_Org_S36_4m_PTN_1 LS21_049_Org_S37_4m_PTN_2 LS21_049_Org_S38_4m_PTN_3 LS21_049_Org_S39_4m_PTN_4 LS21_049_Org_S40_4m_PTN_5 LS21_049_Med_Lip_S06_1m_PT_1 LS21_049_Med_Lip_S07_1m_PT_2 LS21_049_Med_Lip_S08_1m_PT_3 LS21_049_Med_Lip_S09_1m_PT_4 LS21_049_Med_Lip_S10_1m_PT_5 LS21_049_Med_S06_1m_PT_1 LS21_049_Med_S07_1m_PT_2 LS21_049_Med_S08_1m_PT_3 LS21_049_Med_S09_1m_PT_4 LS21_049_Med_S10_1m_PT_5 LS21_049_Lip_Org_S06_1m_PT_1 LS21_049_Lip_Org_S07_1m_PT_2 LS21_049_Lip_Org_S08_1m_PT_3 LS21_049_Lip_Org_S09_1m_PT_4 LS21_049_Lip_Org_S10_1m_PT_5 LS21_049_Org_S06_1m_PT_1 LS21_049_Org_S07_1m_PT_2 LS21_049_Org_S08_1m_PT_3 LS21_049_Org_S08_1m_PT_4 LS21_049_Org_S10_1m_PT_5 LS21_049_Med_Lip_S31_4m_PT_1 LS21_049_Med_Lip_S32_4m_PT_2 LS21_049_Med_Lip_S33_4m_PT_3 LS21_049_Med_Lip_S34_4m_PT_4 LS21_049_Med_Lip_S35_4m_PT_5 LS21_049_Med_S31_4m_PT_1 LS21_049_Med_S32_4m_PT_2 LS21_049_Med_S33_4m_PT_3 LS21_049_Med_S34_4m_PT_4 LS21_049_Med_S35_4m_PT_5 LS21_049_Lip_Org_S26_4m_PT_1 LS21_049_Lip_Org_S27_4m_PT_2 LS21_049_Lip_Org_S28_4m_PT_3 LS21_049_Lip_Org_S29_4m_PT_4 LS21_049_Lip_Org_S30_4m_PT_5 LS21_049_Org_S26_4m_PT_1 LS21_049_Org_S27_4m_PT_2 LS21_049_Org_S28_4m_PT_3 LS21_049_Org_S29_4m_PT_4 LS21_049_Org_S30_4m_PT_5 LS21_049_Med_Lip_S01_1m_WT_1 LS21_049_Med_Lip_S02_1m_WT_2 LS21_049_Med_Lip_S03_1m_WT_3 LS21_049_Med_Lip_S04_1m_WT_4 LS21_049_Med_Lip_S05_1m_WT_5 LS21_049_Med_S01_1m_WT_1 LS21_049_Med_S02_1m_WT_2 LS21_049_Med_S03_1m_WT_3 LS21_049_Med_S04_1m_WT_4 LS21_049_Med_S05_1m_WT_5 LS21_049_Lip_Org_S01_1m_WT_1 LS21_049_Lip_Org_S02_1m_WT_2 LS21_049_Lip_Org_S03_1m_WT_3 LS21_049_Lip_Org_S04_1m_WT_4 LS21_049_Lip_Org_S05_1m_WT_5 LS21_049_Org_S01_1m_WT_1 LS21_049_Org_S02_1m_WT_2 LS21_049_Org_S03_1m_WT_3 LS21_049_Org_S04_1m_WT_4 LS21_049_Org_S05_1m_WT_5 LS21_049_Med_Lip_S26_4m_WT_1 LS21_049_Med_Lip_S27_4m_WT_2 LS21_049_Med_Lip_S28_4m_WT_3 LS21_049_Med_Lip_S29_4m_WT_4 LS21_049_Med_Lip_S30_4m_WT_5 LS21_049_Med_S26_4m_WT_1 LS21_049_Med_S27_4m_WT_2 LS21_049_Med_S28_4m_WT_3 LS21_049_Med_S29_4m_WT_4 LS21_049_Med_S30_4m_WT_5 LS21_049_Lip_Org_S21_4m_WT_1 LS21_049_Lip_Org_S22_4m_WT_2 LS21_049_Lip_Org_S23_4m_WT_3 LS21_049_Lip_Org_S24_4m_WT_4 LS21_049_Lip_Org_S25_4m_WT_5 LS21_049_Org_S21_4m_WT_1 LS21_049_Org_S22_4m_WT_2 LS21_049_Org_S23_4m_WT_3 LS21_049_Org_S24_4m_WT_4 LS21_049_Org_S25_4m_WT_5 Factors Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 1-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:"NA, blank medium control" | Age:"NA, same batch medium as 4-month-old" | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTCC; PTEN-/-; TP53-/-; CDKN2A-/-; CDKN2B-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PTN; PTEN-/-; TP53-/-; NF1-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:1-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Culture medium Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:PT; PTEN-/-; TP53-/- | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:1-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Culture medium Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid Genotype:WT; wildtype | Age:4-month-old | Extracted Sample:Organoid 1-deoxymethylsphinganine 22500.5900 22681.4300 13272.0400 19555.2700 30933.3200 20301.6100 15382.4000 13784.8400 5844.9900 22160.0100 23576.2600 17089.8000 19575.4600 18165.7800 22988.7200 1084332.0000 1028328.5000 1028900.5000 861673.6900 1145259.6200 7194.1200 34493.3600 17687.8600 13600.6300 33750.1200 507543.9100 400778.1200 113529.2100 99495.1200 144406.9100 30325.5800 19933.9400 15726.7400 23713.4200 26385.8700 734243.2500 950012.4400 813261.0000 1071189.6200 887662.4400 19484.0900 21332.8700 27007.0900 17120.8800 34541.1400 315195.9700 245763.4500 166328.9100 76703.6200 188262.8300 20521.2600 27141.0400 50916.9400 23458.0100 28197.0100 1049122.5000 989653.9400 1040580.7500 1403607.1200 1110533.2500 26529.8600 20086.4500 22453.2600 24839.4300 22758.0100 949985.4400 810120.8100 1052475.6200 808966.4400 1027719.0000 15089.7500 19225.3400 10770.3700 19127.5800 25132.3100 1233638.1200 1290322.0000 1099402.3800 1085163.1200 808210.7500 12230.6400 18582.4300 22818.2200 19028.4000 19750.5500 1041527.0000 1240950.8800 1059467.2500 1065445.1200 879966.1900 4-Hydroxyproline 30322.4600 29878.2100 16119.4800 24893.3100 26026.6000 14279.9600 13496.3300 43071.8400 20336.3700 14884.5100 81575.4600 61195.0200 41538.5200 57526.8200 81400.1500 141581.2000 174177.6400 129305.7800 184749.8100 207274.6900 101039.7400 177160.2300 169169.6600 174152.5500 232479.9500 85140.3400 96598.1500 137600.2300 82383.5500 54722.3400 161450.5900 141531.0500 129567.0000 146652.7500 129774.9800 270816.0900 101719.6600 205970.6900 170245.1100 154728.6700 1364285.5000 969652.0600 1000390.4400 1198579.6200 783712.7500 501136.4700 209666.6700 982713.5000 1909378.8800 784091.0000 104880.7600 144530.1900 99681.7700 95059.7500 80872.8400 256315.5500 159877.1900 61165.8100 241370.5200 191940.3800 261644.8100 82967.3200 127732.3100 108656.5600 169511.8800 60077.4500 83764.3600 42799.2500 155409.1700 64145.8500 92115.7700 87451.3400 72726.4700 81746.5100 41444.6600 139218.6700 151617.7200 97658.9400 267398.3400 258179.9800 451573.2500 297504.8400 300144.5300 184638.8300 189648.4500 128915.7700 184347.3000 171299.0800 118467.8500 248537.8000 5-Oxoproline 99529800.0000 84039032.0000 81155736.0000 90580504.0000 83879384.0000 88213320.0000 87123544.0000 77226600.0000 77044120.0000 74447424.0000 181560304.0000 144618016.0000 171140400.0000 149211024.0000 179467280.0000 164291728.0000 141195200.0000 120069120.0000 140640912.0000 207281424.0000 168976256.0000 182368144.0000 166653440.0000 143208368.0000 153092592.0000 92731032.0000 168410368.0000 148977744.0000 163799504.0000 160255216.0000 172006480.0000 123868008.0000 139856272.0000 141794256.0000 167922560.0000 92297384.0000 106404536.0000 90069480.0000 77340632.0000 66874612.0000 139825808.0000 124674808.0000 136791184.0000 123422048.0000 121438424.0000 84781600.0000 57338288.0000 154533056.0000 293174272.0000 145258720.0000 165667984.0000 171929088.0000 135866192.0000 157074208.0000 132526968.0000 124664008.0000 95555560.0000 76845856.0000 204352064.0000 215402544.0000 161193392.0000 148777872.0000 149817744.0000 135674224.0000 157222480.0000 92633432.0000 183189520.0000 36559788.0000 151706128.0000 154855824.0000 156713280.0000 163558208.0000 132514904.0000 133316288.0000 135571216.0000 92034680.0000 191250368.0000 79858712.0000 119912064.0000 112036056.0000 165254576.0000 178036208.0000 159409648.0000 147770128.0000 178760592.0000 118422408.0000 158679744.0000 172871216.0000 165240192.0000 178056208.0000 Acetylcarnitine 6124.3600 2417.3400 3569.2100 3875109.0000 3117309.0000 2583052.7500 3095789.0000 3649457.0000 10936786.0000 10193131.0000 7268858.0000 8816056.0000 9058695.0000 5932452.5000 5711042.0000 6388782.5000 5419284.0000 5247429.5000 12386291.0000 44180028.0000 33230170.0000 16863144.0000 25253384.0000 4622340.5000 3376562.0000 2907698.0000 3204670.0000 4277662.5000 11321040.0000 9535500.0000 11414579.0000 8193942.5000 9013881.0000 7335894.5000 5203404.5000 5975994.5000 5662243.5000 6360778.5000 15493928.0000 20840504.0000 47740784.0000 26612058.0000 35041204.0000 4641265.5000 4399343.5000 2674417.5000 3119502.2500 2642926.2500 17952818.0000 11988755.0000 7724036.5000 8286967.5000 12134076.0000 6341751.5000 6944398.0000 9410112.0000 4384367.5000 9158323.0000 13125939.0000 51332836.0000 3960141.2500 34893132.0000 20564498.0000 4410643.0000 4517198.5000 2785033.7500 2386551.2500 3144077.2500 6807988.0000 8805211.0000 6352237.5000 9223941.0000 7407998.5000 5015524.5000 7493346.5000 5516794.0000 5051977.5000 5138523.0000 12966360.0000 29368694.0000 38582096.0000 45105900.0000 22840136.0000 Adenine 88152352.0000 109026976.0000 93866560.0000 85781320.0000 65484912.0000 302590368.0000 358120352.0000 461487456.0000 392382496.0000 606451456.0000 36411116.0000 56486156.0000 59117552.0000 197702608.0000 54743564.0000 455005600.0000 29010026.0000 433239840.0000 647046208.0000 38605428.0000 183033408.0000 120004536.0000 86717656.0000 90554176.0000 124043400.0000 276617728.0000 507752736.0000 8938887.0000 464457568.0000 119045432.0000 33372442.0000 93636256.0000 54040384.0000 144867600.0000 97605048.0000 384740864.0000 153690800.0000 250637392.0000 237541680.0000 168230992.0000 Adenosine 5126689.0000 5295188.0000 4162996.2500 4668600.5000 3390276.0000 13224531.0000 12267267.0000 6763015.5000 12769411.0000 5750776.0000 2083052.8800 2691613.0000 2611934.0000 2200518.7500 5355753.5000 6320249.5000 1300220.7500 11519003.0000 14520808.0000 10652848.0000 6492982.0000 2482235.2500 2179768.0000 5313647.0000 4589518.0000 2370511.2500 3220452.2500 106780.7400 3577976.2500 3461382.0000 1013604.0600 944787.7500 1754112.3800 966843.1900 2941541.0000 9971655.0000 4585959.5000 20390364.0000 19499144.0000 11062911.0000 ADP 601108.4400 1026624.9400 798505.8100 1211680.8800 1006449.3100 915227.3100 1848097.0000 2124596.2500 1244653.8800 927260.8100 584943.0000 1184728.1200 642657.6900 801385.7500 896925.3100 1782249.3800 79016.1300 3647738.7500 8116444.5000 1703190.5000 928825.6900 1189373.8800 518383.2800 1558007.8800 1983825.6200 1272567.0000 2145518.7500 27465.3500 2272233.5000 1035178.8100 17677.3400 3146355.7500 385312.5900 836846.1900 803560.1900 2311090.0000 2837383.2500 2489869.7500 1100166.8800 2253865.2500 AMP 937934.1900 1401691.3800 1144394.5000 1320160.3800 2585229.7500 1819695.3800 2639919.5000 4039928.0000 3054001.2500 6046042.0000 767862.7500 1102976.5000 583747.0600 1304331.0000 1063115.1200 3778644.0000 1091484.1200 9300767.0000 19710986.0000 7652236.0000 1809571.3800 1920493.8800 1552645.8800 3101610.0000 4820254.5000 1266687.8800 2692130.5000 180190.0800 2307310.2500 2063143.8800 140418.3100 1165461.3800 298305.4700 632835.3100 574485.8800 5538926.0000 5534042.0000 2652926.5000 2885678.7500 3075656.7500 ATP 314674.3100 614473.1900 449594.4700 1092793.3800 920815.5600 398686.0900 905380.7500 741749.9400 601168.1900 368577.7500 256431.0800 1125813.8800 436650.4100 544034.8100 495775.2200 471725.0900 29887.4100 996711.8100 1593487.6200 611826.4400 266611.4100 513853.2800 167709.5500 1570720.1200 1482541.3800 606510.0000 957033.1900 18179.9000 964891.0600 326990.2800 7927.9100 4154150.2500 343646.7500 970248.7500 1032440.3100 867907.1900 1093677.3800 1138369.8800 682550.9400 1522866.0000 Betaine 77749944.0000 63882316.0000 51264804.0000 36796352.0000 36882604.0000 49456416.0000 42714888.0000 52987860.0000 49009564.0000 46553940.0000 64867120.0000 71810408.0000 59564704.0000 58828524.0000 63758956.0000 93551656.0000 70671080.0000 55972748.0000 61309740.0000 77666312.0000 77731704.0000 80715848.0000 75883552.0000 71520984.0000 70548936.0000 64373632.0000 95160072.0000 98897496.0000 120714200.0000 96707520.0000 71232392.0000 53408544.0000 61035904.0000 52037824.0000 51512716.0000 55487324.0000 51579404.0000 44056604.0000 50293076.0000 37170876.0000 120521048.0000 119579544.0000 97219608.0000 112137048.0000 113415680.0000 106667744.0000 40454172.0000 193097856.0000 261577600.0000 197868496.0000 78769504.0000 83830232.0000 53059868.0000 64779444.0000 50390528.0000 99325848.0000 58865376.0000 44571304.0000 84269880.0000 96469032.0000 128245608.0000 82342328.0000 128227528.0000 136480576.0000 163320976.0000 64124204.0000 166824752.0000 21729100.0000 116180632.0000 170293392.0000 102487072.0000 79398776.0000 69093408.0000 47869212.0000 61280564.0000 43735456.0000 71017000.0000 40483952.0000 66564916.0000 58448416.0000 220847600.0000 231338672.0000 246332368.0000 219134848.0000 178827856.0000 137295840.0000 193829248.0000 242847568.0000 277722144.0000 290416256.0000 Butanoyl-Carnitine 8922.0900 5472793.5000 5087256.0000 7456802.5000 7003584.0000 9312043.0000 14736517.0000 3850762.0000 6245718.0000 6869435.5000 6016394.0000 5786197.5000 8269526.0000 7575075.5000 6892975.5000 7956278.5000 11100139.0000 19965786.0000 29348432.0000 15739805.0000 11267916.0000 4566104.5000 4270488.5000 5769511.5000 5978663.5000 8949889.0000 13589888.0000 4848055.0000 13103607.0000 5046775.5000 3781291.2500 6187032.0000 5431010.0000 6332954.0000 6192249.5000 5084730.5000 11677275.0000 1326487.6200 42022140.0000 22139790.0000 24083098.0000 6231142.0000 5942562.5000 7058750.5000 7500893.5000 7272641.5000 26401392.0000 8732704.0000 3462951.2500 7045544.5000 7704943.5000 5402027.5000 4783805.5000 5376012.5000 4664454.0000 6427054.0000 10231948.0000 21201154.0000 243152.7000 17785780.0000 5533957.5000 4307142.0000 4199499.5000 5836182.0000 5690806.0000 5500916.5000 16905026.0000 15252301.0000 5417742.5000 19494446.0000 7539280.0000 4325042.5000 4512922.0000 3605841.7500 3238567.7500 4339042.0000 5168790.0000 6536532.0000 9837596.0000 11041807.0000 8651626.0000 C18-Deoxysphingosine 10049.8900 4871.8600 7914.6100 14762.5700 9897.2200 13865.5600 208.4200 11700.9000 3505.6300 1743.3800 14824.7300 195.4700 3987.8000 4265.4200 122335.2700 144954.2700 138818.4400 140504.3300 165810.1400 2121.7700 1144.2700 7419.0100 460.2900 2824.6300 1165839.1200 1433535.3800 1294033.3800 2124225.2500 1789438.0000 11646.6200 9509.4000 7599.8000 2129.8400 261928.5600 252556.9500 242224.9200 266043.1200 292577.5000 8241.9100 3900.3700 4333.9900 18681.0600 10398.5200 3035604.7500 4047305.2500 3164692.2500 3541870.7500 2969305.7500 11694.2800 2321.4000 61726.7000 6501.6900 151029.9500 145071.9800 126340.1200 101719.7700 147744.6100 8759.3400 9248.5000 8851.4500 5817.5600 1394.8800 1019352.5000 1113462.2500 890957.8100 1148887.8800 1304517.6200 14828.1700 2921.9800 4891.9700 1462.8500 8543.0400 84668.3800 180310.7300 140302.8900 190966.8900 193573.0800 183734.2000 8541.1900 4015.0400 6081.9500 4108.3800 1795863.0000 1408765.0000 1843356.8800 1762022.6200 1792822.3800 C18-Phytosphingosine 130726.9100 108471.2000 122316.7200 119645.2700 114056.7100 127376.9100 114229.3700 114826.2300 110260.3000 119271.1600 132306.4200 122583.1500 141531.7700 123607.4800 119769.4700 172249.5900 161163.5600 137877.5300 180848.3600 168089.0200 111016.6200 123957.0200 114106.3000 124144.0700 102410.5200 234835.4500 454568.8800 413580.1600 452972.8400 498673.1600 140664.2300 150333.5200 141577.0200 125844.4400 122973.1000 356419.7800 314299.2800 348292.7200 405195.1600 383099.7500 109594.9800 110550.7100 113075.1200 1780392.6200 113978.7000 2053338.6200 9373350.0000 1602707.3800 1038939.6900 1010175.2500 167942.5500 109728.9600 145874.2500 120154.2500 153917.2300 266468.5900 252682.2300 189461.6700 189847.4400 236194.0000 120268.9800 135486.3300 165940.5000 116698.5700 111054.2600 379456.3800 392664.8400 401987.7500 419459.5300 384670.6600 139342.6100 123552.8400 153032.3300 121478.9000 128882.0400 214429.9500 266777.8400 203470.6400 326124.7200 338983.5300 575489.0600 119735.6900 111880.6900 111532.2300 110616.1200 693981.1900 450945.7200 560058.0000 449677.5000 562007.4400 C18-Sphinganine 60867.9400 46681.8100 50787.9600 59901.8000 32984.3900 55654.2700 44809.6400 58677.3600 46406.4500 35162.2900 67638.6800 57254.8900 56803.7300 57565.6600 71356.3400 517646.5000 575530.3100 391129.7500 645319.5600 816466.9400 60196.6100 75556.1000 60918.5900 59100.9300 91488.1600 2736231.5000 3196531.7500 3501249.2500 5536130.5000 4977593.5000 61231.8700 69525.6800 65323.8600 53188.9100 60835.4800 990466.0000 1019491.0000 1068018.3800 1245428.8800 1354395.1200 74919.1900 52750.0000 51284.2700 205056.8300 66382.4300 3828653.2500 11472407.0000 4038115.2500 4607868.5000 4248648.5000 63974.6400 58951.4500 112789.3700 53293.7200 64696.7100 1331493.3800 989479.2500 628024.8100 741647.2500 1059856.0000 64463.5300 50561.3200 121280.2400 45738.5400 52086.2500 3624384.7500 2919284.0000 3125212.0000 6257404.0000 3729273.2500 63689.9100 64232.8100 91867.9600 35607.2600 80882.9200 557039.6900 996885.5600 906692.5000 1277113.8800 1337529.8800 1829566.6200 44420.0200 58448.6100 52232.8000 39824.5400 2912114.0000 2796649.2500 3520871.0000 2595222.2500 3680559.7500 C18-Sphingosine 114835.9600 69195.9700 97012.0600 78491.7600 71912.7900 89549.6900 73305.9900 89312.3400 80240.4300 79795.0700 114878.1200 91283.4100 91565.4300 115155.5600 139469.2700 692765.3100 799683.2500 678976.8100 947751.9400 1059755.3800 84505.4800 135193.7700 95457.7500 128297.3100 107262.6600 2472013.2500 3438345.2500 4122155.0000 7281083.5000 5200792.5000 126051.3800 115100.3800 97969.8800 100903.1000 99179.5000 2018114.5000 1636821.5000 2096121.5000 2366780.0000 2245077.7500 101099.9600 95358.7700 82937.7100 419062.5300 93459.1500 4570750.5000 11074237.0000 5208275.0000 6461641.5000 5911776.5000 114437.5900 84352.6600 183087.8600 97640.4700 93375.2300 1859347.6200 1429980.0000 1122154.8800 1298684.1200 1430393.5000 99805.9600 104873.7900 112657.5400 78139.1900 68358.1600 4197119.5000 3456683.0000 3430409.7500 6476920.0000 4369592.0000 100762.4100 101569.1900 105654.7600 81953.5800 116830.2400 811166.2500 1446702.5000 1165980.6200 2229117.2500 1944822.6200 1294502.8800 93303.7700 84195.6900 89462.9100 101746.8100 1381411.8800 1775721.8800 1617098.5000 1524832.6200 1793886.5000 CDP-choline 8459112.0000 8350018.5000 5554171.0000 10774332.0000 20358224.0000 18239336.0000 30586648.0000 26682386.0000 34013092.0000 22465714.0000 2952308.7500 4348793.5000 3280187.0000 3226148.0000 3824318.7500 6294302.0000 1843690.3800 20575422.0000 52075364.0000 12277251.0000 8963616.0000 5727789.5000 4546832.5000 12095957.0000 15154635.0000 10074362.0000 13892888.0000 678987.9400 13524837.0000 29252066.0000 448923.2800 3183902.7500 812622.3100 1879861.3800 1610905.3800 1506107.8800 1557865.1200 2453522.7500 2532342.7500 2441023.2500 Cer(d18:1/16:0) 48149.3600 13646.3300 16687.3800 16633.6500 172171.8000 343539.0300 164757.8900 586892.0000 201725.3800 11956992.0000 12755571.0000 11543719.0000 11659025.0000 12880556.0000 1042108.5000 582638.0600 1105070.1200 1980988.1200 794334.0600 18357654.0000 20178488.0000 21693466.0000 25338266.0000 20640528.0000 596193.6900 538524.0600 362094.4100 284477.0300 341031.5000 15087147.0000 13116459.0000 14190024.0000 16269717.0000 14566731.0000 2156291.2500 1738925.0000 1391865.6200 2063611.0000 1257414.6200 30665198.0000 37847348.0000 31731430.0000 33500154.0000 29810706.0000 706262.6900 311587.9100 1383640.0000 472350.7200 345742.2800 11771939.0000 10236589.0000 9614936.0000 9849456.0000 10630345.0000 707778.0000 691383.9400 820390.5600 1162151.1200 521091.3800 20893782.0000 24283578.0000 22857032.0000 19557502.0000 22986320.0000 156901.3300 168424.8300 85840.3700 57044.4300 108648.5400 6827400.0000 9389879.0000 8544712.0000 13010036.0000 12225657.0000 2083429.0000 144981.3900 242135.7500 125379.0400 168743.3600 19299058.0000 22298862.0000 24530614.0000 19742366.0000 22578618.0000 Cer(d18:1/18:0) 34285.7200 43150.5800 18468.0700 20925.5200 29919.5500 29496.8300 19463.5000 24082.2600 28253.1300 99800.4100 47802.8300 215203.7500 49889.0200 14232268.0000 13978413.0000 11673733.0000 13770241.0000 16222063.0000 1497921.5000 630399.0000 1174998.8800 1599823.3800 617545.4400 94325912.0000 125927912.0000 129522208.0000 149755424.0000 156233840.0000 116027.3100 104426.3700 39899.0500 41360.9000 71646.1800 16162688.0000 14438924.0000 15087013.0000 18128494.0000 19141130.0000 917578.7500 780832.5000 647860.6900 992229.8100 589510.1900 89400800.0000 123373440.0000 105954560.0000 121273640.0000 123793856.0000 201361.6200 88531.8400 437781.0300 163679.2700 36972.3700 16436004.0000 13948739.0000 10718040.0000 11886807.0000 15524557.0000 785805.3100 803252.6900 817047.6900 1238498.0000 549305.9400 122468608.0000 142436000.0000 123636392.0000 127554216.0000 138787072.0000 43278.9100 52563.8400 22615.8800 29286.3300 28019.0300 4712540.5000 10887640.0000 7511728.0000 11490784.0000 11393219.0000 1253598.6200 88596.1900 217240.3000 137031.5800 217388.1200 58112720.0000 95934584.0000 88376976.0000 79242040.0000 69592440.0000 Cer(d18:1/18:1) 13024.4000 12439.6000 442182.1600 725310.7500 268405.3800 814235.9400 531810.0600 110071.0100 84178.7500 116221.4000 22213.0500 3183996.7500 3004204.2500 2903166.2500 3961102.0000 4005958.0000 504102.2500 414966.6200 362854.8800 186129.5000 482507.0900 54973.7900 108234.9800 63852.1800 115584.1500 42195.7800 2744011.5000 3659700.0000 2747504.7500 3129194.7500 4045046.2500 42932.7100 621173.6900 398030.0900 478935.8800 352747.3800 598748.0600 31403.9900 46651.1500 108046.5600 2768405.2500 2924114.0000 2549705.7500 2586427.0000 3380474.2500 58956.4400 232672.4800 182722.6700 350409.8400 255130.7000 734826.0600 13516.6400 2603457.2500 5073823.5000 4676621.0000 3929347.2500 2951214.7500 Cer(d18:1/20:0) 16732.8500 28926.1000 4804107.5000 4843320.0000 3925550.7500 4976623.5000 6009086.0000 86044.3400 74604.0100 161351.8600 242425.9400 79835.2600 21243576.0000 31143466.0000 31703818.0000 37777708.0000 33577852.0000 16017.0400 12395.0200 4347139.0000 2977641.2500 3645560.7500 5208317.5000 4502522.0000 80542.5900 25363.8200 56884.3800 232950.0200 55700.1700 20603592.0000 29316270.0000 24260902.0000 29187984.0000 26401582.0000 7238.2900 48882.7100 116646.9100 22138.2600 6822487.5000 6255813.5000 4146905.0000 4293522.5000 6396693.5000 93902.9100 67290.1500 76484.8400 115001.8700 73852.8200 31274642.0000 32055590.0000 28022022.0000 33214448.0000 28092296.0000 1048138.7500 2319828.5000 1399858.3800 2923093.2500 2827451.0000 611629.0600 12172.2900 7726103.5000 10129827.0000 11057729.0000 8838537.0000 10072453.0000 Cer(d18:1/20:3) 42929.1800 24951.5900 4881.0300 155.6800 92310.9600 158453.0200 94508.1800 337536.6600 136860.7000 8040388.0000 7956637.5000 7496655.5000 8446681.0000 7732886.0000 2559740.7500 840948.8100 2265290.0000 2894126.0000 1112075.0000 27399938.0000 32943774.0000 32066558.0000 39522108.0000 39560048.0000 131435.8000 185768.2500 112045.8800 130432.7600 128607.3800 6347601.5000 6099364.5000 7552810.0000 7539141.5000 8257657.5000 1618350.8800 1410890.5000 1155115.7500 1807329.1200 1228967.0000 26578992.0000 31488842.0000 26399622.0000 27102720.0000 39757504.0000 303711.4700 196370.3800 522075.0900 283479.6900 207012.6900 6658064.5000 6334546.5000 6838449.5000 6173058.0000 7287610.5000 1490211.8800 1316423.1200 1357060.8800 2362771.2500 1100289.1200 31700498.0000 35313424.0000 30432506.0000 30261288.0000 38932024.0000 58200.3500 94476.0400 45281.3300 47551.1700 66810.0100 4141963.7500 5347035.5000 4944964.5000 5748645.5000 5124610.0000 2219321.5000 226012.0200 376633.3400 252519.2300 518161.9100 18997918.0000 29391274.0000 24924234.0000 22359350.0000 20209782.0000 Cer(d18:1/20:4) 11380.8600 119305.3700 89329.1200 117291.9400 158831.1600 187636.6700 56612.6400 187344.8800 188678.3100 105416.7100 560978.8100 401939.2200 369202.7200 578157.8100 378380.9700 67137.5200 202180.2300 221758.8600 127872.1000 166131.5000 154780.8800 226363.1200 403457.1600 320864.4100 411783.7800 264409.9700 45742.1800 61920.8800 189962.5000 99259.9400 64962.0100 71617.7200 95000.7800 164243.3000 80149.5300 193876.0200 573082.6200 245530.9500 336289.0000 75110.9700 116417.8800 86810.2400 42307.1800 50443.9400 770842.0000 15698.9000 18805.4600 20009.1000 406438.2200 1115126.2500 1004950.4400 941042.4400 602060.3800 Cer(d18:1/22:0) 23471.9900 2472638.7500 2755536.0000 2181560.2500 3388331.0000 4052393.7500 66070.5400 135445.7500 169772.4400 253118.5500 117114.8400 22524386.0000 28035706.0000 31072986.0000 32660184.0000 31200352.0000 21827.7400 5594062.5000 3405829.7500 4212895.5000 5378091.5000 5195192.0000 155972.1100 158688.8900 102240.6500 258308.8000 134401.0000 30030064.0000 44461680.0000 37301796.0000 44745164.0000 37576912.0000 33092.3200 374842.4100 17752.4500 4370441.5000 4029369.2500 2151511.7500 3576070.7500 4796948.5000 105183.8100 44169.9100 114283.6600 158731.3600 20800.5300 31913050.0000 31960370.0000 26731258.0000 31541018.0000 28129760.0000 644109.0600 1941235.3800 1255873.3800 2493293.0000 2579954.0000 737097.4400 15988.0600 21173.3400 9654838.0000 8632176.0000 10884129.0000 8573876.0000 10530416.0000 Cer(d18:1/22:1) 51004.9000 3485986.2500 3287563.2500 3302286.7500 3686291.7500 4429732.5000 15942.6600 18683.9000 49804.5300 41421.2700 14066.1200 8517520.0000 10006808.0000 11098125.0000 13567829.0000 12999975.0000 4786369.5000 3662499.2500 3985502.0000 5835997.5000 5538966.5000 24286.9100 42487.2100 17847.3400 63246.9200 11616299.0000 16179280.0000 15559879.0000 20212234.0000 14530381.0000 54645.2100 4693156.0000 4825274.0000 3042357.0000 2312836.7500 4244192.5000 15746.3000 32837.3200 12353867.0000 15334451.0000 12509597.0000 13528295.0000 14139351.0000 633060.5000 1691545.6200 1234830.3800 2094814.6200 2300844.7500 677492.0600 2982707.2500 3774639.2500 4578238.5000 3121339.0000 3247609.0000 Cer(d18:1/24:0) 62526.0600 18412.1200 14623.4900 1382090.7500 1557833.0000 1325622.3800 1463049.8800 1796987.5000 16509.9500 43894.6900 6379255.5000 7152734.5000 11237448.0000 11495853.0000 9303512.0000 15508.2300 2784206.2500 2677918.2500 3538939.0000 3833961.7500 3659859.2500 53092.3000 44023.3000 70934.3700 81227.5100 21156.6200 35191160.0000 78241168.0000 56054908.0000 64100128.0000 47420300.0000 17709.2100 4971.5000 3181513.2500 2474003.0000 1447610.3800 1944306.3800 3403265.2500 36694.9800 15436.1100 25353728.0000 22421184.0000 20533222.0000 26982434.0000 13516696.0000 501993.3400 1413639.3800 859360.8100 2321352.7500 2460609.0000 285967.5300 5829004.0000 4277608.5000 9567303.0000 5714668.0000 8161210.5000 Cer(d18:1/24:0)_1 34858.1500 13441.8200 16238.7700 17228.7400 30798.9900 14818.1500 1692766.6200 1600882.3800 1435039.6200 1892417.3800 2187515.7500 114199.3800 105838.1200 162554.9500 318810.7800 147988.6700 19976794.0000 25715258.0000 26707278.0000 28498256.0000 30318786.0000 41946.4400 42792.4000 14814.1200 4691993.5000 3203030.0000 3700806.0000 4099281.0000 3851887.2500 243591.4500 299719.4700 261428.0000 359573.9100 181557.3900 52038428.0000 80195832.0000 60957324.0000 76579144.0000 61749676.0000 20612.6200 327943.4700 14523.4900 23759.5200 2436114.2500 2562167.7500 1237409.5000 2121471.7500 2766541.7500 80583.2000 49675.6400 106724.8200 86619.9500 63102.2000 27864134.0000 27045600.0000 21064290.0000 28428072.0000 20386498.0000 20073.4400 400229.2500 1330981.3800 704751.5000 2021707.1200 1618205.6200 1046659.9400 27607.9300 39598.7900 15567.0400 14998.8900 10594946.0000 9629230.0000 9664979.0000 7757721.5000 8741289.0000 Cer(d18:1/24:1) 49293.1400 38972.3900 67205.8700 45369.7200 23747.6700 73450.4100 33971.0500 79530.8000 137844.8400 33073.6200 148003.8900 75344.6200 16661251.0000 16752021.0000 14709616.0000 19505680.0000 22141436.0000 420040.6600 215560.2000 442200.5300 600473.4400 290581.5900 63234636.0000 82662200.0000 90376536.0000 104722280.0000 101652616.0000 168434.5800 169815.8100 121012.6200 89669.4500 108895.1600 36161920.0000 25726518.0000 30809552.0000 38235348.0000 35797428.0000 801262.2500 793838.9400 658331.0000 825514.6900 446678.5000 141069952.0000 190625072.0000 176306960.0000 225873920.0000 167381136.0000 285824.5600 119332.7200 550839.8100 134175.9500 118929.4800 28654406.0000 27190758.0000 16382600.0000 20831734.0000 28629770.0000 381657.3800 266998.5600 319906.3800 481796.7200 253588.8600 115622472.0000 128852672.0000 112432728.0000 122968360.0000 109360520.0000 31225.9400 39596.5700 73633.4100 21114.6300 17417.8100 3926244.7500 11587371.0000 6579701.5000 17062646.0000 15982343.0000 1432226.3800 39622.3300 28034.8800 34532.3900 47099.5700 34221088.0000 31522818.0000 43936436.0000 34143332.0000 34942176.0000 Cer(d18:1/26:0) 122987.8800 66451.8500 130240.7900 129853.9100 120359.4800 12068.5200 52581.6200 50453.0200 50992.0500 61750.4500 49343.5100 21334.8700 731574.0600 2126182.7500 1450763.1200 1390216.5000 1059567.3800 27462.2700 23762.4400 65372.7200 395243.0900 248884.7300 295052.1600 367281.3400 251987.2300 18741.3500 49750.2900 217319.2500 44885.9100 44604.7000 56493.3000 56275.4200 89613.6000 Cer(d18:1/26:0)_1 14025.5900 18335.6700 18697.0100 14376.7700 40597.5900 217559.6700 223736.3000 218774.7500 332741.2800 349878.0000 14510.1600 33225.7800 24946.0500 63663.3200 59787.9400 97128.5400 16387.7000 700117.3100 1385257.3800 1048736.3800 1130173.3800 876938.1900 28309.6000 29810.8000 22502.0900 229625.4800 204811.3300 171594.3000 249472.3800 172617.6700 13621.1300 27294.8700 460459.0000 179904.9200 197998.2000 63613.2100 167545.9500 121813.6600 Cer(d18:1/26:1) 17321.2300 13782.1200 76017.2100 35212.7800 16702.1000 74977.2600 26963.1700 16531.3800 38491.6600 40558.0300 127648.0900 195174.1200 223410.8600 123908.5900 227539.8300 271607.3100 44298.3400 217852.6700 90915.3200 71030.8800 41175.2100 1104856.6200 1203332.6200 1254299.5000 1607922.1200 1723525.0000 19042.6900 28292.1800 15499.9300 32805.2500 26256.5200 654495.2500 391306.7200 460875.2500 486004.1600 401684.2500 17766.0900 14406.3000 25057.0500 532488.8100 79356.3100 4325750.5000 6062977.5000 5598261.5000 8078272.0000 5330394.0000 90931.6200 57484.0800 132398.1900 42645.4600 78710.6600 420035.4100 325110.5600 205665.7000 248211.8300 381751.9100 12807.3900 56796.9000 63634.1700 21937.2000 1938823.5000 2092901.8800 1644649.6200 1690202.3800 1550079.3800 27484.3700 21119.9500 99122.9000 18245.2600 16176.5800 27785.6100 175204.6400 138964.7800 304330.0900 185225.5600 716946.6900 35343.1700 20037.9700 518611.7500 630473.0000 720175.2500 680954.5000 511042.5900 Cholesterol[-H2O] 125430.1600 24388.4000 17251.0600 53408.2500 14926.1400 5184043.5000 5344788.0000 5264090.0000 5928775.5000 6264858.5000 216768.1700 137952.3800 220699.9500 249795.2000 171779.6400 26669418.0000 31305266.0000 32535354.0000 36804320.0000 35339172.0000 19564.7200 53307.5400 18708.1700 13756.8200 8731277.0000 7153270.5000 8455879.0000 10316092.0000 9092853.0000 278092.0900 273247.7200 230828.3000 507866.6600 326406.8800 31098416.0000 48550548.0000 38446752.0000 57404480.0000 43213468.0000 36715.5100 26137.4300 170091.5500 32405.1600 8730829.0000 8098769.5000 4279470.5000 4218839.5000 7471365.5000 172647.9800 138137.6400 204768.9200 204147.1100 92130.7100 45990956.0000 46545408.0000 37534976.0000 42544572.0000 34311648.0000 16252.3000 12558.6400 13536.2400 19592.9700 1670948.3800 5084339.0000 3609658.0000 7158607.5000 7260780.0000 419270.6600 83667.1800 69926.4500 84031.0000 42073.2300 21421164.0000 23524768.0000 28968784.0000 22331016.0000 17937724.0000 Choline 181448464.0000 134517424.0000 137696576.0000 149749296.0000 134273216.0000 161180992.0000 187780992.0000 151448032.0000 148972528.0000 149811312.0000 221969552.0000 177589728.0000 205455376.0000 190507776.0000 225403856.0000 244520976.0000 210379440.0000 181582896.0000 225245424.0000 224019520.0000 108859968.0000 137327472.0000 110150680.0000 123257768.0000 114168800.0000 206656512.0000 280145664.0000 306590304.0000 317151424.0000 350357888.0000 205625136.0000 162925968.0000 181375872.0000 179915200.0000 214955984.0000 145199904.0000 142507888.0000 146326704.0000 155577328.0000 124779768.0000 83764024.0000 74103096.0000 85839832.0000 84427512.0000 75983584.0000 171752048.0000 17736110.0000 208726000.0000 283499808.0000 205553664.0000 188430384.0000 166169904.0000 160646352.0000 178177488.0000 154719792.0000 229791360.0000 171987536.0000 130469944.0000 198294288.0000 157745200.0000 13201701.0000 6442674.0000 10987383.0000 43307956.0000 47379540.0000 133584736.0000 206180992.0000 1575106.6200 207676864.0000 167421952.0000 183363968.0000 185827968.0000 173751392.0000 151454784.0000 147162976.0000 88384576.0000 172259280.0000 112376008.0000 179624832.0000 173260224.0000 89301144.0000 81975096.0000 75903584.0000 82148016.0000 134089216.0000 169560752.0000 202262784.0000 239183568.0000 206328144.0000 230017664.0000 Citrulline 18671.2600 23502.6400 36604.8500 9604.0300 12794.7900 3173.5000 11943.9500 28639.7600 26097.9900 18227.4400 245483.8900 133687.4400 187022.5800 195124.6700 203832.9500 273545.6200 214518.9500 201249.8100 190442.6700 224168.4400 211846.7700 241897.1700 252377.6400 494663.9100 268168.2200 344944.7800 413679.0000 583253.5000 755443.0000 499659.1600 104492.9600 118388.2400 153346.6200 119185.4300 177375.1900 171596.9800 211269.1700 193637.0000 157576.3900 228595.5800 1258436.6200 702639.8100 793058.5600 883719.0000 448270.8400 457062.2200 376919.3400 1018274.3100 1154545.7500 796383.5000 317266.0300 303606.2200 240559.8800 242692.6200 233617.1700 370816.2500 240847.9500 162436.6400 323726.7200 366982.1600 448795.5000 486963.8800 401248.8400 386715.1200 395801.5900 412607.5900 754983.4400 139472.4500 814770.5000 585680.7500 67116.3500 31498.3800 68958.8000 88596.0300 62311.8400 142348.4500 129861.2200 100546.0900 136073.0300 108815.5200 210062.5800 194347.1900 156903.9200 162639.3100 163050.0000 217363.2300 285713.4100 314033.5300 294969.0900 290506.6600 CMP 1651634.0000 1695783.6200 1039123.0000 1653028.0000 3499679.7500 2720476.7500 4882758.5000 5491591.0000 5249286.5000 5502578.5000 1001965.6900 1210545.6200 1174199.6200 1148599.6200 1050575.3800 2551581.7500 861117.0000 7204795.5000 16140835.0000 3461753.2500 2346877.7500 1358829.1200 1045387.1900 2604726.7500 3099810.7500 3414468.0000 6176496.0000 252323.7700 5813146.5000 5005103.5000 215801.7300 2082457.6200 496801.3400 846810.6900 964348.3100 1107495.0000 1496905.3800 1681949.3800 1221370.6200 1459592.8800 CoenzymeQ10-NH4+ 15239.6400 516230.1600 573344.0600 693969.2500 555133.5600 647601.7500 15673.8100 3759569.7500 6074442.0000 6067120.5000 6674869.5000 6085814.5000 1225174.5000 851681.6900 778657.3100 1139387.3800 1303527.3800 173666.4400 5638450.5000 9295737.0000 7505481.5000 9679327.0000 8077716.0000 820232.7500 864781.2500 520349.5000 538068.8800 661021.5000 6081034.5000 5548445.5000 5637618.0000 6316664.5000 4457116.0000 206632.8800 356495.7500 345599.2800 578408.0600 575742.3100 1751184.3800 1958751.0000 3187989.2500 2384816.7500 2157947.2500 Creatine 977532.1900 669610.4400 527223.1900 350864.1600 323443.2800 447098.3800 256034.6100 371199.2200 464653.8400 335657.3400 4745832.0000 4119561.7500 3667081.2500 3857035.2500 3804962.7500 285243008.0000 197891392.0000 201490896.0000 224157440.0000 246463408.0000 51796832.0000 41038944.0000 45266052.0000 39017380.0000 23568066.0000 467821952.0000 816427968.0000 776606784.0000 878710208.0000 819144960.0000 4249546.5000 3449307.2500 3473475.2500 3102550.0000 4116428.2500 195276208.0000 187469824.0000 189434128.0000 187990576.0000 188030064.0000 47499652.0000 44238312.0000 44496844.0000 45068068.0000 49056948.0000 683511296.0000 618551232.0000 1102219904.0000 1409030016.0000 1057028672.0000 3769348.7500 4262366.5000 3331152.2500 3038495.7500 3069565.2500 312418144.0000 232797328.0000 233452288.0000 188766416.0000 216236800.0000 52060756.0000 38107612.0000 51739040.0000 72513896.0000 64641124.0000 584580864.0000 1119659648.0000 413880064.0000 982762304.0000 945979712.0000 4018093.2500 2997784.2500 3478481.0000 3377730.0000 1809369.0000 253948416.0000 241390848.0000 188123440.0000 172484240.0000 176979440.0000 68481232.0000 82402208.0000 77866600.0000 73020120.0000 53635328.0000 465164960.0000 754758464.0000 747276864.0000 692846912.0000 731986240.0000 Creatinine 24442.6900 145053.6100 63561.4700 73080.5500 66662.3700 164593.1900 119827.2300 118798.3400 98765.6200 77298.5700 511764.9100 313593.5900 468472.4700 555019.5600 605303.3100 4502818.5000 5091940.5000 4168802.2500 8270749.5000 8493787.0000 8919893.0000 8039328.0000 10375123.0000 7464472.0000 7936366.5000 151966784.0000 203325184.0000 290638880.0000 300870976.0000 683068224.0000 414991.6600 361953.6600 597309.5000 456207.8400 534073.3800 10264743.0000 3712582.0000 5996205.5000 13841856.0000 3692923.2500 20153550.0000 17582530.0000 15580461.0000 14915020.0000 14779963.0000 267875312.0000 64905088.0000 327624352.0000 436669472.0000 168271344.0000 459452.8400 561359.4400 494543.8400 580828.7500 464201.3800 7654013.5000 5924118.5000 3862900.2500 4995438.0000 8818604.0000 21534522.0000 17903694.0000 17710022.0000 16758113.0000 18931246.0000 272137568.0000 474209280.0000 13448152.0000 436511584.0000 198179968.0000 117591.5100 349994.4100 1639777.6200 307831.6200 286876.8400 3396839.7500 13633651.0000 6107773.5000 13351273.0000 15301749.0000 5521790.5000 5136511.5000 4075215.2500 3468818.0000 3464529.2500 128169096.0000 233106032.0000 197752400.0000 194795440.0000 165696432.0000 Cytidine 15245.9500 2869.0500 4520.9200 3933.0400 303731.1200 255916.5000 360382.2200 333990.1900 370670.8800 488344.6600 431982.4100 319322.9700 452527.5000 859302.8100 1306696.0000 1111605.5000 1196075.1200 869429.0000 645813.5000 1245941.8800 1730435.0000 1456781.0000 3004368.2500 2090268.0000 394749.6200 383993.0900 407376.0000 404357.5000 473679.1600 205319.6200 406238.0300 439740.1200 450784.5900 374045.2800 595055.4400 621535.8100 364382.8800 490836.2500 409672.1600 360551.7500 103225.5900 1061352.8800 2517667.2500 848633.0000 212665.4500 187247.9800 186952.5600 188927.6700 144855.1700 279494.2800 253006.1200 140590.1400 543744.8800 924086.8100 697228.9400 456395.5000 481630.5300 1317784.1200 1053162.5000 680006.4400 1106826.5000 880612.0600 1479210.5000 163665.6100 209098.0800 276648.9100 177052.8100 180378.4200 65455.8600 520899.3400 89080.5100 178028.3800 210032.9500 698011.3100 711807.8100 574220.3100 476278.0900 399311.1200 544883.3100 221924.8300 896746.5000 741419.1900 793972.7500 Cytosine 45284.4100 55057.7800 37741.0500 81964.1200 45697.5100 60003.3600 44776.7100 90711.1600 67615.1200 92575.1500 566993.0600 598476.5600 685462.5000 877730.8100 786575.6900 1322836.8800 1305635.8800 1365192.6200 1355956.0000 1368914.3800 837743.2500 876930.0000 1273038.6200 1287390.5000 1415239.5000 2516444.5000 2427174.7500 2236499.2500 2466241.2500 2034897.0000 961449.3100 871466.0000 1012405.2500 1199176.5000 1154171.8800 1951199.0000 2029191.3800 1900764.6200 1510803.6200 1447829.8800 456839.4100 481112.0300 576916.4400 710903.5000 828054.8100 1221685.0000 1220668.8800 971192.3100 845953.5600 732747.6900 Cytosine_1 58582.6700 56811.0500 40283.1000 40995.5300 36258.6200 42190.2000 24083.3700 48461.3900 21295.7000 33412.0200 517411.8400 596375.0600 1054483.6200 1019325.3100 1314221.1200 4288799.5000 3273511.2500 3796879.2500 2996095.7500 2252956.2500 649529.5600 895401.6900 1312484.6200 1221476.5000 1604244.6200 1833092.3800 1926757.3800 1216514.1200 1574730.6200 1529666.0000 353052.7200 393820.5300 538896.3100 532461.4400 515437.5000 2343754.7500 1631625.3800 1530425.3800 4574439.5000 3784278.7500 320114.5300 323795.8800 840407.7500 544567.8100 571172.6900 2327199.7500 2194523.2500 1844117.8800 1601804.3800 1502681.8800 Deoxy-Cer (m18:1/18:0) 65311.4200 44661.8000 337055.9700 383789.2800 310525.6200 434612.0300 501657.3400 23141.1300 8193.1400 32712.1200 6768678.5000 7611917.5000 8315565.5000 9520263.0000 9556479.0000 469786.3400 378094.4100 529413.2500 371171.5000 619564.5600 28012.9800 18191.6200 24256.3800 22515.9900 8878779.0000 12248041.0000 13266315.0000 11292236.0000 12728232.0000 294403.4700 563021.0000 325890.3400 264639.6200 601789.8800 17881.2500 6422213.5000 6795000.0000 8170789.5000 5274304.0000 9305337.0000 102803.8500 359666.0900 204688.7700 291717.0300 313593.2500 25802.5900 26043.8900 10328681.0000 10596672.0000 15294984.0000 13043588.0000 10746874.0000 Deoxy-Cer (m18:1/18:1) 24200.5600 17143.1100 19844.1400 35913.3800 124303.8800 20671.5300 17458244.0000 15844141.0000 14749215.0000 17475862.0000 18228838.0000 1012638.8100 440635.3400 864197.8100 1221013.8800 513238.2800 112194504.0000 150676224.0000 145975760.0000 167057456.0000 174996640.0000 67141.2900 91014.9100 19649.1100 16990.3100 18831816.0000 15190373.0000 19280506.0000 21066584.0000 22345902.0000 612411.5000 632835.0000 471152.6200 664067.9400 463264.0900 107003704.0000 143128208.0000 126750744.0000 142893168.0000 147144112.0000 132034.6100 68536.3100 295089.1600 47547.3800 91010.2000 19707798.0000 17387242.0000 13248520.0000 12888437.0000 17525784.0000 584052.6900 452607.0000 603795.7500 934161.0000 407429.0000 139242336.0000 168426288.0000 142308224.0000 149814384.0000 160848880.0000 45418.7500 31486.3400 5473413.0000 10979256.0000 8811485.0000 13309477.0000 13966961.0000 812583.9400 122677.1000 54438.4100 83826.4800 102228.4400 66912476.0000 113484056.0000 99810912.0000 90019832.0000 78908592.0000 Deoxy-Cer (m18:1/20:0) 467522.2800 338324.4700 458120.9700 486388.1200 482558.2500 5059461.5000 7152444.0000 7302065.5000 7807888.5000 6695322.0000 431696.5900 565860.5000 505915.5000 541260.6200 659600.0600 27150.4900 31762.8300 13573.7800 17939.1800 33235.4400 9243748.0000 14721480.0000 12635640.0000 14084749.0000 11837913.0000 498285.5900 612301.3100 297026.0300 337341.0300 447701.3400 5949772.0000 7311603.5000 6397332.0000 5782984.5000 5962622.5000 178557.4500 70455.2400 433346.2500 386660.8800 54591.4400 5544126.0000 5884666.5000 7543203.5000 6340472.0000 5903785.5000 Deoxy-Cer (m18:1/22:0) 127540.9100 205988.0200 134296.0800 253819.5500 253038.0000 3004186.7500 3930846.7500 4446674.5000 4209711.5000 3965139.2500 443995.2800 276141.7800 350316.6600 430886.9100 451147.0300 51150.5500 30649.7800 20795.0000 52088.6100 10563954.0000 12855261.0000 12933855.0000 13817001.0000 10533132.0000 275800.2800 400115.7800 91856.7700 222134.8300 303075.1600 4407733.5000 4493973.5000 4015738.0000 3267041.2500 3353681.0000 17381.1800 86627.1300 73222.6300 193746.1200 191614.7700 19487.0300 3245510.0000 2998018.2500 3480155.2500 3036068.0000 3277338.2500 Deoxy-Cer (m18:1/22:1) 24661.4800 2161300.0000 2229597.0000 2133648.2500 2677136.7500 3333382.2500 73538.8000 30420.9700 68700.2600 189474.9500 32195.3600 19903974.0000 24834090.0000 28821536.0000 28960512.0000 27320064.0000 26175.2300 4998239.5000 3111191.7500 3874534.7500 4273853.0000 4157491.0000 99362.6200 105822.7900 78693.0300 149893.7500 78127.8400 26766854.0000 39651244.0000 35029348.0000 41772940.0000 33535424.0000 64120.8000 4165812.7500 3546272.2500 2111628.0000 3256877.2500 4106415.0000 24952.3200 19770.0700 65883.0900 40730.5300 28246426.0000 27062546.0000 24029422.0000 28666302.0000 23795066.0000 603343.5600 1533529.6200 843635.5600 2253883.0000 1690954.1200 412882.4100 7862370.5000 6908009.5000 8837508.0000 7414437.5000 9128573.0000 Deoxy-Cer (m18:1/24:0) 14834.1900 354395.0900 423853.5300 337146.1600 511046.5900 559705.7500 44144.8200 17527.5600 2026662.5000 2520179.7500 3371572.0000 3043788.0000 2623945.0000 1473259.6200 1186186.1200 1266185.6200 1541365.0000 1604046.6200 80438.3300 47392.4800 60653.0800 48189.2600 41283.1500 11608543.0000 16289199.0000 14985219.0000 17939082.0000 11733985.0000 19214.0200 884779.1900 902386.8100 446345.0000 422713.9100 761458.9400 6429.1700 3169351.0000 3460792.2500 2927769.7500 2886440.7500 2194957.2500 69283.2000 225755.5000 115970.9000 538838.3800 517807.2800 26732.0800 2477180.7500 1935159.8800 2541987.7500 1858580.8800 2049582.1200 Deoxy-Cer (m18:1/24:1) 764336.5600 680355.9400 817333.2500 743513.8100 893514.5000 3932061.7500 5104013.5000 4723872.0000 4902280.0000 4874583.5000 1744290.5000 1378205.8800 1518110.5000 1667152.0000 1424592.1200 50853.6500 45670.0200 25427.7900 63050.0200 28738.2700 19195872.0000 21113006.0000 24680838.0000 28224150.0000 18825698.0000 1344340.3800 1280900.1200 720451.1900 903589.8100 1292630.1200 6111016.5000 7383237.5000 5634665.5000 5294024.0000 4887058.0000 155553.8600 445220.8800 258599.1200 921765.1900 653241.5000 13979.2200 4639166.5000 3545587.2500 4572086.5000 4299730.0000 4255061.5000 Deoxy-Cer (m18:1/26:1) 61286.5400 113308.8500 68724.1200 132526.0200 114980.4900 13961.6300 18945.6600 8400.8300 925584.3100 1325485.8800 1026404.5600 1450995.3800 882676.3100 119493.1900 133771.1900 107479.1800 101395.8800 122963.5600 120843.8100 71026.7700 115509.6500 62465.0300 47117.8200 Deoxy-DHCer (m18:0/18:0) 686812.3100 675897.3100 526906.5000 796422.1900 661720.0600 5226142.0000 7288737.5000 7999044.0000 8197805.5000 7923725.5000 1672679.1200 1352014.7500 1753044.3800 1839635.6200 2100098.5000 3941823.2500 5915050.5000 5926472.0000 6363457.5000 7247499.5000 840879.7500 959718.8100 559224.7500 314096.0900 744510.6900 8408721.0000 7902178.5000 6137137.5000 7699296.5000 5889858.0000 59239.2500 761318.8100 348532.8400 884323.7500 1166563.3800 2830062.7500 4106981.7500 5738600.0000 4841446.5000 3851232.0000 Deoxy-DHCer (m18:0/18:1) 65311.4200 44661.8000 337055.9700 383789.2800 310525.6200 434612.0300 501657.3400 23141.1300 8193.1400 32712.1200 6768678.5000 7611917.5000 8315565.5000 9520263.0000 9556479.0000 469786.3400 378094.4100 529413.2500 371171.5000 619564.5600 28012.9800 18191.6200 24256.3800 22515.9900 8878779.0000 12248041.0000 13266315.0000 11292236.0000 12728232.0000 294403.4700 563021.0000 325890.3400 264639.6200 601789.8800 17881.2500 6422213.5000 6795000.0000 8170789.5000 5274304.0000 9305337.0000 102803.8500 359666.0900 204688.7700 291717.0300 313593.2500 25802.5900 26043.8900 10328681.0000 10596672.0000 15294984.0000 13043588.0000 10746874.0000 Deoxy-DHCer (m18:0/20:0) 21185.7100 221326.7000 68901.6200 143157.8600 329315.7500 322178.6900 889395.2500 1446891.3800 1651365.0000 1485920.3800 1455143.3800 481479.0000 426347.7800 457242.5000 589113.3800 632946.0600 1267395.3800 2571222.7500 1780963.3800 2192746.0000 1706644.0000 318162.8400 362034.1200 162414.0500 95640.4500 393095.2800 1659279.1200 1603880.0000 1283661.1200 1894947.3800 1238648.0000 165849.1200 276793.3800 255775.6200 535070.1200 643362.6200 1069945.8800 836511.1900 737738.3100 Deoxy-DHCer (m18:0/22:0) 108319.9600 114329.8400 146504.2300 137161.6200 163201.6600 812035.7500 1121859.1200 1105189.0000 1036026.8100 1007221.0600 473856.2500 393223.1200 388412.7800 512113.6600 428671.5000 2434582.2500 4291762.5000 2492494.7500 3445124.0000 2263676.7500 282375.3400 202424.3900 85735.5300 108371.4100 241380.2000 1167083.2500 1193452.7500 969804.7500 1233499.7500 824208.4400 74808.7600 214805.8300 174467.3300 569515.5600 465052.9100 603145.7500 585183.0600 450040.6600 Deoxy-DHCer (m18:0/22:1) 127540.9100 205988.0200 134296.0800 253819.5500 253038.0000 3004186.7500 3930846.7500 4446674.5000 4209711.5000 3965139.2500 443995.2800 276141.7800 350316.6600 430886.9100 451147.0300 51150.5500 30649.7800 20795.0000 52088.6100 10563954.0000 12855261.0000 12933855.0000 13817001.0000 10533132.0000 275800.2800 400115.7800 91856.7700 222134.8300 303075.1600 4407733.5000 4493973.5000 4015738.0000 3267041.2500 3353681.0000 17381.1800 86627.1300 73222.6300 193746.1200 191614.7700 19487.0300 3245510.0000 2998018.2500 3480155.2500 3036068.0000 3277338.2500 Deoxy-DHCer (m18:0/24:0) 24013.2300 15361.6900 440538.8800 561486.9400 633383.5600 550125.6900 506706.6600 164477.5900 128938.9400 185456.5000 148241.1100 219934.6100 2186963.0000 4385155.5000 2680467.2500 2950199.7500 1815948.8800 42275.3400 63774.3300 26542.5200 19724.4800 523125.4700 492380.2800 464888.4700 527261.5600 306364.5900 61489.9700 282473.9100 311467.6600 393028.2800 286756.0300 276317.2500 Deoxy-DHCer (m18:0/24:1) 14834.1900 354395.0900 423853.5300 337146.1600 511046.5900 559705.7500 44144.8200 17527.5600 2026662.5000 2520179.7500 3371572.0000 3043788.0000 2623945.0000 1473259.6200 1186186.1200 1266185.6200 1541365.0000 1604046.6200 80438.3300 47392.4800 60653.0800 48189.2600 41283.1500 11608543.0000 16289199.0000 14985219.0000 17939082.0000 11733985.0000 19214.0200 884779.1900 902386.8100 446345.0000 422713.9100 761458.9400 6429.1700 3169351.0000 3460792.2500 2927769.7500 2886440.7500 2194957.2500 69283.2000 225755.5000 115970.9000 538838.3800 517807.2800 26732.0800 2477180.7500 1935159.8800 2541987.7500 1858580.8800 2049582.1200 DG(C32:0 )[-H2O] M+H 13220.6000 37815.6500 39726.0100 27657.4400 102471.4800 77339.7100 14614.1800 537731.9400 908072.6900 975834.5000 1077238.3800 802540.5000 15226.7500 157323.9200 85345.5000 153628.1400 209591.1200 198808.3800 935184.6900 2195427.0000 1648251.5000 2048685.6200 1324241.3800 77919.6200 140162.7300 138363.7700 46070.7100 42347.3000 87872.5000 15436.2600 1694092.3800 1378164.1200 1303574.0000 1637709.3800 952393.0000 18806.2400 37506.8900 62401.0200 15904.1600 106030.0300 93672.7400 384266.8800 250484.0200 237151.2300 DG(C34:0)[-H2O] M+H 23345.6100 23220.8800 31222.6900 37124.7000 316188.7500 484905.3800 598838.1900 640420.9400 522625.5300 95183.9700 27206.9700 41268.9400 67929.4100 109928.3400 470858.1600 1141224.5000 919708.9400 869757.2500 737149.1900 53706.7900 63960.7300 26790.0400 31953.9700 98312.0400 12545.4500 994690.5600 613634.7500 530069.5600 841478.7500 394376.5000 27940.0500 81543.6800 77607.2200 167991.9800 71148.0500 73869.8800 DG(C34:1)[-H2O] M+H 15109.1400 19728.7500 18203.0500 15083.8600 16916.2300 416810.8800 570411.5600 473933.9700 580439.3100 572479.0000 14624.4900 54650.1200 16923.9000 47252.6100 1983569.6200 3008825.2500 4454927.5000 4485827.5000 3838047.2500 18070.1800 18918.1700 17837.3500 1049061.8800 706009.0600 752768.4400 1077990.0000 1303958.5000 16444.3000 20897.7800 19362.3700 3490232.7500 8472443.0000 6973142.5000 7121353.5000 5436383.0000 333650.7500 17860.6500 990517.8100 799500.2500 465195.5900 355641.8800 899930.3100 34170.2500 19177.5100 14949.1400 24072.6700 13689.8600 6250187.5000 5325496.5000 5192427.5000 6278410.0000 3954614.0000 16902.3900 15754.5600 56723.6400 155137.6700 138334.8000 316634.9700 413884.0000 17310.7900 14747.7000 672140.8100 533316.6200 1165347.3800 797709.0000 958193.5000 DG(C36:1)[-H2O] M+H 16916.2400 15079.7000 23490.3700 13987.9700 2906108.0000 2498167.2500 2657045.2500 2822996.0000 2745659.5000 158786.4400 48443.0200 154067.8000 169292.3000 51262.9000 8367841.5000 10401244.0000 8749629.0000 11609299.0000 10901931.0000 18833.1100 42529.7900 4503252.0000 3705051.7500 4466816.0000 5404141.0000 5078536.5000 97677.2300 65802.0700 107875.8100 562787.1900 61616.2000 8812473.0000 12442872.0000 10586327.0000 10864668.0000 10698008.0000 47178.8200 46363.6400 20666.5200 39510.7900 2586862.2500 3277093.0000 2040397.0000 2118353.7500 2849286.0000 54524.0300 46976.4100 104889.6200 98046.2700 23216.6200 10644681.0000 10134073.0000 8332832.5000 12211341.0000 7030797.5000 1893293.5000 4097706.0000 2632018.0000 3372005.0000 4304118.5000 67182.3500 5054012.0000 6820632.0000 6193814.0000 5790078.5000 5720285.5000 DG(C36:1)[-H2O] M+H_1 39880.5200 16271.2100 17147.6800 39190.5400 1284814.8800 1315358.8800 1073931.8800 1197401.2500 1405488.6200 43084.3700 15554.7400 39402.8900 20999.0800 17054.2800 5447786.0000 5745938.5000 5746341.5000 6286883.5000 6197021.5000 18014.3500 16361.3300 2270065.2500 1961862.3800 2101146.7500 2393820.7500 2525555.0000 57107.6800 53845.7000 36033.8600 28066.9200 38844.5800 5088001.5000 5587652.5000 5168445.5000 5585009.5000 3076464.0000 29618.2700 59310.9700 15660.5600 20854.9600 1663170.8800 1649072.8800 1095658.1200 1255322.0000 1475614.5000 35833.9500 14714.8200 19648.9900 21455.5200 5792057.5000 6276450.5000 6051597.5000 6360960.0000 5735854.5000 14448.2100 10543.8500 17666.9600 586314.5000 1941226.3800 1371452.5000 2056485.3800 2136190.2500 23950.2200 14690.7300 3484377.2500 4395001.5000 4554681.0000 4041483.2500 3981261.7500 DG(C36:1)[-H2O] M+H_2 59071.3200 111072.5300 62576.8100 134729.9800 147242.0800 16011.5300 568270.4400 814593.6900 977029.8100 1240355.6200 826340.6900 272646.1900 161314.4800 227883.6700 272422.5900 263999.9100 1054420.6200 2535302.7500 1556699.8800 1810835.1200 1291508.0000 16163.7300 200579.6100 215811.5200 131267.0800 94045.3000 227139.2300 1539467.6200 983114.4400 1063921.3800 1410762.6200 783687.5000 20735.5300 46918.6900 38553.2900 124841.0900 52726.5200 238721.0800 212390.6200 336748.2800 242002.3000 255150.4200 DG(C36:2)[-H2O] M+H 14733.0600 11985.2000 13436.8500 14635.1100 14901.6500 469466.2500 470153.1600 463363.5900 545298.0600 545566.7500 13482.7900 68891.0900 15611.0100 17355.0800 1729444.0000 2816995.2500 3261360.7500 3548628.0000 2863187.2500 18492.1100 1126960.2500 616826.3800 871735.5000 1183742.1200 1238000.2500 32003.0600 3275365.2500 6675214.0000 4748232.5000 5765816.0000 4318092.5000 210754.6700 1047319.1900 920217.3100 411390.0000 402568.0000 692070.9400 17058.6400 13626.0500 4558339.5000 3941521.2500 4175885.2500 5135389.5000 3077400.2500 37380.0500 154227.4500 151919.5600 383259.2500 426437.7800 522288.2800 427652.4100 862719.3100 418406.7500 717509.1900 DHCer (d18:0/18:0) 183164.9400 2687789.2500 2922263.2500 2377971.2500 2703620.2500 3005157.0000 58886.1500 26172.6200 56482.5900 113193.4000 18951014.0000 20789258.0000 27912314.0000 37579964.0000 31171168.0000 2930781.2500 2825478.0000 3557555.0000 3875647.0000 3581852.7500 60021.7000 58580.8600 33314.3700 113805.2000 83051.9500 53064928.0000 95261184.0000 78556288.0000 90154360.0000 83453904.0000 6826.2400 79562.0500 4981580.0000 3645167.2500 3103311.7500 2488497.5000 3922104.0000 58516.3600 63105.3100 105028.1900 86006.2100 7940.7400 54677584.0000 49973952.0000 42456712.0000 57492668.0000 38289828.0000 675382.5600 2184851.2500 2359660.2500 3310272.7500 3510940.7500 789484.4400 18924814.0000 23935752.0000 42616380.0000 32678952.0000 29629134.0000 DHCer (d18:0/18:1) 34285.7200 43150.5800 18468.0700 20925.5200 29919.5500 29496.8300 19463.5000 24082.2600 28253.1300 99800.4100 47802.8300 215203.7500 49889.0200 14232268.0000 13978413.0000 11673733.0000 13770241.0000 16222063.0000 1497921.5000 630399.0000 1174998.8800 1599823.3800 617545.4400 94325912.0000 125927912.0000 129522208.0000 149755424.0000 156233840.0000 116027.3100 104426.3700 39899.0500 41360.9000 71646.1800 16162688.0000 14438924.0000 15087013.0000 18128494.0000 19141130.0000 917578.7500 780832.5000 647860.6900 992229.8100 589510.1900 89400800.0000 123373440.0000 105954560.0000 121273640.0000 123793856.0000 201361.6200 88531.8400 437781.0300 163679.2700 36972.3700 16436004.0000 13948739.0000 10718040.0000 11886807.0000 15524557.0000 785805.3100 803252.6900 817047.6900 1238498.0000 549305.9400 122468608.0000 142436000.0000 123636392.0000 127554216.0000 138787072.0000 43278.9100 52563.8400 22615.8800 29286.3300 28019.0300 4712540.5000 10887640.0000 7511728.0000 11490784.0000 11393219.0000 1253598.6200 88596.1900 217240.3000 137031.5800 217388.1200 58112720.0000 95934584.0000 88376976.0000 79242040.0000 69592440.0000 DHCer (d18:0/20:0) 184480.2500 15408.3400 542421.4400 542589.0600 486320.5300 480662.3400 508481.5000 32122.1100 17716.0800 2632484.0000 2817269.7500 3765534.7500 4100144.0000 3453158.7500 12250.5400 461795.2500 410774.6600 466442.9100 623535.7500 632722.8100 104734.5400 8343378.5000 15291103.0000 10077176.0000 15119839.0000 11002604.0000 12918.3900 57375.8100 928086.1900 582539.8100 569634.6900 511892.0900 877183.7500 37639.1900 7653286.5000 5992673.5000 5661977.5000 6982298.0000 3796531.0000 16215.0300 107746.6200 310064.0300 296088.6600 620677.6900 520812.5000 1093640.6200 2014595.0000 1654620.3800 3411736.2500 1989897.0000 2597976.2500 DHCer (d18:0/22:0) 102649.0000 16587.8300 18322.7400 16108.6100 13819.9600 20279.5500 51974.8900 321388.9100 394575.5900 239592.2000 346734.1600 460555.5900 16697.4600 72880.0700 16348.7700 61834.4600 23819.7700 2587874.7500 2714176.5000 3739094.7500 3829748.7500 2970849.2500 16857.9200 487280.0900 447453.0000 606111.8800 581749.1900 707579.5000 14788.3000 182124.3300 38320.4600 9391553.0000 25605320.0000 13632112.0000 14318805.0000 11104807.0000 15676.3900 106797.2500 572437.5000 485369.0000 333222.6900 462696.5000 705265.2500 12295.5400 29926.9100 21449.9900 7840428.5000 5091904.5000 4992294.5000 7526610.0000 3427683.2500 131516.6400 216921.0000 145850.6400 448800.2800 384148.7800 965225.9400 15256.9500 14826.2700 1299913.8800 916449.9400 2005094.5000 1260253.6200 2034164.0000 DHCer (d18:0/22:1) 23471.9900 2472638.7500 2755536.0000 2181560.2500 3388331.0000 4052393.7500 66070.5400 135445.7500 169772.4400 253118.5500 117114.8400 22524386.0000 28035706.0000 31072986.0000 32660184.0000 31200352.0000 21827.7400 5594062.5000 3405829.7500 4212895.5000 5378091.5000 5195192.0000 155972.1100 158688.8900 102240.6500 258308.8000 134401.0000 30030064.0000 44461680.0000 37301796.0000 44745164.0000 37576912.0000 33092.3200 374842.4100 17752.4500 4370441.5000 4029369.2500 2151511.7500 3576070.7500 4796948.5000 105183.8100 44169.9100 114283.6600 158731.3600 20800.5300 31913050.0000 31960370.0000 26731258.0000 31541018.0000 28129760.0000 644109.0600 1941235.3800 1255873.3800 2493293.0000 2579954.0000 737097.4400 15988.0600 21173.3400 9654838.0000 8632176.0000 10884129.0000 8573876.0000 10530416.0000 DHCer (d18:0/24:0) 65739.7300 260304.9200 149907.7300 186188.3300 263064.3800 295159.6600 18352.2800 26963.4800 34348.5500 1154975.3800 1432933.6200 1790298.8800 1786555.6200 1280508.6200 280119.5600 281460.9400 350131.7200 330509.3400 388216.9100 7913.0600 18884.1500 250290.3600 15363.5300 7565606.0000 32278086.0000 12253867.0000 8916047.0000 8279561.5000 147413.0600 27421.3400 221096.0800 303825.8400 120010.5200 323037.2800 450773.5300 69690.7200 3321451.7500 1924046.0000 2156228.2500 3394935.2500 1410330.3800 20292.2000 34802.2700 106212.8100 59615.4000 91381.0900 275972.4100 849774.1900 665323.4400 494033.9100 818887.0600 613187.5000 786140.8100 DHCer (d18:0/24:1) 62526.0600 18412.1200 14623.4900 1382090.7500 1557833.0000 1325622.3800 1463049.8800 1796987.5000 16509.9500 43894.6900 6379255.5000 7152734.5000 11237448.0000 11495853.0000 9303512.0000 15508.2300 2784206.2500 2677918.2500 3538939.0000 3833961.7500 3659859.2500 53092.3000 44023.3000 70934.3700 81227.5100 21156.6200 35191160.0000 78241168.0000 56054908.0000 64100128.0000 47420300.0000 17709.2100 4971.5000 3181513.2500 2474003.0000 1447610.3800 1944306.3800 3403265.2500 36694.9800 15436.1100 25353728.0000 22421184.0000 20533222.0000 26982434.0000 13516696.0000 501993.3400 1413639.3800 859360.8100 2321352.7500 2460609.0000 285967.5300 5829004.0000 4277608.5000 9567303.0000 5714668.0000 8161210.5000 DHCer (d18:0/24:1)_1 34858.1500 13441.8200 16238.7700 17228.7400 30798.9900 14818.1500 1692766.6200 1600882.3800 1435039.6200 1892417.3800 2187515.7500 114199.3800 105838.1200 162554.9500 318810.7800 147988.6700 19976794.0000 25715258.0000 26707278.0000 28498256.0000 30318786.0000 41946.4400 42792.4000 14814.1200 4691993.5000 3203030.0000 3700806.0000 4099281.0000 3851887.2500 243591.4500 299719.4700 261428.0000 359573.9100 181557.3900 52038428.0000 80195832.0000 60957324.0000 76579144.0000 61749676.0000 20612.6200 327943.4700 14523.4900 23759.5200 2436114.2500 2562167.7500 1237409.5000 2121471.7500 2766541.7500 80583.2000 49675.6400 106724.8200 86619.9500 63102.2000 27864134.0000 27045600.0000 21064290.0000 28428072.0000 20386498.0000 20073.4400 400229.2500 1330981.3800 704751.5000 2021707.1200 1618205.6200 1046659.9400 27607.9300 39598.7900 15567.0400 14998.8900 10594946.0000 9629230.0000 9664979.0000 7757721.5000 8741289.0000 Dihydrofolic acid 4712.7800 5942.2300 4074.2200 10416.3600 3718.1100 2680.9100 5141.6900 2835.0200 4382.4200 6611.1000 2791.4700 2608.4300 4481.2000 3541.1100 2626.0000 9831.7200 3706.2700 4527.3500 2439.6100 14230.0600 4912.9700 10454.1300 4407.9200 4118.4400 2683.1600 Gal/GlcCer(d18:1/16:0) 6065406.5000 6391016.0000 4689336.5000 5585224.5000 6292220.0000 2601163.2500 2766750.5000 3225759.0000 2327380.5000 2482382.7500 57142.5700 52488.3600 7017348.0000 5883770.0000 6765379.5000 7429921.5000 6335394.0000 78373.6000 69935.3500 202977.9500 55327.6500 4177083.2500 4934480.5000 3250236.2500 2994091.2500 2557573.7500 125413.9800 7726145.5000 7018728.0000 5549120.5000 5230139.5000 7288670.5000 2107207.2500 2491639.0000 2834416.2500 2993361.7500 1899697.3800 54088.8600 5683398.5000 6641340.0000 6575980.5000 8317772.0000 7667634.0000 2299785.0000 2669476.2500 2628725.0000 2004909.5000 2440169.5000 Gal/GlcCer(d18:1/22:0) 20660.9600 16517.2800 213614.5000 19319.2000 24443.1200 17707.9700 18951.0000 17183.6100 17873.4800 1762881.3800 1684488.3800 1572235.6200 1926518.5000 2232603.2500 20541.4200 18896.3100 40130.2000 67301.4100 31298.6800 9043046.0000 10085423.0000 8514277.0000 7854402.5000 7829871.5000 35825.8600 17656.9400 17250.7200 16199.5900 2976965.2500 2779961.2500 2929447.2500 3153264.0000 3068584.0000 66896.8000 45383.1700 34922.3300 79127.7700 29998.3200 8704896.0000 10261841.0000 9736611.0000 11727917.0000 10962085.0000 43940.1100 98472.3700 790335.2500 17784.4200 34181.5500 2237389.0000 2408220.2500 1654416.3800 2120416.0000 2904768.7500 66524.7400 25472.5000 18759.5500 5443941.0000 7526294.0000 6117264.0000 6228590.0000 5947747.5000 19177.7500 14118.6800 33693.6100 50891.3000 826405.4400 2035210.6200 1215245.2500 2375803.7500 2248412.2500 17361.9700 34553.1200 29967.4600 4651312.5000 4629386.5000 4559202.0000 3777104.2500 4381291.5000 Gal/GlcCer(d18:1/24:0) 48979.2300 945159.4400 991591.8100 1005982.6900 1148646.6200 1419660.0000 22249.6800 33490.2300 5812858.0000 6790249.5000 6921168.0000 5747840.0000 6492613.5000 27587.8800 2327217.0000 2062071.5000 2202056.7500 2628387.0000 2561041.0000 50141.8900 48716.6700 67272.6600 118211.6500 31646.3100 11776263.0000 16846514.0000 15040736.0000 17348504.0000 14651965.0000 25088.3800 172156.7300 1218367.8800 1408232.5000 718473.0000 1519379.1200 1786901.1200 31148.8400 17984.6600 5290187.0000 6068849.5000 6033531.5000 5105104.5000 4479082.0000 369443.2800 1223016.1200 700714.3100 1519026.3800 1296166.0000 5062702.5000 5838806.5000 4945884.5000 4654356.5000 4826941.5000 Guanine 1052584.0000 2298094.2500 1074005.8800 2451256.7500 1797746.1200 5759126.0000 10799427.0000 12443411.0000 12967592.0000 23448162.0000 226412.6100 2510792.0000 1364329.0000 4661750.5000 2239497.0000 6954302.5000 292419.3400 11714644.0000 25151922.0000 2714931.0000 1445960.0000 1699756.5000 1060911.3800 797505.5000 791379.6900 4518542.0000 17634746.0000 77638.9100 10240799.0000 3115399.2500 60210.8900 346670.9700 518226.1600 1347615.3800 1096256.1200 2897707.0000 2857228.0000 3578304.0000 3993972.2500 2635598.5000 Hypotaurine 496214.3800 290715.2200 349972.9700 255367.3300 177370.9200 14484.6700 10159.1700 64383.0700 57131.0300 57806.5100 49443.6100 65172.0200 17059.2400 13544.7300 8416.4500 143352.4400 158892.7300 119043.4900 173008.6100 218454.8900 113016.9000 354334.0000 263018.8800 269789.8400 252728.0500 L-Arginine 213622096.0000 152295152.0000 118553216.0000 128278360.0000 167754672.0000 88876872.0000 193234384.0000 172949648.0000 184811600.0000 175080640.0000 127529512.0000 121947320.0000 99511688.0000 92166120.0000 66959168.0000 86844424.0000 45406768.0000 194354576.0000 283843040.0000 136560448.0000 192409520.0000 107146936.0000 73734392.0000 174011840.0000 182804528.0000 77456120.0000 198787904.0000 10112055.0000 159356272.0000 151813824.0000 128071000.0000 203247216.0000 89207224.0000 120243576.0000 114337096.0000 66478420.0000 164322960.0000 126786816.0000 134287120.0000 130359136.0000 L-Asparagine 1838578.0000 1548241.5000 1519043.3800 1660001.5000 1570604.3800 1683805.8800 1754641.5000 1638621.8800 1566463.8800 1723135.1200 1361921.5000 1079772.8800 1319879.3800 1155285.1200 1521630.6200 1480088.1200 1525285.8800 1698614.8800 1617077.6200 1586240.3800 1428055.8800 1147258.3800 1422562.0000 1471897.6200 1630660.5000 1651819.3800 1435919.6200 1497892.8800 1507526.6200 1238320.3800 1493804.0000 1324275.6200 1164625.1200 1301104.0000 1205403.3800 1387920.3800 1292173.8800 1168345.3800 1177220.1200 1553107.3800 1204737.0000 1265434.8800 1151401.1200 1108003.3800 1057564.0000 1498758.0000 1461524.3800 1405023.8800 1240751.6200 1513229.5000 L-Carnitine 565083072.0000 429186016.0000 514422368.0000 514489088.0000 498181216.0000 571648000.0000 561684224.0000 533394080.0000 511633504.0000 548117696.0000 497583584.0000 489470688.0000 473459712.0000 454118304.0000 531142272.0000 511191808.0000 406325248.0000 393327520.0000 443501536.0000 460286208.0000 402370208.0000 451282944.0000 424623520.0000 380497152.0000 386088320.0000 584974016.0000 940680768.0000 999188800.0000 1056515776.0000 968212288.0000 549664832.0000 464020608.0000 497360288.0000 494325408.0000 532393888.0000 492474272.0000 436782944.0000 408031904.0000 399196576.0000 361378016.0000 353994016.0000 352696672.0000 390272864.0000 393695776.0000 326934528.0000 524368032.0000 268180032.0000 985298240.0000 1095473024.0000 991120896.0000 498970720.0000 430586880.0000 409550816.0000 484982688.0000 386132128.0000 556806016.0000 416283232.0000 280418464.0000 496217312.0000 515605632.0000 332593472.0000 333620832.0000 286231680.0000 347033120.0000 374259744.0000 588966848.0000 1039301824.0000 38761836.0000 910604352.0000 1031170496.0000 542278912.0000 466224480.0000 468480480.0000 411865856.0000 409193120.0000 355192704.0000 522497280.0000 369128288.0000 484078240.0000 440749664.0000 387238016.0000 392867072.0000 390012896.0000 309733248.0000 418069632.0000 331393760.0000 757810240.0000 828228864.0000 698063936.0000 802621632.0000 L-Glutamic acid 8861823.0000 7326960.5000 6422691.5000 6496367.5000 6568100.0000 6631197.5000 6698682.5000 5669761.5000 5687758.0000 5760968.0000 366883.7200 214869.7500 329966.7200 245040.9200 307751.6200 103929.0200 89416.3700 173083.3600 160515.1900 146133.4800 319629.5300 209441.5800 302754.8800 290960.3400 264939.4100 136535.8600 119629.0900 152381.1100 150699.6100 99755.3400 330943.0300 225296.2300 279544.3400 340462.2200 205982.5500 163437.7700 164743.9400 133772.0800 165534.1700 192136.7000 212146.3800 164971.8800 229200.3600 132837.8300 119522.5900 114646.4400 106128.3400 48202.0400 69718.9500 127957.3400 L-Glutamine 221638544.0000 209723344.0000 175950480.0000 210314752.0000 310806624.0000 139980608.0000 235203120.0000 214218560.0000 233610224.0000 222531968.0000 133004760.0000 159265856.0000 136467200.0000 119881216.0000 100243968.0000 128528232.0000 80551000.0000 214906384.0000 408598400.0000 205580080.0000 168106736.0000 142970224.0000 113726848.0000 298624480.0000 346218272.0000 141008592.0000 244266960.0000 50916084.0000 219138608.0000 212777808.0000 128271688.0000 266630592.0000 125079800.0000 173877392.0000 169872896.0000 172948336.0000 234849616.0000 240259888.0000 230789200.0000 244367744.0000 L-Histidine 52251136.0000 37127680.0000 25446256.0000 35736912.0000 42584616.0000 18036378.0000 46904524.0000 43188812.0000 50017308.0000 44047212.0000 28961786.0000 32756280.0000 20406246.0000 20521206.0000 16855156.0000 18909908.0000 9128497.0000 49191648.0000 82954728.0000 31381078.0000 42104028.0000 28278880.0000 13649317.0000 55509204.0000 45618640.0000 13875316.0000 49560756.0000 3355768.7500 40959760.0000 38049680.0000 15853741.0000 58423244.0000 19450936.0000 25714720.0000 25587712.0000 10410487.0000 30498992.0000 27780870.0000 28969686.0000 30804130.0000 L-Isoleucine 112374272.0000 47473484.0000 46172476.0000 54871604.0000 75202696.0000 36100284.0000 79012792.0000 81978008.0000 83485800.0000 75722072.0000 34000272.0000 32157168.0000 29554256.0000 22279024.0000 13613787.0000 29495242.0000 5111298.5000 102039616.0000 138137744.0000 69552296.0000 93976728.0000 37090588.0000 17521942.0000 89640064.0000 71985416.0000 32751888.0000 76001120.0000 1326346.3800 57249404.0000 48192896.0000 29371462.0000 59047892.0000 21805494.0000 41546844.0000 32877618.0000 12721477.0000 18293902.0000 27090570.0000 26843408.0000 26416542.0000 L-Kynurenine 22721.1000 12834.2900 7977.4100 19440.5400 39792.4600 54214.3900 76518.7000 183669.7700 106377.9500 73094.6200 30503.2700 9120.0700 21985.7000 21292.3600 12107.8200 1229843.5000 100122.2600 2397246.0000 2871897.7500 1029624.9400 40837.2700 33534.7100 23574.1700 35234.2300 41444.2200 54130.5300 241805.8600 8880.1800 67686.6200 18488.4000 9747.0800 14147.7200 13898.1100 56923.9100 31356.8700 61413.1000 82986.5900 95838.3500 79735.4700 56459.0300 L-Kynurenine_1 35317.6600 24882.3500 26051.1500 29828.1300 48336.2900 42805.1300 79887.1000 109497.1200 96879.3400 46162.2400 36085.2500 45574.9400 30361.8200 27967.3900 24682.7900 815100.5600 164233.3900 1179293.2500 1440671.6200 846830.2500 50658.0100 47941.7700 21451.3700 25748.3400 26677.0300 57648.3900 211471.9800 26254.2400 47052.8000 60078.2300 19625.1300 50240.5500 16591.6100 56607.6800 56504.4900 72179.7900 115369.7900 96282.4700 92829.1600 101207.5900 L-Leucine 53571488.0000 41084092.0000 40196336.0000 43624964.0000 54146228.0000 28800390.0000 50335644.0000 47683476.0000 51109600.0000 49868928.0000 27046538.0000 34921780.0000 28285414.0000 26903450.0000 20472528.0000 30257646.0000 8544144.0000 46940596.0000 62988972.0000 49225980.0000 47402860.0000 31793568.0000 22467366.0000 57262112.0000 56037760.0000 28860186.0000 52171104.0000 2973807.0000 42110960.0000 36133740.0000 20090592.0000 49117716.0000 25122490.0000 36691308.0000 37366860.0000 18711334.0000 25846000.0000 26835520.0000 27621542.0000 27217802.0000 L-Lysine 16631875.0000 14380428.0000 16916650.0000 15070779.0000 14288765.0000 15176312.0000 15730152.0000 13384216.0000 13209508.0000 12566652.0000 18555230.0000 14666967.0000 18216950.0000 16287999.0000 18310314.0000 18392008.0000 18467114.0000 14796081.0000 18676062.0000 31442338.0000 18161034.0000 18380286.0000 17487768.0000 15500207.0000 15040229.0000 12689532.0000 21406270.0000 20688434.0000 20662444.0000 17820504.0000 18750726.0000 14834563.0000 16813678.0000 16939838.0000 17857740.0000 14468240.0000 15947821.0000 12431399.0000 10761038.0000 9115491.0000 17289270.0000 14819099.0000 16030811.0000 14875535.0000 12755689.0000 6764878.0000 6600913.5000 21825904.0000 37052284.0000 13259523.0000 18286198.0000 14628788.0000 17523334.0000 17234650.0000 15562335.0000 16301421.0000 13021739.0000 8580889.0000 32037104.0000 34514848.0000 17186626.0000 15091600.0000 14652120.0000 13481828.0000 17324568.0000 11879549.0000 22622406.0000 2459316.0000 17362562.0000 14585309.0000 18100382.0000 17936758.0000 17921818.0000 16584525.0000 15203365.0000 12289595.0000 26427464.0000 10151553.0000 13733007.0000 14044491.0000 14588092.0000 14352736.0000 13715528.0000 13220395.0000 15393832.0000 8599753.0000 20493714.0000 15416280.0000 14392293.0000 13166429.0000 L-Methionine 9835816.0000 8845764.0000 16398108.0000 9393958.0000 9700679.0000 14891757.0000 12253979.0000 10950093.0000 11368827.0000 11297781.0000 11523599.0000 9457425.0000 10096995.0000 9162287.0000 11827840.0000 10506364.0000 8518809.0000 8087872.5000 9108719.0000 10390463.0000 10988751.0000 13671627.0000 11764897.0000 11572375.0000 10737197.0000 5816057.5000 9483269.0000 9128887.0000 9552626.0000 8629384.0000 11441437.0000 9063656.0000 8664290.0000 10839117.0000 13159241.0000 5766135.5000 6751318.5000 6016102.5000 5628750.5000 4186650.7500 7905882.0000 7193519.5000 9725791.0000 8835952.0000 6968944.5000 7135807.5000 2128923.5000 10640239.0000 12435625.0000 9900226.0000 10974832.0000 11723800.0000 8222218.0000 10170931.0000 8032951.5000 9475983.0000 6721704.0000 4370067.5000 10974314.0000 11201911.0000 10228861.0000 7919112.5000 7652002.0000 8549399.0000 11887120.0000 5699681.5000 10199315.0000 541396.3100 8707690.0000 7572438.0000 12031979.0000 11771681.0000 13031275.0000 8084986.5000 8304972.0000 4585471.5000 9637395.0000 5407785.0000 7410661.5000 7201598.5000 10962617.0000 12883496.0000 8429689.0000 8634806.0000 13221184.0000 4934826.5000 7218792.5000 6841025.5000 6396309.5000 7022658.0000 LPC(C14:0) 11900.4600 18106.0000 20636.3500 8967.7300 2046020.6200 2091955.0000 1775522.8800 2054891.0000 1647464.3800 12564343.0000 9832236.0000 6280490.5000 8846111.0000 4960416.5000 2172335.7500 1288318.6200 1922732.3800 2106168.7500 1551973.0000 6113810.5000 9062191.0000 10941596.0000 13797852.0000 12988105.0000 1578104.3800 1264704.8800 1459978.3800 1625119.3800 1426134.0000 3796108.0000 3801999.0000 6551947.5000 6113224.0000 5361276.0000 2121959.5000 2499589.0000 2607417.7500 1959683.6200 1848333.3800 9794500.0000 22142610.0000 12452796.0000 14955672.0000 14586248.0000 2741966.5000 2439699.5000 2474696.0000 2495790.7500 2519619.5000 9344559.0000 7299203.5000 11695584.0000 5759805.5000 5121297.5000 1209761.8800 1583814.8800 1012336.3100 1830649.3800 1047980.3100 8954077.0000 9547885.0000 7920161.5000 10271003.0000 7979052.0000 1283792.3800 1089582.5000 956184.0000 1009420.1900 1235971.5000 674205.1900 3268888.0000 1550632.6200 2610481.0000 5522408.5000 828229.3100 581103.3800 571888.7500 534756.8100 534486.8100 4690137.5000 6692974.0000 7910723.5000 6380132.0000 4370142.0000 LPC(C16:0) 1254855.8800 564633.8800 1147508.3800 962629.0600 1566485.0000 779495.3100 485950.0000 488517.8400 458671.5900 505203.3400 24135408.0000 27394448.0000 22716840.0000 23476662.0000 20686600.0000 92662344.0000 75401296.0000 59689828.0000 74335816.0000 54463028.0000 53816716.0000 36892836.0000 48585408.0000 52099504.0000 41821508.0000 173724912.0000 250032720.0000 264168016.0000 340158624.0000 339220640.0000 22331206.0000 17770552.0000 21203826.0000 23285648.0000 22178202.0000 48824160.0000 47015156.0000 66936012.0000 67349352.0000 63485684.0000 43321756.0000 50801764.0000 60546764.0000 52059460.0000 44776480.0000 294499424.0000 570691648.0000 360641664.0000 434682464.0000 443178880.0000 37916348.0000 35758068.0000 35014348.0000 37093388.0000 38201820.0000 83201904.0000 74061016.0000 84737272.0000 58322272.0000 59945948.0000 37017572.0000 35494140.0000 32739726.0000 62975824.0000 36585176.0000 276719520.0000 305995488.0000 231984128.0000 266366928.0000 277783328.0000 21461358.0000 19334304.0000 16239715.0000 16428885.0000 20591558.0000 10989661.0000 41702396.0000 20496418.0000 39609880.0000 64003924.0000 40163328.0000 44653840.0000 39585108.0000 37518668.0000 29279690.0000 211760080.0000 256700368.0000 318885472.0000 253415824.0000 201271424.0000 LPC(C16:1) 60749.9300 17480.7200 31734.5200 20283.2900 25614.2500 28463.4500 7014.2500 13648.6900 9240.8800 17587.2100 3607410.7500 3954783.7500 3054642.0000 3894102.2500 3090750.0000 15311400.0000 10042907.0000 8070960.0000 9356221.0000 5687816.0000 7643194.5000 3548916.7500 6750213.5000 6952074.5000 3905343.2500 17243082.0000 26173480.0000 23975558.0000 41573960.0000 37508580.0000 2370038.0000 1747111.0000 1953832.0000 2292490.0000 1984695.3800 5558577.5000 5216256.5000 8502544.0000 7924580.0000 7367534.5000 4233897.5000 5779309.5000 5931584.0000 4701470.5000 4671356.5000 21708858.0000 39415612.0000 27914866.0000 35138320.0000 33321686.0000 3451325.2500 3207581.7500 3064745.7500 3276869.0000 3548665.2500 7567372.0000 6805720.0000 10427481.0000 5268877.0000 5666810.5000 3211755.0000 4200882.5000 2204893.0000 6613238.5000 2777449.7500 27798114.0000 27848558.0000 23906786.0000 25693126.0000 26800198.0000 2768131.2500 2343959.2500 1873194.0000 1897517.1200 1827628.6200 1184483.0000 5203470.0000 2402998.7500 4440081.5000 8393611.0000 1587412.0000 1343016.8800 1430392.3800 1184027.8800 949626.5000 14710021.0000 18189674.0000 24271206.0000 21099178.0000 14985635.0000 LPC(C18:0) 3632409.2500 2614104.7500 3903105.7500 2899262.0000 3346423.2500 2399146.0000 2386360.7500 2755813.7500 2258217.0000 2613048.2500 2659441.7500 3064525.0000 2856848.7500 2565391.0000 2720130.7500 9628932.0000 8698295.0000 8767755.0000 9672849.0000 9922721.0000 12341460.0000 8643888.0000 11609816.0000 14164763.0000 9661225.0000 108230880.0000 156953072.0000 168480784.0000 217263680.0000 196293168.0000 2571323.7500 2610402.2500 2683852.7500 2657151.7500 2466241.7500 15094424.0000 11948688.0000 14744344.0000 17441798.0000 17830390.0000 7654811.5000 7795930.5000 9185396.0000 8345081.5000 7555781.5000 135019904.0000 393554208.0000 199310320.0000 207130176.0000 203600064.0000 2905484.0000 3138625.7500 3909919.0000 3234306.2500 2776482.7500 14531596.0000 13055328.0000 11205117.0000 9867089.0000 12315284.0000 6362819.5000 7223434.5000 6159480.0000 9131643.0000 5842055.5000 131855112.0000 125881448.0000 97263136.0000 149676288.0000 109563272.0000 4195456.5000 3626468.7500 3448931.7500 3166852.7500 3349287.0000 3086451.2500 9528691.0000 6151966.0000 12340957.0000 12594571.0000 9039403.0000 8504168.0000 8825137.0000 9036919.0000 8184418.5000 75135816.0000 90066728.0000 116706120.0000 98118824.0000 75545416.0000 LPC(C18:1) 401475.8400 157224.5500 375538.0300 286082.1200 253454.3900 302483.9700 134230.6700 143367.4800 95851.0400 167797.1600 15538909.0000 17922530.0000 14395179.0000 16286453.0000 13202683.0000 104444712.0000 81636552.0000 58731152.0000 71797112.0000 53956080.0000 30260550.0000 16075147.0000 28704730.0000 29188258.0000 17906158.0000 114891640.0000 174412480.0000 160197232.0000 219720272.0000 206251408.0000 10607571.0000 8591435.0000 9235748.0000 10367464.0000 8886148.0000 47725444.0000 44799884.0000 69511592.0000 67084144.0000 60233952.0000 16482247.0000 22596168.0000 23752650.0000 17569358.0000 18786570.0000 136547888.0000 274576864.0000 167940112.0000 201207296.0000 175288944.0000 22522034.0000 21822206.0000 17905376.0000 22063096.0000 22251826.0000 87688952.0000 72335416.0000 94633144.0000 62130820.0000 56536784.0000 14340655.0000 16706424.0000 10772065.0000 28393120.0000 12922571.0000 141505936.0000 144389840.0000 137973392.0000 146360848.0000 153858224.0000 12952653.0000 10875703.0000 9209829.0000 9286564.0000 8840911.0000 8184973.5000 32896742.0000 17471488.0000 30476614.0000 58007584.0000 9663443.0000 9684557.0000 7930058.0000 8397093.0000 6854494.5000 84738152.0000 98050344.0000 122663360.0000 102420648.0000 83804688.0000 LPC(C18:2) 111993.0400 96441.1500 117454.7800 81562.7700 103879.5000 83001.4100 83828.3800 93824.8400 85329.1300 90992.2100 908343.6900 1183459.1200 1024058.4400 1156048.3800 858466.5600 5158756.5000 3565405.0000 2452316.5000 3471812.0000 1875972.3800 1369902.0000 643105.9400 1088554.6200 1297072.6200 651782.3100 3412827.7500 5863414.0000 5674112.0000 8540025.0000 8200330.5000 645202.3100 502842.8800 546762.7500 652058.8100 467496.1200 1631177.0000 1710990.0000 2535853.0000 2195860.5000 2022797.6200 575841.1900 917023.9400 779970.3100 727750.1900 528754.3800 4177153.2500 6657865.5000 4762479.0000 6249946.5000 5263289.5000 1187378.5000 1205129.3800 1200088.1200 1136799.1200 1325324.3800 2882969.0000 2324714.7500 3711045.7500 1972817.3800 1693955.1200 387894.9100 477527.0300 243048.3300 922303.8100 335710.6600 4823442.5000 5060622.5000 4201590.0000 4974760.0000 5806794.5000 637910.7500 525569.1900 406444.2200 437412.8400 435972.7800 321825.4700 1452799.6200 628182.8100 1308562.3800 2526878.2500 262611.0000 193420.9500 244354.6200 249221.7500 235196.8000 2583096.7500 3694887.7500 4700945.5000 4139076.0000 2751063.7500 LPC(C20:0) 7156.6800 91253.8200 11091.8400 8662.7700 12610.1400 144011.4500 104402.3000 66692.5300 52781.9600 129944.0700 98137.2200 119790.0900 88608.4400 128464.1800 78895.5200 933209.7500 1204436.5000 1266869.3800 1391687.3800 1280500.0000 12530.9600 30676.3700 20383.8100 67391.0500 129103.2500 132769.1600 153633.1400 167185.9500 72411.4800 109497.5200 90265.4100 130581.6900 71995.8400 2063551.1200 4834638.5000 2357994.0000 2598578.7500 2215043.2500 13159.2100 14351.2700 21596.6500 23956.8500 197506.3900 94015.5600 211027.4400 177804.1900 102728.9500 62921.1400 81489.9400 94637.3500 53432.2000 64390.7700 1152407.3800 1073371.3800 721941.1900 1055025.8800 965689.6900 25448.3900 13664.3900 10305.7400 10651.0800 26022.6700 66788.7300 19203.7100 84757.9100 100460.9900 101747.8800 90698.3000 134164.9800 82856.1200 47498.6500 907590.5600 1014183.9400 1319768.1200 1052698.8800 910284.8100 LPC(C20:3) 329285.3400 382621.8800 246973.1200 362694.2500 204032.3100 16012321.0000 10764785.0000 6568929.5000 9213900.0000 3892884.0000 465875.3800 180974.7000 334197.0000 455149.4700 193558.6100 2870459.2500 4794842.5000 4765686.5000 6718511.5000 5563926.5000 183067.0000 107087.4600 86802.1800 135560.6900 92042.7100 2567680.0000 2229468.7500 4976678.0000 4834332.5000 3506551.2500 217851.1400 353561.5300 394013.5000 255766.1700 208458.7700 6967296.5000 6293392.0000 6203565.5000 7993624.0000 4012466.0000 431547.7200 357283.5000 322333.4400 379700.6600 364351.7500 6001486.0000 4644133.5000 11085921.0000 3707535.2500 3292469.0000 112548.1000 107778.0500 31793.3100 373405.2200 110895.8800 3964917.2500 4936446.5000 5596451.5000 5321822.5000 5760992.5000 290300.3400 218134.8900 199431.0800 106339.4000 212489.4200 506229.9100 2865198.2500 1218395.3800 2214899.0000 6315828.5000 80360.3800 54894.0400 61127.8000 90971.8800 88809.0200 2704300.7500 4060331.0000 5380660.5000 4476840.5000 3251240.2500 LPC(C20:4) 29881.5400 21972.8100 142382.7800 54190.4600 33891.1100 24669.1200 21176.4300 36923.5000 8449.1200 7015.7600 484203.5000 647323.7500 517900.4700 558416.9400 397565.0900 22843504.0000 14022032.0000 8551259.0000 13080299.0000 4969932.0000 1115222.6200 376368.1600 856451.8100 1054694.0000 323893.5900 9429988.0000 13812948.0000 12421236.0000 20728184.0000 19742218.0000 189570.8100 167134.3100 168070.2700 214548.5500 159571.7300 3373811.2500 4272011.5000 7992914.5000 6227652.0000 5009429.0000 441796.9700 721591.6900 606129.9400 414166.5000 451283.5300 16521928.0000 12828029.0000 14766263.0000 16318924.0000 8277701.5000 498895.2800 473755.7500 528436.8100 472218.6600 513064.5000 6753284.0000 4723847.5000 12573655.0000 3928994.7500 3139032.7500 175263.5600 154015.5800 84921.1400 640270.5000 180703.8800 10459041.0000 13769977.0000 14589789.0000 10436955.0000 15389523.0000 236621.4400 152350.2000 130798.0200 178743.3800 159424.6200 530870.4400 2917654.0000 1170013.1200 2580231.2500 7002180.0000 117082.5600 60764.8700 89947.4100 82531.5000 82791.1800 9473716.0000 12899499.0000 16943860.0000 12645137.0000 9290635.0000 LPC(C20:5) 33556.7000 47599.5400 21611.2800 45214.7500 23194.0300 1311803.5000 765834.8100 485415.1600 723142.3100 287706.6200 55710.7300 18841.1300 35015.9300 35105.7000 15009.0500 283991.5300 502132.7200 526860.2500 719929.4400 607400.0600 176227.6400 226704.0600 414612.9700 344868.0900 219213.1900 7921.8400 40035.3600 10628.6100 8669.0600 16982.4500 476735.9700 411154.8800 420113.2500 405897.5000 307218.8400 36008.9100 45886.8400 37179.5900 34786.6200 38316.3800 479209.4100 257339.4800 715540.0600 283599.5300 184310.1200 35344.4300 7245.4900 429944.9700 541209.3100 626598.6200 408758.8400 616839.5600 5564.2500 6673.8600 16167.8600 200138.3100 65179.4200 123443.5500 350279.9100 4186.3400 563284.1900 816750.9400 938639.0000 811729.8100 537759.1200 LPC(C22:0) 38131.3400 10141.6100 8121.0600 12360.5000 39288.7400 13036.9100 33634.4500 241153.5800 263243.0900 322758.2200 251244.2000 303310.4700 18759.3900 16403.8600 14057.8900 37441.2300 30363.7200 17659.8500 40257.4600 32705.9400 36759.1200 951558.4400 1854794.5000 1179386.0000 1280105.6200 993021.0600 7325.8100 27141.2300 18968.3800 11494.5100 6030.2400 18956.2000 16914.6200 258300.3000 242267.0200 220329.5600 235475.2000 203058.4400 15668.8400 13413.6400 11803.7900 15977.4800 38049.2100 26416.7300 458962.9700 460350.8400 412834.7800 460483.4700 322274.0300 LPC(C22:5) 7384.2200 12567.6400 2071.4600 45035.9000 63954.8900 64129.4900 97258.2400 49937.4400 6300264.0000 3573247.7500 2243974.7500 3476106.2500 1220785.3800 151347.9200 87310.0000 171552.6600 70081.7700 1248884.1200 2110537.5000 2050394.0000 2612271.2500 2575651.5000 61306.1300 10413.8100 44696.5900 38359.6900 41605.9800 906209.5000 1254981.0000 2003987.3800 1719016.0000 1510241.3800 67689.2400 97854.8800 97978.7500 85517.1800 34455.2100 1776586.5000 1572430.8800 1773765.0000 1592761.3800 938614.8100 104830.1600 92454.9000 105650.3500 78398.2300 76482.2500 1890820.0000 1080316.1200 3115996.0000 1187349.3800 847617.9400 50598.4900 18222.4100 13457.2200 133310.2300 43120.8300 2702639.7500 3633641.0000 4173390.0000 2430276.0000 3921294.7500 20878.1400 13440.1700 11715.5800 22378.4500 18005.3700 69067.1500 445591.6600 178365.0000 352207.7200 876341.3100 21876.8400 28996.3600 21370.3500 16118.2200 32950.4400 1525697.0000 2404130.2500 3585368.2500 3177990.0000 1743887.8800 LPC(C22:6) 21744.4300 6425.3300 16018.9500 8768.5000 8437.9600 13416.9100 4278.5000 4556.8800 59313.7500 71338.8800 38940.0700 76446.2700 41328.1800 5770085.5000 3274795.7500 2005012.5000 3321923.2500 1297163.6200 94933.1900 231637.8100 241411.7500 76580.1800 2005640.3800 3402710.7500 3020553.2500 5299942.5000 5128864.5000 45031.8300 23471.3200 26379.4200 19490.3100 26765.0000 568751.6200 786392.2500 1212190.1200 1083753.0000 919156.8100 123990.3800 165734.0800 122252.2300 78487.0700 113755.4100 3884936.0000 3612112.7500 4039742.2500 4979518.0000 2217414.2500 71200.7600 61830.8500 79081.9900 69756.4400 98800.0200 1461066.0000 1158699.8800 3038913.0000 894316.1900 770571.4400 46491.1700 20420.8900 29856.5300 203919.3000 48112.5200 3016063.7500 4386529.5000 4194434.5000 3019069.7500 5125482.5000 24555.7900 21852.0400 13177.2900 29148.6500 28554.3000 180433.3900 797379.7500 319204.7800 496833.3400 1343131.6200 11633.0500 9231.0200 6286.7100 8510.6800 39863.2000 1397998.0000 2147308.7500 3077367.0000 2322202.7500 1647564.1200 L-Phenylalanine 38439488.0000 29846278.0000 54558880.0000 52788544.0000 49170108.0000 46773696.0000 50314940.0000 40132860.0000 49214628.0000 50735708.0000 58763040.0000 41614632.0000 60385840.0000 55575788.0000 61399264.0000 60805808.0000 37897728.0000 29266374.0000 38460336.0000 28000200.0000 67132440.0000 75344384.0000 73912152.0000 64331252.0000 69290016.0000 25246768.0000 53601268.0000 54846048.0000 60814116.0000 44011548.0000 48531276.0000 43053252.0000 61953036.0000 61580908.0000 63305308.0000 20139208.0000 16172471.0000 18329130.0000 16543429.0000 10297395.0000 64809536.0000 50599580.0000 61566068.0000 57884084.0000 45470732.0000 28066442.0000 5163265.0000 63902880.0000 80247744.0000 54667956.0000 57565620.0000 59902356.0000 57328752.0000 67287992.0000 51228316.0000 61715888.0000 21823118.0000 9737041.0000 43424592.0000 48363788.0000 60503724.0000 46588896.0000 51465476.0000 52881772.0000 72833640.0000 17245134.0000 56746528.0000 1373843.0000 33178256.0000 27131366.0000 53762116.0000 56015584.0000 56982692.0000 55634116.0000 41397948.0000 13642933.0000 31916618.0000 12874389.0000 25204720.0000 18840398.0000 61232992.0000 48139596.0000 53551316.0000 51808348.0000 68036104.0000 10651552.0000 14552267.0000 22021262.0000 21844758.0000 21187836.0000 L-Proline 130903008.0000 107429512.0000 129299520.0000 136415504.0000 138669504.0000 141085680.0000 150651296.0000 135953744.0000 132088664.0000 126647232.0000 243482224.0000 224746576.0000 212130544.0000 210289648.0000 227158288.0000 237448368.0000 206606384.0000 182352304.0000 198702144.0000 286840736.0000 230519552.0000 266069040.0000 250160320.0000 244373808.0000 247011536.0000 222515856.0000 350286208.0000 348705568.0000 342071872.0000 330844192.0000 308444128.0000 253741888.0000 222740096.0000 249734528.0000 278581728.0000 214153600.0000 216118000.0000 209545392.0000 205265872.0000 183363152.0000 367262848.0000 322624928.0000 324484864.0000 355113600.0000 280836768.0000 402266848.0000 173481552.0000 633479744.0000 1037134016.0000 550356928.0000 289410912.0000 274259104.0000 215519184.0000 220704624.0000 186229584.0000 248049744.0000 200903296.0000 127889760.0000 314799968.0000 347647712.0000 262095504.0000 250635152.0000 246878208.0000 229463248.0000 255180752.0000 269246944.0000 441129504.0000 46180644.0000 373996320.0000 361197152.0000 187614096.0000 181011904.0000 177865712.0000 181854064.0000 176632976.0000 102524184.0000 208528256.0000 96109288.0000 202058544.0000 176126896.0000 221599280.0000 203496368.0000 209014144.0000 166749568.0000 207234688.0000 158237760.0000 213214064.0000 262477328.0000 228761600.0000 233957360.0000 L-Serine 3270626.2500 2634445.7500 3338683.2500 3457815.2500 3017997.2500 3600540.7500 3510514.7500 3178509.7500 2950329.7500 2893735.7500 2778087.2500 1769258.3800 2859254.0000 2612841.0000 3057036.0000 2685374.7500 2925616.7500 3049235.2500 2151557.7500 2318697.7500 2572646.0000 1743283.3800 2528926.7500 2734888.2500 2846470.7500 2414708.2500 1901151.5000 1988337.6200 1769517.6200 1970317.3800 2895910.0000 2961539.7500 2717807.7500 3084898.7500 2756013.7500 3098468.0000 2525158.2500 2934160.2500 2901209.2500 3639078.7500 3521442.7500 3435222.0000 3490217.0000 3557465.0000 3186970.7500 2671379.7500 2447736.2500 2687909.2500 2600199.0000 2777585.0000 L-Threonine 14801003.0000 14187443.0000 11188921.0000 15067743.0000 28915016.0000 8310097.5000 13808087.0000 12952600.0000 16261587.0000 12536384.0000 5831680.0000 8317302.5000 5779877.5000 5290250.5000 4530677.5000 7010763.5000 2830307.7500 14808544.0000 43230788.0000 9814840.0000 8776799.0000 6691958.5000 4438010.5000 28247408.0000 32809656.0000 7165444.0000 14845500.0000 1777934.3800 11043062.0000 10161142.0000 5237939.5000 25548730.0000 4470930.0000 9033307.0000 9765529.0000 6652468.0000 7904508.5000 7559525.5000 7608706.0000 7426525.5000 L-Tryptophan 2241590.7500 1950606.3800 3942085.0000 2555185.0000 2199659.7500 3241835.7500 3007309.2500 3030004.0000 2706956.2500 2957258.0000 3222060.7500 1973141.0000 4158630.2500 3389829.2500 4446447.5000 2774127.7500 2265880.2500 1979808.0000 2689170.7500 4728565.5000 3774582.0000 5905535.5000 4857640.0000 3390444.7500 4138636.0000 1995893.6200 3119460.0000 2605608.7500 4033580.0000 3481994.0000 3343801.0000 2220619.2500 3932562.2500 3495971.0000 4185314.0000 1134630.5000 912043.5000 900545.3100 914455.5000 694529.1900 1896660.3800 1631579.3800 2396963.2500 1756712.3800 1888062.6200 1101038.3800 40965.3000 2225865.2500 4558275.0000 3079549.7500 3196089.7500 2636897.7500 2609528.7500 3529263.0000 2495206.2500 2187088.0000 1159644.5000 516586.1600 2874369.2500 3854653.2500 3107749.7500 2278720.0000 2473763.2500 2726741.7500 4245532.0000 1628032.6200 3829560.0000 2546273.7500 2593775.2500 3211175.2500 2793874.7500 3477278.0000 2789181.2500 2670464.0000 162876.1700 1942918.1200 683475.2500 1506310.3800 1575021.0000 3309464.7500 3426464.2500 3113428.0000 2748255.0000 3679878.2500 545836.8100 3124274.2500 994688.0600 1089680.0000 1136953.0000 L-Tyrosine 4402528.5000 3341059.0000 26932642.0000 15246001.0000 13423195.0000 18564862.0000 15916936.0000 10678521.0000 13628379.0000 12155975.0000 5185131.0000 4259252.5000 12046705.0000 9099890.0000 20575308.0000 2362332.2500 3735816.7500 3264577.2500 4626354.0000 5958005.5000 11179061.0000 15247585.0000 13371527.0000 11524968.0000 12275399.0000 1939038.3800 4540478.5000 3510816.7500 5126386.5000 5661653.5000 5267770.5000 4097588.0000 11232299.0000 12573417.0000 17089154.0000 2823582.7500 2590400.7500 2089771.0000 2400212.0000 1980065.6200 7658869.5000 5279868.5000 8835364.0000 7478425.5000 4498421.5000 3387794.0000 818936.5600 5794568.5000 14200604.0000 5834901.5000 5107605.5000 4380826.5000 7802098.5000 12093711.0000 7032460.5000 2573851.2500 2355093.2500 1518445.5000 8393968.0000 11110673.0000 9735883.0000 5095798.5000 6466421.5000 6741124.5000 10433372.0000 2611415.7500 5135904.5000 264610.7500 3939760.0000 4090183.7500 5224570.0000 4070383.7500 17859258.0000 9337076.0000 8628688.0000 700630.5600 4596191.5000 1835824.1200 2574994.0000 3337803.2500 13015829.0000 15566520.0000 8344603.5000 9225746.0000 17336680.0000 1485075.6200 8074953.5000 2278326.7500 2080334.3800 2673276.0000 MG(C16:0) [-H2O] M+H 305719.2500 97213.9800 45355.2600 118807.8400 204656.8600 51437.0100 75955.4100 100704.4400 59422.6100 53980.3800 273623.9400 326200.9400 80283.7300 165949.1900 209826.6400 18373410.0000 13558547.0000 7496208.0000 12504251.0000 5257546.0000 155613.8300 112595.3200 155004.9500 174449.8000 58606.1200 3181970.0000 3432534.2500 3978367.7500 3993031.0000 4747620.0000 148933.5800 208317.6400 142109.3600 261931.1200 134462.6900 3342368.7500 4596835.0000 9477708.0000 6673232.0000 6114004.5000 153039.8000 187598.8900 172079.7000 175941.3800 146226.2500 4460410.0000 2865589.2500 3831725.7500 3474602.0000 1610084.6200 259804.4200 451117.4100 223658.3800 154681.1900 361379.9100 7348147.5000 6265681.5000 12099877.0000 5042113.0000 3902895.7500 155486.6100 130814.7300 131957.2700 152652.3900 140602.3900 4566340.5000 6300996.0000 6092952.0000 4084694.7500 5189580.5000 605674.0600 292303.5000 417468.1600 349475.4700 398237.1600 1087478.3800 8630550.0000 2556151.2500 3791159.7500 10786153.0000 118403.2900 159729.0600 88681.3400 110671.3400 118650.0500 4362211.0000 7746642.5000 8054808.5000 7178954.0000 4746184.0000 MG(C18:0) [-H2O] M+H 65486.8600 60949.5600 64557.5300 92813.9600 63647.8600 51559.9900 51702.6600 37851.5100 69671.9200 51257.4600 34962.3400 86623.9600 40105.5800 88607.2100 52632.4600 228035.5000 242634.0000 173722.8800 249502.0200 237571.0000 124937.1900 95568.9700 115133.4600 146559.0800 83308.4100 1791042.1200 2578339.7500 2378778.7500 3321454.2500 3146106.2500 32660.7400 95038.6800 81137.4400 87274.5000 37828.7700 354756.6600 265643.5300 315029.1200 517186.0900 365632.0900 114996.3400 79691.4800 129043.6200 100788.0300 70458.9500 1716596.8800 3255262.7500 1864334.6200 2048317.5000 1858298.3800 78841.7300 56485.7500 243185.6100 73007.9000 71400.3500 322601.1200 291639.9100 245895.8900 173205.3400 210188.4500 106177.6900 107949.3700 71676.9100 123200.8800 73597.8700 1505833.1200 1904707.3800 1464739.0000 1635898.0000 1602587.1200 102939.7200 80633.7200 41733.4300 62804.1400 75468.2600 73147.9400 190448.2700 143897.7700 264023.7200 262200.8800 36269.5000 60793.0700 50504.5000 43052.3600 59111.5100 1289227.3800 1538556.6200 1888509.6200 1721853.0000 1229737.0000 MG(C18:1) [-H2O] M+H 63306.3600 62628.3200 44837.9300 55464.4200 62267.4600 52393.6700 26710.4300 50078.4300 70337.5200 49643.9600 105140.6300 138678.9800 74496.1400 126602.6300 107469.9900 17463506.0000 13199019.0000 8324572.0000 11625013.0000 5798253.5000 219190.9400 170397.7500 196628.5200 212980.2700 177027.2500 7735440.5000 10049994.0000 9676934.0000 11499581.0000 10247753.0000 162699.9800 51087.8800 93670.1600 111755.2500 81084.2900 6566734.5000 7734664.5000 14315455.0000 12042075.0000 10866187.0000 234102.1900 348662.4700 240332.0800 378029.8400 157680.9500 11647061.0000 12159611.0000 11113012.0000 9697212.0000 5311266.5000 98174.0400 118088.4700 171333.1900 113641.5200 153290.5300 10877059.0000 9068097.0000 15744877.0000 8060705.5000 5430193.5000 206356.7500 154189.6100 168008.9400 132650.5800 140351.5200 13302963.0000 14903565.0000 15882573.0000 14262108.0000 11441184.0000 73237.3800 94390.9600 62036.8100 74067.2600 73351.7200 1406734.0000 9221843.0000 3157075.2500 5482020.5000 12493931.0000 115895.0700 94906.2700 93755.5900 89988.2100 103266.3400 8194654.5000 12066485.0000 15176984.0000 13347113.0000 10962204.0000 NAD 4865139.5000 5137915.5000 3899230.0000 6968858.0000 12577241.0000 5103063.5000 10770676.0000 8721604.0000 7600917.5000 5298678.0000 5278448.0000 8642925.0000 4741416.0000 5560942.5000 5285639.5000 8834279.0000 4583968.5000 18333920.0000 46483100.0000 10967328.0000 10619721.0000 7288340.0000 5714960.0000 15385776.0000 18183032.0000 6785418.5000 13247984.0000 1404207.6200 12097744.0000 7507591.5000 2369523.2500 14291579.0000 3886769.2500 6091688.0000 5627020.0000 9112624.0000 10419981.0000 11820243.0000 11886017.0000 11890012.0000 NADH 181092.8000 286835.6600 159942.1100 377730.2500 671237.0000 273366.4700 579930.1900 468600.4100 363200.1600 234290.8300 276641.2200 479518.2500 281232.4100 345758.3800 335126.4700 358192.4100 223535.6700 1071803.1200 2545811.7500 848631.8100 658476.3100 422777.6600 209505.5200 950386.0600 1096673.6200 381770.4700 794910.6900 105865.1200 715743.4400 384720.6600 91871.2700 800765.5600 192555.2000 361805.0900 332749.2200 505361.5000 797782.0600 614938.0600 818516.1900 615947.5600 O-LPC(C16:0) 38452.7800 19080.0400 21120.7100 18232.2500 13442.8900 12220.7500 18652.1600 21215.1500 18288.8400 22593.0400 20834.7700 13364.2900 36020.5000 18438.5800 14847.7400 589323.8100 604137.6900 407060.2200 634526.5600 708815.6900 183750.8300 107953.5400 204394.3000 267881.9700 182241.8000 1393890.8800 1963410.3800 2316273.7500 2426295.2500 2459062.2500 56738.5900 35890.4500 40812.0800 29185.1500 52610.8100 1160275.0000 920714.4400 1300112.3800 1439351.0000 1512774.0000 451238.4700 530781.8100 498621.0000 506427.0300 419228.0900 4400093.5000 19935056.0000 8272572.5000 7878781.5000 5899385.5000 87172.0000 36011.7200 95237.1000 28360.8000 73936.7800 1431372.1200 1155596.7500 1047751.0600 1042232.0600 1021658.8100 223884.8900 153635.5500 131373.4500 211694.8800 164931.7500 3202162.0000 3257514.0000 2453830.5000 2993079.0000 2641483.2500 20203.2600 61001.9700 23713.0500 12430.5800 13390.6800 28216.3800 507624.5900 240612.8600 705265.0600 854743.5000 180835.8800 93949.1600 121439.8800 88293.8700 72545.5700 1664909.6200 2525032.2500 3437150.0000 2559270.2500 1664456.1200 O-LPC(C16:1) 17865.6900 8335.2100 3859.1700 17749.2400 5825.8400 4023.2000 34989.8200 8796.4500 20911.7800 22747.3000 6890.8400 18289.9900 284319.5000 257793.4200 36570.1300 364619.5000 409354.0900 76962.6200 2894181.2500 4834041.5000 4401362.0000 6667584.0000 5988602.5000 4892.6300 3508.6700 56301.4100 8806.2900 339601.8100 490546.2200 55182.2500 304061.0900 686673.9400 488773.3800 449773.3800 362543.4700 369086.9700 271740.8400 7345572.0000 37642400.0000 18948982.0000 20359994.0000 16028885.0000 29198.4700 56833.6700 15324.8200 36257.7400 208025.0000 254741.5200 14210.9100 378835.5900 777753.4400 119042.5600 61680.7700 183086.8800 449510.0900 275074.5900 6314009.5000 4577420.5000 3888833.7500 5042096.0000 5858967.5000 10053.1600 5324.5000 7974.9400 20529.7600 95438.2000 63540.1600 364848.2200 131167.1400 55405.2900 61292.1200 51398.2600 31131.8600 1769614.1200 995262.3100 1532787.6200 1529957.1200 1323728.6200 O-LPC(C18:0) 30220.1500 17900.0400 20575.4700 19859.9700 20935.3700 35983.0300 26470.7700 15079.6200 21693.7500 26963.2900 29157.3400 15059.7000 35978.5600 25271.5300 23229.0900 310464.8400 307130.6600 248020.8000 301571.0900 307473.7800 51021.1000 45855.1300 65990.8000 87429.0900 54274.5500 651381.3100 791404.5000 1021821.1900 1029608.5600 850525.2500 16323.6300 27739.9000 21734.2000 20036.6700 29074.4800 372528.2500 324273.9700 421229.9100 441922.4100 491500.2500 125010.9800 134424.5000 125699.2100 178181.0500 104751.9400 2021743.5000 9276691.0000 3227159.0000 2937920.0000 2426775.2500 38502.9100 25384.4400 21784.8800 26189.7500 38308.0400 611498.0600 415819.0000 447455.3400 380779.3400 423535.5900 63489.3600 48297.7300 56899.4500 64574.8900 47907.3400 1249397.3800 1126809.1200 868070.6900 1050858.3800 943509.7500 25617.6300 30963.9400 18749.5900 19736.8800 9068.9200 71444.4000 181936.3800 93733.7300 246938.2000 284101.7800 77409.1000 27580.4800 29567.4300 31501.3500 45507.2900 729010.7500 948186.5000 1216325.8800 916364.0000 659236.0000 O-LPC(C18:1) 26706.5200 56269.5900 45945.4100 51558.4600 31529.7600 890263.6900 792428.1900 643600.8800 754219.9400 680656.3100 211847.1700 96895.1800 191328.2000 256525.2000 152925.3800 1354784.6200 1718879.5000 1918230.6200 2285169.0000 2167322.7500 63533.7500 49397.2100 50338.3600 19794.3000 35931.7900 1069177.5000 1017779.9400 1297758.3800 1391433.1200 1315524.3800 320196.6900 344019.7200 327244.1200 790265.1900 247719.5000 3046861.0000 10371304.0000 6039390.0000 5607034.0000 3926641.0000 76547.8800 56051.1900 107461.9000 65871.7300 76419.1500 1411560.1200 1248374.5000 1263743.6200 1114168.5000 1045634.0000 120127.1200 93842.5600 72809.0900 149530.7500 91333.5600 1934149.1200 2139171.2500 1610532.0000 1976362.6200 1736469.5000 31001.7300 41177.7900 30294.8300 36616.4700 26360.4900 152803.8300 569785.3100 299280.1600 714749.8100 917121.9400 48662.8300 48010.4500 41393.8900 40782.5600 36967.6900 1421918.8800 1935424.5000 2572031.0000 2139063.7500 1423473.0000 O-LPC(C18:1)_1 7874.1900 29389.3000 9736.1400 7492.9700 10082.6900 5908.2000 6155.7800 98290.7500 87004.0100 80983.7700 99556.7800 196586.0600 78976.2500 21399.1300 84333.7000 121106.4800 35924.1400 766626.5000 1315865.6200 1259674.5000 1869751.3800 1832293.1200 3125.9000 12288.5000 381543.6600 282574.2800 227372.3300 387042.5000 372068.5300 118621.2900 96842.4800 58835.0100 127733.0000 80538.1700 2524724.0000 12159381.0000 6508906.0000 6911978.5000 5509612.5000 10283.7700 35700.9800 49741.0600 7204.1200 3302.8100 298526.0300 247988.4800 116621.6200 219259.9200 266640.0300 49245.7100 20830.3300 73606.0000 107976.8000 60905.5700 2071769.0000 2207823.2500 2034339.0000 2068411.8800 2029751.0000 6509.4800 5212.0200 14305.3600 43545.6900 31056.2000 85262.7000 64073.7900 42529.4500 33084.3900 29750.0100 11913.6900 11444.8600 846595.6900 908049.5000 1420579.5000 1132149.3800 890557.2500 O-LPC(C18:2) 11795.4500 19525.2900 7956.6900 28778.9400 12182.3700 150389.6100 201593.8800 260083.3800 414724.5900 92316.6600 13119.4600 139605.7700 146650.1100 18901.5400 1168807.5000 1857445.6200 1662178.3800 2984947.2500 3285564.0000 14576.6500 10773.0700 16533.5100 24282.2000 666192.5000 429894.0300 530258.9400 613889.1900 606136.7500 197074.3800 136422.3300 102800.6200 126235.7300 109467.0500 3006023.0000 13627367.0000 8071002.5000 7950104.5000 6450296.0000 23748.9600 15463.8800 60130.1700 11068.5300 683584.3100 590994.6900 214300.0600 557228.1200 662851.8100 68708.6600 19377.4700 64837.5000 175188.9400 65200.8800 2988856.2500 2822398.0000 1898630.0000 2397407.5000 2964684.2500 11916.2800 88585.4100 70937.6800 95760.1500 268214.6600 141090.0200 11153.1500 25701.7000 17708.5700 15625.2900 14225.1700 721695.2500 641971.7500 910222.2500 743985.1900 736004.8100 O-LPC(C20:3) 2470.2700 3031.1300 2090.4600 1415.8900 2441.7400 1423.7100 1920.9700 1441.9500 1591.7500 57227.8200 42964.7300 26277.6000 34165.4500 43973.7900 2698.8900 2243.1500 833.2400 1327.2300 59685.2100 149785.1700 130631.6000 159739.6100 123207.3400 1986.6800 63404.0400 32496.2500 64907.1400 80322.1700 71515.4900 7017.8400 11561.5000 5629.5300 883.4600 7571.5500 317305.8100 1717223.8800 577631.0000 513902.7200 406017.4700 1220.7400 1387.9700 92151.8400 71385.0400 59593.6200 85625.1000 70396.7400 1780.6500 5680.0400 1429.2200 6522.3100 1984.9600 193081.0200 211400.0800 130650.0500 197823.1700 141752.4200 1923.7400 1512.5900 1870.2400 1571.0400 10056.1900 34093.3300 17265.5500 2607.8400 2664.1700 94259.6900 155158.0200 200026.5500 148198.1700 90190.2900 O-LPC(C20:4) 5493.2800 20077.5100 54556.1400 37343.2900 60375.0000 32246.0900 17049.4400 6083.0100 12810.0300 29586.8800 8291.8800 176801.0000 307593.5300 262460.5900 137233.1400 259776.2500 123431.9100 128782.7200 112695.0600 139520.1700 92130.6300 24351.6600 41503.7000 31542.2700 48888.0600 12119.9700 237934.4500 1566714.0000 709476.6900 816941.1900 604566.9400 13381.5400 10017.7100 70901.1300 152074.8900 150842.6700 214322.0500 126133.4100 9647.8600 9708.6000 7414.8300 303136.5000 325682.2200 47590.9800 180386.1700 109767.8800 13981.8900 19513.8400 26327.8300 81918.2000 146525.2800 3147.3300 79331.5000 161459.5000 212803.5000 268204.5000 103954.2500 O-LPC(C20:4)_1 38593.0400 11188.2800 112825.5700 141472.5300 188059.1400 262295.6600 284945.5300 3660.0000 67801.2900 36790.1900 26637.8700 45463.7400 34831.8900 8326.4800 10257.1500 7679.3800 370756.0300 2105463.5000 965326.5000 1073761.6200 882573.5000 14061.1400 25075.3700 13982.0500 35784.5000 9267.4200 7948.2900 296647.7200 279983.8400 259272.1700 246507.3000 296719.0900 9545.3600 6689.1400 97560.8400 82567.2300 146303.3100 156215.9500 104968.3700 O-LPC(C20:5) 11972.5700 20223.1000 38293.2900 4142.9800 138450.4800 216360.1900 172502.8000 388442.3800 318562.2200 59137.4600 34474.1200 39271.1600 23007.3200 29616.5200 7426.0900 8989.8200 307967.7800 2007200.6200 916637.3100 1115377.6200 959396.0600 9128.5900 21319.0600 58174.6700 16665.9700 43781.0700 56725.1800 7021.4400 8196.8400 10378.5800 354211.6200 364640.5900 218745.5800 313196.8800 358429.7800 7551.9300 40691.2200 8987.0000 77139.9800 73361.4800 91071.3400 78413.9600 92428.8400 PC(C28:0) 13688.0300 20389.0000 3630.2100 43830.1600 16852.8400 26681.4900 38884.2600 405482.1200 485259.0300 460478.7500 553680.0000 429330.0000 82615672.0000 86302656.0000 79485752.0000 82912648.0000 93977224.0000 711698.4400 380748.5900 717364.8100 614522.8100 662512.6200 360382592.0000 561276480.0000 573881600.0000 650669696.0000 640968640.0000 598963.0000 540488.0600 555024.2500 629324.9400 594656.3100 139505136.0000 92743608.0000 134611344.0000 154110304.0000 172374656.0000 670748.9400 740217.1900 632567.6900 764801.6900 601085.1900 547259584.0000 728226368.0000 631808256.0000 1111331584.0000 748631360.0000 664276.0000 529635.9400 912028.1900 520164.3400 453948.3400 182318720.0000 168828656.0000 81750680.0000 95029320.0000 147367264.0000 394885.2200 481192.6600 533888.5600 585046.9400 440571.4100 550968128.0000 682316224.0000 490342656.0000 684867008.0000 482185728.0000 506520.8400 527569.7500 446676.6200 421230.1600 578633.0600 34241952.0000 89504768.0000 56594796.0000 108824768.0000 129144648.0000 243528.3000 42308.6700 165706.3800 157458.8600 173983.1100 202618800.0000 298043904.0000 404268928.0000 280920992.0000 221923024.0000 PC(C30:0) 182467.8000 34131.5800 234946.6700 51002.2900 53050.0200 47983.8600 53172.3900 57106.8600 10469.2300 18269.9900 2285731.2500 2959025.7500 2548197.2500 4477536.5000 2585824.2500 521631488.0000 542685632.0000 535406560.0000 577806592.0000 626616320.0000 10918439.0000 5611817.5000 10254373.0000 11834969.0000 7094442.5000 638704320.0000 679832256.0000 707771712.0000 748937024.0000 745513984.0000 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165696.0800 70820.6500 136021.9700 215227.0000 42218172.0000 46489276.0000 51705476.0000 55273708.0000 48316836.0000 52668.4100 32203.7700 19365.8300 80134.3600 38136.2000 12882371.0000 12021799.0000 4397244.0000 9267954.0000 13373680.0000 85190.5800 138433.8600 158208.4400 382429.5900 103046.7500 45514948.0000 46765712.0000 41591676.0000 38408684.0000 41190592.0000 108698.7500 53839.0800 58775.0500 58188.3800 25891.5900 5880305.5000 7926821.5000 7260738.0000 13353057.0000 9534333.0000 96320.3400 61799.5900 93581.7700 153007.4400 78667.8400 30502960.0000 25072554.0000 30165674.0000 34632240.0000 33615724.0000 PC(O-C34:0) 9610107.0000 10471786.0000 8717612.0000 11564097.0000 14947737.0000 25598.5200 30336.6600 18271.8700 65020108.0000 69402240.0000 78307896.0000 87023296.0000 89781472.0000 9944.8700 24161298.0000 19370082.0000 26104586.0000 30504778.0000 31784186.0000 79761.4500 34306.3000 74796.5300 110077.9900 30179.1800 92206472.0000 147096832.0000 140094192.0000 156081952.0000 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269326.2200 244535.0600 169172496.0000 170985104.0000 128320896.0000 130641856.0000 158603616.0000 1041242.5000 614428.4400 710611.5600 890076.5000 448452.5300 242032720.0000 279008256.0000 247560000.0000 251795056.0000 239534720.0000 148669.9200 154837.8000 134900.3400 118868.8000 198412.4400 71451048.0000 173005456.0000 114454664.0000 199131152.0000 190712768.0000 537295.8100 297032.0000 354889.5900 327472.9400 327059.7500 218792336.0000 281203168.0000 316346784.0000 297902592.0000 259830576.0000 PC(O-C34:2) 8373.6700 3125.3500 3918.3700 820.9100 4039.3100 2345.1200 6069.6300 9591.1500 9267.5600 4266.1700 30893.0400 24596.1700 22186.3700 61776.2300 15604.4000 5603442.0000 18369062.0000 30571296.0000 28806554.0000 55373388.0000 310074.3400 118582.5300 333238.0000 432335.1200 109007.9800 170568624.0000 213635920.0000 184826192.0000 203568464.0000 215873008.0000 45145.2700 36363.0700 18957.3800 30423.5800 100843.2900 83474312.0000 59280544.0000 57542432.0000 79861064.0000 76776600.0000 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9790887.0000 128400.0200 4878712.5000 3956149.2500 1158169.1200 3740685.7500 5089372.5000 27446.5300 11702.4000 35191.8600 8318723.5000 8433461.0000 8195744.0000 7571826.5000 7428028.5000 2082135.6200 3466076.7500 3091581.7500 5829981.5000 3751062.7500 18069.6100 6986833.5000 5736296.0000 6589926.5000 6565436.0000 7433614.5000 PC(O-C36:0) 794266.2500 750407.6900 652646.5000 843547.6900 1467931.5000 3675783.2500 4740254.0000 4678702.5000 5439628.0000 4434842.0000 2569723.2500 1768378.0000 2030616.1200 2813914.7500 2702984.0000 5821450.0000 11191831.0000 7726200.0000 8872403.0000 8352533.5000 8019.0400 3010644.7500 2856303.7500 1270233.0000 1557452.6200 2077418.8800 10069419.0000 7436032.0000 6505394.0000 8141744.0000 5598400.0000 221659.0600 921573.0000 720393.3100 2185983.2500 1736183.1200 2825434.0000 3358059.7500 4644712.0000 2722337.7500 3031330.7500 PC(O-C36:0)_1 190043.4200 192079.7000 121721.8400 141164.2300 287889.9100 1177511.8800 1487093.5000 1863315.3800 1883739.3800 1598301.1200 374229.0000 335986.5900 403011.5900 461046.7500 427318.4100 2608099.2500 4990442.0000 3714109.7500 4857489.5000 2788302.2500 506063.2200 403520.9700 170685.3900 291156.7200 489670.4700 3592075.2500 3094940.7500 2615545.7500 3409949.7500 2225777.2500 33998.1300 201771.0000 167755.7300 445354.6200 351068.8400 1000347.2500 1455651.1200 1702820.3800 1464445.8800 1055825.3800 PC(O-C36:1) 10303.1900 8422875.0000 9906547.0000 8016736.5000 9564154.0000 15804491.0000 43971972.0000 50357100.0000 57557476.0000 62840420.0000 56918476.0000 29513496.0000 18185664.0000 26881672.0000 32140224.0000 32563378.0000 31016.8300 35206.9900 34373.1500 39726.1300 67684648.0000 152496992.0000 105806280.0000 120314216.0000 93997672.0000 22145.8000 109678.4000 37955236.0000 29475278.0000 12270256.0000 18581442.0000 28104882.0000 20577.9000 40436.1500 115366616.0000 97909280.0000 84786200.0000 109507456.0000 78754504.0000 42941.8000 3565672.0000 14796232.0000 9023782.0000 24294128.0000 21669040.0000 21148.5600 30725598.0000 40542924.0000 54024076.0000 40733148.0000 38270960.0000 PC(O-C36:2) 22345.5100 16040.2100 15283695.0000 16513628.0000 15094771.0000 16952324.0000 19430094.0000 107045.1500 23957.7400 65543.3100 127780.1200 47991.6200 17075618.0000 18270098.0000 17654212.0000 17511376.0000 18782392.0000 20168.2300 36287.9700 31412.7600 30954030.0000 25055550.0000 32469704.0000 34069716.0000 34641900.0000 130396.5900 87343.2900 119547.7500 328712.4400 72126.3500 27397104.0000 38264812.0000 33305040.0000 32637744.0000 30190218.0000 63738.4500 46089.1200 151442.4200 30067.5500 34114.7100 33799196.0000 28661520.0000 20683710.0000 23566166.0000 25337472.0000 111919.3200 47447.3000 60892.7500 91354.0000 53722.6400 25136018.0000 26269490.0000 25302968.0000 21060144.0000 25489678.0000 14894.1500 20425.4400 12253292.0000 26291928.0000 20715410.0000 33448342.0000 28256474.0000 33571.1300 27687.7000 28497.7900 22326142.0000 22476894.0000 27736272.0000 20686488.0000 24554736.0000 PC(O-C36:2)_1 33367.1800 12944.5700 157087.2000 6372.2700 196609.0600 13343.4400 13405.5000 143835.0000 29087.0800 23656.2600 19205.0300 14429.8300 7813959.5000 9467557.0000 8727682.0000 9131387.0000 21052928.0000 35482.7100 27513.5600 50863.3400 50552.6700 63893012.0000 87078712.0000 89937376.0000 101109640.0000 103194008.0000 13756.3000 13868.5500 10493.6600 41532824.0000 23543110.0000 24311350.0000 39220604.0000 34111352.0000 33767.1300 49804.8100 29492.5500 223073.9200 32933.4200 100604936.0000 164942320.0000 165460272.0000 186696016.0000 141223488.0000 739989.0600 712515.5600 8201.0300 17104.3900 42226668.0000 35870196.0000 11455197.0000 23313514.0000 38522100.0000 43479.8600 31277.2000 48504.7400 29789.7000 152952832.0000 163153120.0000 127677640.0000 150000832.0000 119813312.0000 7104.5600 22183.0700 12651.2000 7398676.0000 15474680.0000 9359983.0000 22256502.0000 17338618.0000 24982.5400 31035.8900 15694.8700 43175276.0000 45818020.0000 69579032.0000 57646368.0000 54118416.0000 PC(O-C36:3) 12389.1700 12814.2800 11989.5000 11165.8300 11497.4100 4605935.5000 11560289.0000 15325809.0000 15399155.0000 29732664.0000 31293.2700 14757.0900 101716.6000 94589.9300 29970.1500 44046532.0000 55959612.0000 49789748.0000 50561236.0000 58569636.0000 9595.1900 20333.2000 15809.8900 16731.0100 42894692.0000 29592030.0000 28261952.0000 42550944.0000 36516800.0000 134212.5300 84182.2200 44294.9100 864973.2500 72206.3400 61966224.0000 74717176.0000 87094720.0000 93093056.0000 67433080.0000 16400.8700 23887.5000 134403.5200 13265.0100 19818.7700 37812724.0000 38992112.0000 13208559.0000 29905536.0000 40945076.0000 94122.2000 60522.8000 75422.3000 150463.4800 47306.8800 68592056.0000 79747104.0000 71377280.0000 71050328.0000 71398104.0000 15116.7300 10372239.0000 18558542.0000 16057723.0000 29917594.0000 24186656.0000 24643.6800 12346.9000 5318.5000 15650.2300 40433108.0000 31867888.0000 45425184.0000 39904160.0000 45247500.0000 PC(O-C36:4) 102342.1200 127846.7000 132857.4100 108804.2300 99168.6600 139512.8900 106699.7400 190659.8800 88647.6900 199468.1200 112870.6200 147459.8900 137686.0900 121256.8100 106468.4800 2949318.2500 2356959.2500 3083193.2500 2688580.5000 3634468.0000 525775.8800 344127.6600 374262.9700 644989.1200 392724.9100 6131778.5000 6507733.5000 6746858.0000 5012260.5000 6098750.5000 97233.6200 125564.5500 81820.6800 106352.9100 106148.0200 5235933.5000 4694911.5000 4754451.5000 4568144.0000 4835126.5000 658303.8800 614825.5000 701542.8100 582471.6900 275286.8800 13220749.0000 14576647.0000 13283968.0000 12844381.0000 11627863.0000 137186.1900 157971.2700 252641.0000 76063.9000 112499.0000 4135285.0000 4082233.7500 2570053.2500 3107448.7500 3693244.7500 397329.2500 394205.4100 436333.0900 486391.2500 222883.8800 5506476.5000 7075314.5000 5414999.5000 5251056.5000 6971836.5000 123914.4600 86180.0900 148694.1900 109826.7100 118679.3200 1664964.3800 2432220.2500 2659760.0000 5011390.5000 3477886.7500 329257.7800 137335.8900 194046.8300 143707.5200 133846.3000 8144816.5000 9086071.0000 10309018.0000 8551383.0000 8277256.0000 PC(O-C36:5) 157268.2700 74043.5300 410879.9100 63150.4200 89969.9600 56854.1100 27553.0600 20544.7200 39293.6900 50405.6400 409106.1600 577646.9400 401843.1600 991871.4400 413023.2200 1121546.6200 2122795.2500 5056076.5000 4994724.5000 9640957.0000 2808488.0000 1486747.0000 2458247.2500 3203178.7500 1748447.6200 29994038.0000 34712852.0000 30556504.0000 32584442.0000 34965004.0000 700700.5000 629846.3100 575978.3100 465829.2500 534972.5000 12894104.0000 8377818.5000 9764568.0000 13166633.0000 9464044.0000 2357019.0000 2431806.7500 2431212.0000 2490955.0000 1965904.3800 57577136.0000 55990940.0000 64450316.0000 75185904.0000 53123408.0000 889213.6900 538589.4400 1218410.1200 794500.0600 711644.9400 8534380.0000 8180590.5000 3385862.0000 5269112.5000 9477593.0000 2058191.3800 1822193.6200 1519315.8800 2746988.0000 1474541.8800 27524342.0000 33917996.0000 30943574.0000 22262848.0000 35516684.0000 314900.9700 403390.6200 424814.6600 224826.3300 426012.1200 3378187.2500 4787031.5000 5155929.5000 11596220.0000 7472108.5000 1402749.8800 939246.0000 1216093.6200 1034407.0000 1091598.2500 33936452.0000 25959360.0000 30656170.0000 30589638.0000 33235656.0000 PC(O-C38:0) 25669.0500 20651.8300 28941.8300 21540.2800 142298.0800 219165.9500 253288.4400 247016.4800 201591.7000 319488.0000 98271.2600 58015.6100 116092.7500 99187.6600 233202.5500 673035.3800 1039263.1900 763479.1900 961226.5000 638419.8800 305014.6600 205491.9500 106622.0400 70637.6000 166539.8900 688285.6200 647041.8800 553726.5600 682930.3100 420019.4100 39226.4100 23344.0300 87880.1300 196266.0000 100256.8100 233307.5000 281067.0000 256831.9200 182233.8800 PC(O-C38:0)_1 21165.2900 21830.8800 127022.1600 157755.7000 159507.9700 153679.0200 177717.9400 40823.6100 47522.6700 35750.0100 30271.6300 1199237.2500 1439202.1200 1027705.1900 1647069.0000 872250.1900 19667.2700 35985.1200 33888.6400 41975.5900 27082.4100 29610.0900 332998.2800 299781.2500 179552.0200 337805.1600 186312.0000 20282.9300 45937.1700 12818.3500 92844.2200 60968.0400 117015.0200 152010.7300 39516.4200 PC(O-C38:1) 20287.2400 24909.2700 580768.8100 794840.5000 467108.8400 736904.7500 1169404.1200 26438.9300 1707747.3800 2251647.2500 2776498.7500 3129476.0000 2853922.7500 2010111.0000 1164797.7500 1771381.3800 2150944.2500 1902368.1200 6788.4400 7763102.0000 12192579.0000 11119169.0000 16817866.0000 8313333.5000 13493.0100 7628.1400 3182472.7500 2198016.7500 1160377.0000 1494369.5000 2311654.2500 11147607.0000 8442442.0000 5910337.5000 9719747.0000 4883880.5000 14891.4500 43000.2600 336887.0900 891270.5600 512983.7800 1706394.3800 1304796.1200 13957.5500 996683.0000 1625393.6200 3043507.2500 1952714.5000 1629418.6200 PC(O-C38:2) 4220835.5000 4859706.5000 4107679.2500 4867940.5000 7225369.5000 6200917.5000 7793843.5000 9664219.0000 11180493.0000 10489210.0000 9256899.0000 5932799.5000 8537940.0000 10493649.0000 8982383.0000 10907783.0000 21115546.0000 18481634.0000 22780554.0000 15480363.0000 22331.4000 15364791.0000 12683440.0000 5705609.5000 7945447.5000 12016813.0000 20454646.0000 20193094.0000 17916064.0000 18877206.0000 16484416.0000 191357.1400 5604189.5000 3109165.2500 8530584.0000 8544406.0000 4019462.7500 7064250.0000 9455143.0000 6772928.0000 4798511.5000 PC(O-C38:2)_1 318781.7200 134622.0300 1032657.5600 1168539.3800 2040148.5000 4669404.5000 6327467.5000 7468111.5000 8751205.0000 7320010.5000 3374445.2500 1782180.0000 2516464.7500 3493030.7500 3217318.7500 39374.8500 8735927.0000 15503679.0000 15030105.0000 19488352.0000 11166943.0000 92772.1500 79225.5200 5256547.5000 4472662.5000 1112434.6200 2837918.0000 4728913.5000 19323182.0000 17507024.0000 15237588.0000 18324202.0000 11973441.0000 1653681.3800 1223556.0000 688142.9400 2422076.7500 1902893.8800 37014.2400 3108087.7500 2677960.2500 5390200.5000 4559020.0000 3654164.7500 PC(O-C38:3) 14450.6300 14454.7300 45269.2300 66481.3100 82626.8100 51182.9500 8520.4600 32865.4600 12689.3000 7059394.0000 7673182.0000 7599144.0000 8252421.5000 11591477.0000 30474.3400 20293.5600 15622200.0000 23269166.0000 22267808.0000 26177994.0000 26016042.0000 13937.3900 16175.1600 17100526.0000 8177776.0000 10303525.0000 16518820.0000 15339216.0000 13117.4800 13443.0900 71128.7100 86855.0300 28736230.0000 48698868.0000 49096620.0000 61679836.0000 39808192.0000 258171.0500 184580.0800 12172.7400 23596634.0000 21917756.0000 6336070.5000 11695907.0000 21202040.0000 46742896.0000 52808004.0000 43281664.0000 47855328.0000 41009800.0000 12678.2100 2826902.7500 8308406.5000 5438600.5000 11245796.0000 11414035.0000 8617.7500 11889104.0000 15035933.0000 22539472.0000 17468874.0000 14443541.0000 PC(O-C38:4) 7537.4600 13363.1900 41905.9200 20377.4600 7733.3700 8806.3400 7609.5200 15388.2900 15538.5000 7503.1200 5602510.0000 6096714.5000 9328113.0000 8961763.0000 14182979.0000 27217.3200 22930.6300 76766.8800 36777.4600 50527.5700 10840599.0000 14691472.0000 12321476.0000 16771373.0000 17259238.0000 10780.8400 13666432.0000 9133377.0000 10164365.0000 14192540.0000 11971736.0000 50846.0000 97761.0500 64453.0600 67273.4600 48331.2100 21221150.0000 29845968.0000 27012328.0000 35933420.0000 25673906.0000 344585.5900 13269715.0000 14151835.0000 5589126.5000 9454823.0000 14599808.0000 62976.6000 20814.8100 7292.1400 65767.5700 16186.8900 22640104.0000 31266934.0000 27209880.0000 21815710.0000 31583152.0000 6049.1100 13090.4700 4638789.5000 7807922.5000 7261604.0000 11768408.0000 9537039.0000 22390.7200 16455.9800 20784.4300 21078.0000 12642227.0000 14186855.0000 15822481.0000 15531113.0000 13290916.0000 PC(O-C38:5) 154728.8300 155592.4500 186033.2000 115035.4300 163982.8300 187917.2300 244363.2300 239754.1400 151016.8400 219264.8300 138588.8100 188270.9200 235618.2300 169890.5200 145610.8000 3248012.7500 4385384.0000 7993046.5000 8578855.0000 12776348.0000 74896.9100 135894.0500 153913.7700 169209.7000 109326.0400 17524542.0000 25355808.0000 21370376.0000 24239384.0000 23999366.0000 138652.3600 128450.6500 146009.5000 170212.4500 143302.0500 17635710.0000 13055253.0000 12060343.0000 15651252.0000 14839600.0000 190107.8800 129667.3100 169896.0200 205487.5000 110689.2300 29756442.0000 33383344.0000 34224324.0000 38916368.0000 32158728.0000 120800.7600 133897.0600 333527.7800 149746.3000 217137.8800 13377717.0000 12588323.0000 4068287.7500 9285944.0000 11735388.0000 150696.6100 111594.1500 207639.7500 173336.2300 121465.5000 23520544.0000 30004942.0000 26512866.0000 23690326.0000 29375902.0000 113212.6200 113393.9500 208518.6400 185144.8800 170380.7500 3912673.2500 6389604.0000 6268858.5000 11008604.0000 9833853.0000 152921.2300 182213.2500 181532.0600 97332.7100 186067.7700 17536392.0000 14427235.0000 18046096.0000 13658520.0000 15651200.0000 PC(O-C38:6) 151329.7000 182252.3100 154126.9400 255853.6900 110628.7500 164056.5200 234573.2500 269350.2500 227424.1900 228329.1100 208255.8100 208457.7500 440978.7500 218645.8100 243674.8000 1948729.0000 3826597.2500 6539614.5000 6157648.0000 10255238.0000 262753.1900 137297.6400 156740.5500 106186.6600 244677.0500 17100090.0000 22455392.0000 20741912.0000 24101798.0000 24089654.0000 187402.2700 181469.6200 178738.0600 336379.9100 171313.4100 14806977.0000 12643309.0000 11912747.0000 15092331.0000 12262248.0000 217869.5200 167811.8600 157963.5200 148150.7700 228648.6900 31131382.0000 28355408.0000 35029536.0000 35335228.0000 27855376.0000 122374.5400 145374.1400 165115.8600 115306.1200 245171.2300 10944867.0000 10211647.0000 3975929.0000 7285762.0000 11984323.0000 270044.4100 332717.5300 183783.6700 320166.6200 185525.0000 25156102.0000 27704634.0000 26702530.0000 19396366.0000 27801816.0000 250199.4500 257860.9800 170666.6100 155859.0300 273404.3400 3121080.7500 4470014.5000 5336124.0000 11521037.0000 7124227.5000 222708.0600 174719.6100 192557.0000 158909.9400 333407.3100 18398890.0000 12671421.0000 17304684.0000 13959720.0000 16033756.0000 PC(O-C38:7) 34038.9900 29473.2000 32785.6000 33035.5800 40783.4900 32615.5800 20734.9200 17764.3700 29349.9700 31027.9900 29257.5400 23192.1400 33941.3300 18419.3000 20092.0900 124796.9100 563375.8100 1061583.8800 473159.2500 1270542.6200 55221.8600 22776.5200 25291.7100 32555.7100 30507.5900 3131007.0000 3330872.7500 3374159.0000 3783925.2500 3410165.7500 39356.9200 32667.7900 31441.5900 40234.2700 30398.6400 1303675.3800 1149100.0000 1181531.8800 1418401.3800 1142655.8800 38286.1800 43133.4100 29911.0400 45351.6400 38534.1900 6385792.0000 6649284.0000 6847030.5000 9171885.0000 6857153.5000 35034.3500 46414.5200 257383.6200 20627.2600 27993.6900 914137.8100 1159142.3800 616083.9400 877617.3100 1179934.2500 26833.6500 23368.1900 82128.7900 56531.6400 30261.1000 4403306.5000 4497792.5000 5246928.0000 4890761.5000 5799732.5000 35530.6100 37054.2500 42005.0900 24793.0200 322858.6900 656900.8100 777794.7500 887186.0000 675761.8100 22660.9700 21468.8000 32190.2300 35501.5900 1880691.3800 1733109.3800 1834106.3800 2854237.2500 2219756.0000 PC(O-C40:1) 65179.5900 77505.2000 54843.8100 114389.7800 140788.9500 244112.2700 241402.3100 323630.2200 223088.5000 279428.0000 323416.8400 174865.0800 275435.8800 285116.5000 262037.2000 24587.8300 8380248.5000 8113700.0000 7911744.0000 12258932.0000 5594073.5000 16371.1700 281090.9700 245030.8300 147811.5500 171340.5600 284980.6200 838147.5000 842332.9400 363094.7200 650957.2500 307174.0900 89054.1200 24569.1300 269655.1200 199382.4800 9135.1400 277368.1600 144078.5300 295223.8800 280966.4700 166352.2700 PC(O-C40:2) 216191.3800 371604.8400 284149.0900 273258.2800 462361.4100 617819.5600 807802.8100 1080346.1200 923564.0000 1077203.1200 902917.5000 460055.6600 899494.4400 1001317.5000 801763.7500 5634774.5000 13014544.0000 6942474.5000 9658505.0000 4447675.5000 1302369.6200 962171.4400 404057.5900 587224.8100 852387.8100 2658869.5000 2537382.7500 1977158.6200 2532798.7500 1518605.8800 144327.0600 339538.2200 230311.9800 736654.5000 777066.3100 725478.4400 683763.6900 1140715.5000 982102.5000 747565.8100 PC(O-C40:2)_1 8571.4200 137514.0600 92665.7300 69977.8400 169414.5600 197802.6400 308059.8100 334373.6600 538214.6200 457756.0900 526405.0000 287604.3400 182699.8900 283305.5300 372925.0900 315099.3800 12495.9800 24345.2400 2957401.0000 3419294.0000 3392137.0000 5295919.5000 2361058.2500 6485.7400 5793.2500 387282.0900 388895.3400 137582.3900 226375.4800 394498.5900 1229936.0000 1314898.3800 847462.1900 1159696.8800 804962.8100 34294.2400 175467.8000 75055.0500 244911.0500 208198.8300 215872.8600 267769.0900 427011.8400 395371.1200 338738.3800 PC(O-C40:3) 9247.0600 1466334.0000 1800152.0000 1580453.3800 1796079.0000 2438821.2500 2543046.2500 3712087.7500 4353875.0000 4952879.5000 4843872.5000 3072065.2500 2204745.0000 2821091.0000 3588473.2500 3207063.2500 5989241.5000 8616483.0000 8214896.5000 12051597.0000 6128152.0000 17457.5800 51643.7300 4685329.0000 3796177.7500 1949731.6200 2469023.2500 3878275.0000 6640529.5000 7469834.0000 6368772.5000 7756118.5000 5044786.5000 580938.3100 2284547.7500 1402352.3800 3613915.2500 3313032.2500 2382098.0000 3352487.0000 4131785.7500 3552132.2500 3005451.0000 PC(O-C40:4) 14051.7800 5675.5600 11603.1700 5842.3100 8520.3300 5202503.5000 5122119.0000 4843374.5000 6188930.0000 7664395.5000 8401.2400 10238701.0000 13027712.0000 13975100.0000 16435099.0000 14717724.0000 9237653.0000 6914764.5000 8909143.0000 11304761.0000 11194753.0000 6711.2300 21586972.0000 30017864.0000 27636768.0000 36085100.0000 24544578.0000 14496.0100 153028.9700 9732456.0000 8764561.0000 5365293.5000 4908940.5000 7145708.0000 7828.9000 12339.5500 23108182.0000 23669264.0000 21394158.0000 20846562.0000 19611892.0000 7409.1300 8491.8700 1994178.0000 6800068.0000 4276220.5000 10213929.0000 8892239.0000 6441.1000 9451981.0000 11913160.0000 16529217.0000 14367313.0000 10561879.0000 PC(O-C40:5) 28670.5000 3272466.0000 5269559.5000 8156880.0000 7046074.5000 13032280.0000 21143.4400 12615736.0000 19058422.0000 17376426.0000 23023846.0000 26824992.0000 14249392.0000 9983626.0000 9900393.0000 15118227.0000 12216925.0000 28882.6900 17783.0000 21600456.0000 27453522.0000 30767824.0000 35859084.0000 26419574.0000 40781.4900 204089.1900 12524384.0000 11351551.0000 2943182.0000 6728720.0000 12660051.0000 21953.9900 28100278.0000 39084940.0000 36469236.0000 29680918.0000 37940356.0000 2701892.2500 6317668.5000 4689320.0000 10040419.0000 7413997.5000 10362216.0000 9890825.0000 17114944.0000 14529299.0000 11327200.0000 PC(O-C40:6) 17840.0800 1057378.8800 2405137.2500 3657850.0000 3620221.2500 6020216.0000 22409.7000 8438499.0000 12267287.0000 10599622.0000 13789121.0000 14673693.0000 3387.7100 7157330.5000 6574329.5000 5938929.5000 6911536.0000 6919244.5000 33909.5500 28657.4700 10331941.0000 11374869.0000 12900637.0000 15493821.0000 12693699.0000 10737.1100 5035539.5000 5021596.0000 1962561.6200 4076015.7500 5671117.5000 7166.0400 13427908.0000 20185054.0000 16634980.0000 13679013.0000 18850650.0000 1646913.8800 1861025.1200 1755306.3800 3108475.2500 1758539.0000 6735055.5000 6180830.0000 7741413.5000 8206120.0000 5725780.5000 Propionyl-Carnitine 53303.8900 40007.6400 17781.7300 13982.5300 17819.6700 38267.0600 14589.6800 15201.1800 44354.4400 89927.3500 2597436.7500 2225692.7500 2292837.7500 2670505.2500 2928746.7500 9062387.0000 6828567.5000 6215565.5000 8424769.0000 8392463.0000 7705964.0000 8333238.5000 10756649.0000 9452059.0000 10125997.0000 37804872.0000 64569424.0000 65930996.0000 85238576.0000 68922952.0000 5274151.5000 5211586.5000 4307949.5000 3706369.0000 4020947.2500 15160052.0000 10772479.0000 14447944.0000 14247079.0000 11764743.0000 9102891.0000 9205399.0000 7827374.5000 7175400.0000 6823816.0000 59277276.0000 9559853.0000 94657560.0000 96107968.0000 90001408.0000 4672511.5000 3982640.7500 3759586.7500 3508052.0000 3022530.0000 18450030.0000 13347748.0000 8262194.5000 6863504.0000 10808473.0000 10130581.0000 7586360.0000 8095027.5000 9939820.0000 10343445.0000 49246036.0000 76806520.0000 2041878.0000 67761912.0000 99247768.0000 5243826.0000 4138446.7500 3589893.0000 3680971.0000 2827853.2500 7012509.5000 11421499.0000 10548180.0000 26755310.0000 19094314.0000 13314395.0000 8921819.0000 9750936.0000 9753115.0000 12145199.0000 23862928.0000 48892388.0000 51459740.0000 43617116.0000 50266804.0000 Pyridoxine 67605920.0000 46316628.0000 36585052.0000 39301640.0000 34599844.0000 44415932.0000 40068140.0000 37343300.0000 36914900.0000 40027188.0000 52310620.0000 36852780.0000 30624264.0000 32146686.0000 40349560.0000 21151110.0000 37234860.0000 34953216.0000 40188028.0000 45928644.0000 21030558.0000 19595746.0000 23194998.0000 20970722.0000 28909360.0000 15897372.0000 25982374.0000 23835174.0000 25320614.0000 24936818.0000 46205444.0000 34434324.0000 30856968.0000 32736318.0000 36735516.0000 8596787.0000 24381392.0000 20237048.0000 20127676.0000 16265137.0000 8503351.0000 5881981.5000 11296992.0000 9297588.0000 9345453.0000 5917715.5000 1088597.1200 6338830.5000 14744736.0000 11104302.0000 44748452.0000 44711228.0000 22839606.0000 34346072.0000 25628304.0000 13112819.0000 21233480.0000 14986232.0000 49588096.0000 57973260.0000 10015654.0000 6717574.5000 9677825.0000 7663341.5000 12805176.0000 3113858.2500 9799096.0000 144792.2800 7191245.5000 6975096.0000 56780748.0000 56214268.0000 28037758.0000 37339768.0000 25902712.0000 6101400.0000 33416406.0000 21422578.0000 29467714.0000 36724348.0000 23110232.0000 24476974.0000 22128636.0000 17754222.0000 34671268.0000 8447957.0000 8308716.0000 14276611.0000 13422265.0000 14933721.0000 Pyridoxine_1 4336176.0000 4069320.7500 5852588.0000 4681433.5000 4359422.5000 4367635.5000 4631900.0000 4613903.5000 4755844.5000 6194586.5000 3328858.0000 2924325.0000 2946456.7500 2908562.7500 4413502.5000 2240128.2500 2917358.2500 2933929.0000 2476647.5000 3413646.0000 3283068.7500 2601180.0000 3010667.2500 3209708.7500 3365855.2500 785925.0000 631673.8100 1251400.8800 1095332.5000 1287025.6200 3162397.7500 3508453.0000 2116771.2500 3029812.0000 3017853.7500 906293.0000 786013.5600 1122196.6200 885922.4400 1668325.1200 4624212.5000 4044974.7500 2420701.0000 3046974.2500 3397503.2500 2746210.2500 2907653.2500 2955341.0000 2302379.7500 4429641.0000 Riboflavin 3881325.2500 3402641.0000 4167757.2500 3581579.2500 3793123.2500 1929292.6200 1765480.5000 2622932.7500 2049459.1200 2899418.0000 3946910.0000 3365038.2500 2374724.0000 3163876.7500 1284432.7500 179953.5200 130363.2900 141233.8000 164658.4700 197520.6700 1938342.0000 938987.6900 1035334.6900 1845442.6200 948827.1900 840465.5000 307125.6900 265347.0900 201288.6400 174203.4500 4189284.7500 3484193.0000 2068710.0000 2460051.7500 924567.0000 93974.0600 112046.5600 102462.8400 102043.0500 87263.3600 1231966.0000 2582832.7500 1029846.6900 1471797.0000 3067635.7500 135202.6400 98759.5200 118288.9500 157128.8100 2607257.2500 3337737.0000 3852316.2500 3079120.7500 1892179.5000 3462336.7500 213216.3100 91522.3800 157312.6200 170877.5800 192256.9800 2331793.0000 3445631.7500 3243587.2500 3153175.2500 1032149.0000 647954.2500 220567.4800 26820.3100 427249.3800 614200.3800 3608926.7500 3483814.0000 2129072.0000 2479858.2500 3624434.0000 410379.5000 111911.8400 106041.8500 129825.2300 102456.6600 2486803.2500 1681562.8800 2193147.0000 2685551.2500 863767.3100 597245.5600 47049.3100 760874.0600 795261.3100 712723.8100 SM(d18:1/14:0) 27372.2600 13141.5500 25385.1500 210099.3000 262560.6600 201334.2300 227726.8300 188398.0000 27853902.0000 26841742.0000 29243960.0000 30686726.0000 33444288.0000 299171.2200 166478.8900 337334.4700 398375.2200 251350.1900 143175168.0000 170402720.0000 149558256.0000 163240224.0000 148759536.0000 396344.6200 359466.1200 355250.6600 445629.1200 396813.2800 58496896.0000 35247884.0000 48634944.0000 58969696.0000 47421324.0000 846974.4400 833697.9400 766930.8100 1173684.6200 731183.7500 391008672.0000 463342560.0000 423004832.0000 589557952.0000 430555904.0000 326996.8400 189829.6400 395215.6200 215926.7500 266810.1900 49198816.0000 46706336.0000 24183362.0000 23689560.0000 39297372.0000 317485.5900 238219.6100 211698.2000 259982.0500 195795.5000 127282008.0000 187237520.0000 139988992.0000 138734800.0000 122089464.0000 334350.3400 250775.2500 268848.0300 218804.6700 230608.6200 14455360.0000 27528488.0000 21522574.0000 56899072.0000 50828832.0000 217484.7000 189893.5800 208782.8600 158575.8600 212595.7000 167262304.0000 129000928.0000 208102464.0000 160239136.0000 129012608.0000 SM(d18:1/16:0) 754528.0600 524099.1600 986164.3100 710613.6900 588602.5000 648616.0000 439542.5000 539012.1900 504319.5000 585370.5600 1722309.6200 1801116.1200 1700987.1200 2681021.0000 1568743.6200 232190672.0000 242570288.0000 231715312.0000 246225296.0000 256900272.0000 6946270.5000 4308325.5000 5792684.5000 7650286.0000 5723748.0000 265938560.0000 217950864.0000 224801360.0000 187604096.0000 179234000.0000 3961632.0000 3616322.7500 3601552.2500 3650331.7500 3214541.2500 355623968.0000 272769376.0000 317927776.0000 327245408.0000 303669120.0000 19992372.0000 20350452.0000 16995574.0000 21503068.0000 15524705.0000 486346848.0000 521607456.0000 450523648.0000 421285216.0000 390592096.0000 3729200.0000 2577212.7500 7933174.5000 2750321.7500 2655498.5000 290151488.0000 277485152.0000 231580864.0000 259479552.0000 284926048.0000 6408444.5000 5330848.5000 6185009.5000 5174604.5000 4299410.5000 195978880.0000 202238128.0000 208060160.0000 203380304.0000 193755408.0000 2147311.7500 1839137.0000 1869154.1200 1752882.0000 2424148.7500 194913808.0000 247041136.0000 245147056.0000 403132448.0000 337910080.0000 4782749.0000 3587981.0000 3818627.2500 3480486.0000 3085887.7500 365834208.0000 292261216.0000 331324512.0000 336045472.0000 344590560.0000 SM(d18:1/16:1) 67400.7700 42024.7900 178209.3800 82225.9500 35036.3400 70712.0500 87652.2500 34957.2500 22046.3600 30098.1200 96859.3400 73926.4100 64201.5800 64663.0900 59514.9300 1859878.5000 1856217.0000 2242577.2500 2128653.2500 2505559.0000 139785.4500 184579.2300 149363.5000 166863.3300 135751.3600 22356134.0000 20880496.0000 27274470.0000 25202598.0000 18483840.0000 123567.0200 93126.0600 76716.7900 89815.2300 86870.9100 2647522.7500 1986785.8800 2507189.5000 2647288.7500 2076923.8800 769435.9400 663364.8100 580712.1900 695220.7500 597790.8800 100073144.0000 154274736.0000 122525704.0000 186865968.0000 128941208.0000 40807.3300 105444.6000 101662.0300 125981.5000 106943.2900 2604873.2500 2560173.7500 2136839.2500 2093684.0000 2529637.2500 182493.7500 105216.0200 98409.8400 144770.3100 128467.7500 22468128.0000 36475716.0000 24717826.0000 19668638.0000 19216234.0000 161619.5900 91721.9100 105423.8800 64679.9800 101023.3400 1320930.1200 1846735.0000 2017752.3800 3694510.2500 3091409.7500 158348.9700 114573.0400 196256.4500 150282.6200 144031.0900 35900876.0000 32121712.0000 48606784.0000 34979084.0000 27988518.0000 SM(d18:1/18:0) 180586.5800 94341.5700 215262.5200 154591.2800 116791.0200 103580.2400 27159.4300 65233.3200 44010.1600 67328.3500 393833.9100 413304.0000 403971.6600 634387.0600 371527.9100 37647876.0000 35176580.0000 36095636.0000 39604768.0000 38886700.0000 4731784.0000 2308825.0000 3815822.7500 5107379.5000 3108380.7500 109180512.0000 109901080.0000 104623624.0000 107225184.0000 96438016.0000 518492.7800 530555.4400 511806.8800 519217.0000 513129.2800 37670764.0000 36808244.0000 40453692.0000 40380512.0000 43984832.0000 8467238.0000 6844541.5000 5741711.5000 7045494.5000 6304898.5000 146565584.0000 163035568.0000 161386256.0000 151531712.0000 171152896.0000 1076031.6200 705781.1900 1623262.6200 779855.8100 867522.3100 40028960.0000 37830592.0000 31610272.0000 36136228.0000 38031116.0000 4316131.5000 3558301.0000 4072399.7500 4778591.0000 3153371.0000 119445096.0000 136387808.0000 147603696.0000 106148472.0000 138639792.0000 343923.0300 416996.5000 407164.2500 327602.0900 449631.3800 40360956.0000 47259036.0000 45146272.0000 49737740.0000 49463552.0000 2768758.2500 1608881.1200 1780088.6200 1597100.6200 1979203.0000 201414864.0000 202953792.0000 204120656.0000 225429040.0000 208218256.0000 SM(d18:1/18:1) 63585.0000 54764.3900 40993.0400 64165.2700 3561094.0000 3268119.0000 3956298.0000 3609222.7500 4022652.0000 280062.8400 269181.9400 183384.8100 185370.8000 236479.2000 11161567.0000 9074386.0000 9361145.0000 8281271.5000 9521134.0000 60358.8400 54500.6700 85126.2700 3926853.2500 3169060.0000 4086563.2500 3879277.0000 3889742.0000 911598.5600 915753.4400 826047.0000 940755.1900 697269.7500 25500366.0000 24308624.0000 24357024.0000 24533826.0000 25439386.0000 54611.1800 48014.5300 4333326.0000 4052616.0000 3612450.7500 3545778.0000 4080193.0000 391485.0000 277293.8800 236270.1700 321777.7200 364806.6600 11255747.0000 11769277.0000 11501205.0000 7660228.5000 9918678.0000 111417.2600 42923.5200 2789015.0000 3077984.2500 3434070.0000 4093506.0000 4472923.5000 283625.4100 262655.2500 165782.4800 200167.4400 254681.5000 26961616.0000 24957458.0000 24869472.0000 27064944.0000 23379402.0000 SM(d18:1/20:0) 18154.6800 921718.2500 39453.3600 16283.7000 4488.7200 28131.4200 23902.2600 316359.9100 16242.9400 21607.2800 31310.5300 80606.0800 20296296.0000 21178028.0000 19455598.0000 23151926.0000 27086382.0000 370277.9700 431798.4700 308835.9700 406113.3400 215994.3900 75722240.0000 74793504.0000 72169736.0000 68203360.0000 73813784.0000 79436.7700 88063.6900 33190.5000 75413.0300 11563.3700 23589160.0000 17072752.0000 21571578.0000 21162938.0000 19948674.0000 461021.5000 435800.0900 374890.8400 605099.4400 458849.2200 83913048.0000 99441192.0000 85208584.0000 95280760.0000 89847424.0000 83379.6800 175647.8000 310308.0300 322573.2200 252920.4800 29244424.0000 28246528.0000 19022462.0000 20148824.0000 28165526.0000 261544.0800 205754.8300 216498.0800 383692.4100 135819.0600 66423856.0000 76593696.0000 74449080.0000 55046004.0000 79136608.0000 16290.0000 13442.0400 24611.5100 108965.4100 24214.1400 9431928.0000 17684442.0000 14782467.0000 25071154.0000 25724950.0000 122916.7700 72518.6200 96238.5700 112944.6200 117283.7500 126260296.0000 114399096.0000 111350664.0000 105827264.0000 128046208.0000 SM(d18:1/22:0) 31216.3300 25187.2900 800922.5000 162430.7700 22569.1700 20233.6600 120214.3800 17937.8700 326257.6600 55437.3000 30910.2100 50722.9300 114798.1000 13333133.0000 14350311.0000 13141841.0000 15373212.0000 21728332.0000 502056.1600 769612.4400 429381.5000 620193.0000 250129.9500 200816432.0000 219742288.0000 235900208.0000 219090896.0000 212191344.0000 102109.1000 137153.1100 161668.9200 92991.5600 55005.4100 35895580.0000 23866424.0000 28525656.0000 37835852.0000 38729412.0000 881497.0600 827144.3100 677924.8100 787110.5000 783275.0000 233528768.0000 303590656.0000 268193104.0000 306283648.0000 268492224.0000 81827.4000 223098.5200 1013654.9400 392431.6200 202202.3000 25636130.0000 24692298.0000 11707664.0000 18464632.0000 27294320.0000 492710.0000 259135.0200 312802.1600 434738.4100 259687.7000 202958608.0000 212796112.0000 194817216.0000 194477648.0000 187731856.0000 75230.7700 27219.3400 27886.4200 199181.7700 85665.5500 4528218.0000 15485997.0000 9704655.0000 26849746.0000 26043134.0000 272716.5300 173088.7700 277365.9700 162936.9200 228353.4200 220857136.0000 197728240.0000 223760592.0000 196057648.0000 229850032.0000 SM(d18:1/24:0) 24684.0100 28636.8100 36416.2300 10393.1700 57902.9400 5729581.5000 5743372.5000 5240908.5000 6751803.5000 8875879.0000 345262.5000 189482.6200 353057.0000 533650.5000 249522.0500 141320048.0000 150481904.0000 186313552.0000 167748992.0000 168302912.0000 56825.1400 29343.2800 29770.3000 23419.6300 41445.4600 17958006.0000 12283929.0000 15049656.0000 18849214.0000 17337052.0000 986780.7500 1186165.8800 726940.7500 955805.7500 686547.4400 344911840.0000 532794976.0000 440919008.0000 568419200.0000 361963520.0000 53997.0700 40329.6500 529343.6900 62556.0900 58234.4600 7753860.0000 8800960.0000 4050050.7500 7812950.0000 10744004.0000 191063.2500 285336.0900 282954.4700 276845.0000 184476.1100 169880096.0000 158558672.0000 138851520.0000 153130096.0000 118691392.0000 63565.3600 67599.4500 2039972.8800 7195138.5000 3638890.0000 12564744.0000 8983683.0000 99691.5900 154514.1700 85887.5700 132689.9400 116169.0000 159237008.0000 123863808.0000 154874208.0000 139072816.0000 144251504.0000 SM(d18:1/24:1) 93321.2100 17543.0200 92854.3400 127683.7000 40760.4800 89822.0600 25951.0400 41860.2100 18476.0300 32941.9600 214619.3300 190931.5600 180264.5800 280440.0300 202298.0500 109941664.0000 114070816.0000 101593640.0000 117327400.0000 163648208.0000 1253940.7500 787313.5000 1311472.1200 1766526.6200 972018.0000 540792256.0000 609019904.0000 606429760.0000 639086912.0000 663683584.0000 470064.4100 459274.0900 424346.3800 438756.7500 392836.7800 305104224.0000 219058608.0000 265402752.0000 313178016.0000 299806944.0000 3904174.7500 3699057.7500 3591572.2500 4078947.2500 3148137.7500 1069985600.0000 1227369344.0000 1184878976.0000 1285200256.0000 1066727168.0000 579474.0600 300151.8400 1155937.3800 378614.3800 233575.3800 225379760.0000 216996656.0000 105184904.0000 140337040.0000 203347440.0000 1281090.2500 1210489.1200 1238163.6200 1452286.6200 876236.9400 746088640.0000 832605504.0000 720831744.0000 665184960.0000 665762624.0000 228399.2300 205801.9200 196273.8000 184641.1900 232819.3300 34550148.0000 136870768.0000 71531496.0000 237452672.0000 219410048.0000 829996.9400 558061.9400 689062.8100 543159.3100 699030.7500 637594560.0000 599572416.0000 666965056.0000 670965632.0000 592931392.0000 Taurine 91908.6500 151001.8800 163384.6900 206580.6700 254174.0600 2710863.5000 4939370.0000 7485687.5000 4409051.5000 3493331.7500 77432.2700 143361.3000 69363.0800 260227.2000 282401.4700 3100790.0000 1002795.1900 5258822.5000 9317241.0000 6226366.0000 215901.3900 237697.6200 143859.8100 166573.2300 478992.4100 2550101.0000 4418381.0000 484647.1600 6444654.0000 3305741.7500 277897.3400 407725.6600 230691.2000 469590.5000 376028.8800 4301688.5000 5213448.0000 8923411.0000 7033309.5000 8929718.0000 TG(C48:0) M+Na 315960.2800 310471.3800 306794.4700 343351.0000 383477.5900 14452.1700 2056927.0000 3157320.0000 6540268.5000 7549807.5000 3805914.2500 18619.0100 989577.0000 677757.3100 746976.4400 1006805.8100 1312576.2500 4840.6900 4158087.0000 8809353.0000 10976441.0000 12336419.0000 6515085.5000 66668.4400 640604.6900 586458.8800 278769.0900 180731.1400 606172.5600 6328179.5000 5529554.5000 5700342.0000 9679800.0000 3909052.0000 12728.6200 78458.5600 53793.3900 299505.8400 375763.7200 14756.4200 655432.4400 512336.7500 1750349.6200 1350577.3800 1234155.5000 TG(C48:0) M+Na_1 73491.6600 25114.8000 55595.2300 67245.5900 125242.2700 64226.1000 31841.7400 64640.9700 67674.5200 45224.8000 47492.8000 76437.7400 52320.0800 47810.9300 115943.5200 205760.2700 274684.5000 236651.8000 349294.4100 310011.3800 60692.1200 172756.5000 129571.6200 218783.9400 104405.3500 3005366.2500 5346534.5000 6184034.5000 6376918.5000 5522358.5000 56769.2700 67158.8000 28141.9600 109188.2100 44555.7700 701823.9400 422691.7500 563045.5600 700721.1900 706273.6900 95745.2700 95873.3800 101606.7200 142121.3300 172775.1900 5853472.0000 14535279.0000 10287582.0000 11698428.0000 9474509.0000 49204.4500 34040.7000 842697.6900 34699.3200 111539.3500 589410.0000 485625.2200 255273.3300 237242.1200 473850.6600 76556.0100 47336.5200 192330.5000 107032.5000 84439.5200 11306456.0000 7638588.5000 8018454.5000 9628264.0000 5581530.0000 84834.6200 40848.2700 59412.9500 79783.2600 88406.9100 71258.4100 65456.8900 212227.6400 267216.4700 197134.5800 46189.6700 83145.7300 40610.1100 39817.2000 1114478.3800 1083179.6200 2452170.7500 1478530.5000 1494615.1200 TG(C48:1) M+Na 35835.8200 41652.5100 172679.5500 25176.3900 93674.2000 26665.5500 79785.1200 32308.3300 18869.2800 29139.3700 228922.1200 237343.0600 176045.0200 245592.6700 251685.0000 57490.1300 430932.9100 301755.8400 830802.7500 17006.7000 2017384.5000 4188183.7500 4738277.5000 5138867.5000 4529183.5000 172286.2000 254453.4400 137445.0600 645715.3100 361730.9100 490435.8400 752034.8100 737569.1900 335452.2500 203206.2000 385706.3400 284068.9700 3703377.2500 9523508.0000 7537330.5000 8599269.0000 8110545.5000 38413.4800 52081.2800 63499.9100 204168.9400 431357.0900 303947.3100 133503.5500 106009.1200 225383.5800 402354.0000 280974.3800 13287.2200 164884.8900 8110332.5000 7178892.0000 6080549.5000 7100072.0000 4667068.5000 16239.5900 45473.4200 87601.1600 55095.8800 181294.1200 224184.4200 432828.0300 39141.1900 616868.0600 395376.1200 1316655.3800 675236.3100 798023.8100 TG(C48:1) M+Na_1 214893.8100 96591.6600 73537.0200 157508.1100 281190.4100 138228.4800 56356.6400 179026.5000 95945.7400 88201.7700 157573.2500 185870.2700 139495.6900 82046.7400 212900.8000 2992604.0000 2917145.2500 3361040.0000 3512335.2500 3444772.2500 311825.5300 15776.8400 54824.6600 272138.2500 21153568.0000 37432348.0000 46284564.0000 47743692.0000 37617136.0000 156513.8600 52077.5100 162055.5200 206778.6900 123191.8500 10046625.0000 6207126.5000 7299346.0000 10242887.0000 10872116.0000 251450.5800 141423.0600 203206.2000 423726.4100 231658.2700 39944260.0000 97531072.0000 82339432.0000 84299240.0000 68435424.0000 59642.1900 159808.3000 1687274.1200 113596.3400 152685.3600 6346015.5000 5610428.5000 2649967.7500 2135904.2500 5565434.0000 17357.5000 237751.3900 154230.5500 275677.4700 164884.8900 66401088.0000 57532612.0000 58814432.0000 73324392.0000 39433344.0000 213054.8000 106444.1200 180557.9500 100277.2200 164526.6700 260260.9200 763277.5600 572250.9400 3064585.7500 3333447.2500 230652.5600 140732.8300 139881.6200 123208.4900 106360.3000 6565830.5000 5347779.5000 16116035.0000 8992909.0000 10289389.0000 TG(C48:2) M+Na 81189.6800 46709.1200 20345.5700 36687.3200 91831.0300 23692.9300 21936.5800 42845.8900 41418.6400 49985.9700 28349.5200 55671.7200 55523.2700 32683.3400 60362.4300 1669759.6200 1631468.0000 1555359.0000 1896827.6200 1978019.3800 126331.9300 201996.8000 170955.1400 407497.9100 123791.8200 15481649.0000 31546786.0000 38479388.0000 40795236.0000 33590380.0000 77205.7900 102660.1900 58500.4600 109114.1000 37116.4500 5229500.5000 3300100.0000 4021714.7500 6104923.5000 6321318.5000 112758.4800 150636.8800 114519.8500 151519.2500 140753.1100 29152718.0000 79090488.0000 65118324.0000 72320488.0000 63818596.0000 48307.5200 25000.0900 444487.2500 25347.7700 57525.9600 2951138.0000 2685782.0000 1162025.8800 1030199.6900 2366738.7500 145193.8900 100569.0700 144130.9800 161713.1700 55950.9300 59356704.0000 54347360.0000 49695648.0000 57472384.0000 36944316.0000 51468.8400 25460.4700 67130.9100 23294.9200 71625.4900 179930.1200 497939.7200 334267.5900 1595678.0000 1634104.0000 216007.0800 21753.4900 15865.0600 22659.8300 31326.0900 4326486.0000 3632747.7500 10384103.0000 5793696.5000 6782390.0000 TG(C48:3) M+Na 22340.5500 14814.3000 15972.4200 14405.1800 15008.5100 17733.7300 15158.2800 404808.2500 475250.5000 492455.5000 555489.9400 532620.7500 25106.5100 68846.4700 50689.5600 124323.3800 16561.5200 6395461.5000 13815337.0000 16114719.0000 18909302.0000 15488253.0000 20986.6300 19178.4500 14536.2500 41366.6700 1116513.1200 745831.1900 999341.8100 1391110.1200 1548477.0000 16932.1700 26384.2000 17381.7700 43285.6200 47898.2200 10969342.0000 27669616.0000 22560574.0000 25759584.0000 23139120.0000 35076.7500 19769.5400 625223.9400 530498.4400 217454.3600 230033.0200 422478.1600 21077.8900 17155.8300 38546.9600 73524.7600 15399.8500 20942100.0000 20294258.0000 18647730.0000 22787114.0000 14298691.0000 20862.1600 18163.3600 18896.1700 24194.3400 123283.2600 33230.5600 240361.9800 345679.1600 81638.1800 17929.6000 1572669.0000 1249119.1200 3558048.0000 1749615.5000 2400010.0000 TG(C50:0) M+Na 21560.8400 17481.8800 14565.4600 17814.9400 35952.3900 14735.7500 13574.3300 49774.2500 13675.8100 32165.0400 33987.9200 16811.0900 10938.7500 14198.9200 15644.4300 418343.3400 341878.2200 394197.7200 528700.6900 397173.3800 31783.7700 35677.3100 51849.2000 89769.5900 51524.2400 2929043.7500 4997795.0000 5769596.0000 6464248.5000 5437569.5000 19407.3300 20412.3300 21078.8200 37848.3600 17978.3000 1045159.3100 640213.4400 859500.1900 1118973.5000 1154192.1200 43092.9100 63460.4300 35803.1500 53303.5100 67552.8200 5330682.5000 11406251.0000 7942185.5000 8844164.0000 7980716.5000 22732.8600 38613.0000 677242.3800 32133.4700 52794.4400 942392.0600 635566.0600 352920.5300 357540.6600 585044.5600 55358.1100 32887.4800 31902.2900 46862.2900 27143.5300 9310651.0000 7355458.5000 6516782.5000 7992137.5000 4789923.5000 42534.5100 24625.1000 15756.2900 21768.5800 23329.2300 112061.6600 58925.8100 376535.5000 299678.2800 60358.2100 17116.2900 21079.9700 14591.4800 49479.5400 914650.0000 683848.0600 1609390.8800 931509.8100 1171376.1200 TG(C50:0) M+Na_1 17354.7900 17047.3400 60036.6400 32650.8400 16389.3100 15590.5200 17442.5900 18301.2000 17275.6500 208661.1100 196977.8800 217787.1400 229290.9500 242833.4400 19474.2600 80683.4700 51207.4400 113329.6900 28876.8200 2433815.5000 4516019.0000 5291376.5000 5477078.5000 4278222.5000 16772.4200 17012.4500 17487.5600 15299.3900 15322.2100 509042.6600 327339.6200 405832.2500 474258.1600 535566.1900 37700.7800 25942.6100 45536.9200 79786.8600 83643.7300 4572729.5000 13382140.0000 8195098.5000 7742140.0000 6632418.0000 14289.4900 256895.8800 19236.3600 431032.7200 331134.5300 177880.1700 183255.3900 369841.5000 26301.0600 17262.6700 65411.0700 19002.7600 16432.2700 8236950.5000 4946978.0000 5001157.5000 7558920.0000 3453849.0000 18041.1600 22193.7500 19060.0300 24240.7200 66427.3000 36838.5600 178392.9400 174477.1100 58504.8100 19178.3200 20245.0000 14767.3900 15671.5600 709358.6900 730498.8100 1340733.3800 938490.8100 934052.0000 TG(C50:1) M+Na 28458.7600 55254.0600 17647.3300 18335.7700 92714.8800 17443.2200 19622.5900 35290.1800 22843.3800 13295.7900 24855.2200 24605.6000 24888.6600 22568.0100 13065.3900 895137.2500 1045702.8100 946914.5600 985630.3100 917110.3100 50405.8500 77962.3800 67298.6400 131791.6700 66667.4800 5813370.0000 10351185.0000 11195957.0000 12553144.0000 11542063.0000 44732.3000 26943.6200 39464.0800 39195.3300 36228.5200 2641731.2500 1579525.0000 2102163.0000 2797238.7500 2944288.7500 47130.6000 68081.9100 63545.7300 87018.9900 71419.8000 10544804.0000 22768246.0000 17718152.0000 18979322.0000 17931546.0000 19645.6900 22570.4900 582021.4400 52858.4300 31000.3900 1764533.3800 1614493.5000 724940.2500 738758.5000 1240754.6200 67295.1300 44138.4100 75362.3700 85354.0300 25200.2400 19486368.0000 17135550.0000 14113993.0000 17677754.0000 11689776.0000 43863.9400 18833.9200 23806.6800 12706.3200 24289.3400 39322.8100 244638.0600 170322.9500 761173.2500 732197.1900 57370.5700 24557.4800 23541.8800 25669.1000 44431.7200 1825623.0000 1294024.3800 3664541.7500 1946612.3800 2325093.0000 TG(C50:1) M+Na_1 280205.5300 199728.3800 189289.7700 200749.8300 491064.6600 251625.5000 207161.8100 357223.5000 220837.6900 301839.3400 315902.2500 262520.8400 269188.4100 227129.8000 253261.5000 3222224.0000 3610380.7500 3275206.7500 4280459.5000 4006874.0000 399311.8400 474268.1600 551137.0600 1059118.8800 388994.0900 23607970.0000 42767124.0000 52750868.0000 56292432.0000 42571512.0000 308489.6600 341326.2200 277431.0300 344279.8800 270056.7200 7669202.5000 5662374.0000 6954967.5000 8924701.0000 9967757.0000 345887.9700 444121.5000 442657.3400 554861.2500 496853.2500 42933932.0000 103730152.0000 81591768.0000 83867552.0000 67717736.0000 221643.3600 238407.5000 6204204.0000 235050.0600 319894.0000 6934061.5000 5687022.5000 2943825.2500 2390190.7500 5317544.0000 520745.7500 318492.7200 493762.7800 455107.6600 270218.3800 76879288.0000 61125856.0000 58037024.0000 76607800.0000 43309904.0000 299035.4700 197092.6200 245102.2300 229909.0000 287544.9700 312551.4100 821909.0000 555724.6200 2845846.2500 2751652.0000 381410.9700 239012.0500 228829.8100 238811.0600 309378.5300 7350394.0000 5848281.5000 15213753.0000 8993487.0000 10325787.0000 TG(C50:2) M+Na 251159.9500 144103.2300 195007.4200 343960.5300 751184.6900 289829.0600 325438.7500 508705.1600 372204.6600 319415.8800 384228.5300 367994.5300 371611.2800 311414.2200 295874.7800 283029.8400 299419.4100 277418.7800 264800.4100 332150.8400 584145.2500 598174.6900 644636.3100 1436858.3800 572445.0000 2029591.1200 4518128.0000 4724951.0000 5011969.5000 4496236.5000 534690.9400 545795.8100 421631.6200 466358.2500 365381.9100 700814.4400 393175.5300 620516.4400 680925.7500 752426.1900 558007.5000 685492.0600 562968.8100 405974.6200 625161.0600 3729222.0000 9146028.0000 6474077.5000 7932086.5000 7659278.5000 301554.7800 397994.7800 220516.7000 271484.6600 472192.3800 384384.6200 295191.7200 165649.2000 101220.7900 289981.3800 829584.8100 506458.7200 653196.4400 798729.0000 445529.0000 7744962.5000 7034539.5000 6210436.0000 7456482.5000 4869750.5000 445742.6200 259184.0000 428913.1600 313787.0900 149583.1900 47370.9000 40837.7500 186057.8300 235828.6100 590718.9400 320889.9100 386818.2200 283537.5900 387415.2800 563306.5600 507672.7500 1208705.8800 636102.3100 797929.3100 TG(C50:2) M+Na_1 387246.5000 335625.0300 417264.2800 80395.3400 12682.5900 289829.0600 302868.7500 13113.1400 309677.7200 378627.6600 432214.1600 122195.0000 109981.4800 224986.1900 348918.0000 7152605.5000 7563674.5000 6892760.0000 8263363.5000 8006434.0000 20256.3600 319398.8800 21738.1400 99308.6800 14804.0100 49298284.0000 91563264.0000 106421528.0000 116951768.0000 94025704.0000 104333.7900 524241.0900 375002.7500 107217.5500 360494.7500 20101526.0000 13190224.0000 15885809.0000 22401390.0000 24917122.0000 41768.7200 13798.6200 13265.0600 1020550.0000 150464.6200 85972536.0000 200234752.0000 164385728.0000 174611312.0000 154859024.0000 69846.0700 5345813.5000 362604.6600 104423.8200 13640557.0000 12233308.0000 5664098.5000 5405292.5000 11386692.0000 506458.7200 627793.6900 34167.8300 14923.7600 155078832.0000 144348656.0000 132025504.0000 161557136.0000 98578200.0000 309984.4400 311980.0000 303542.7500 374854.4100 727845.3100 2096754.6200 1480353.6200 6073890.5000 6998007.5000 15841.8700 268790.1200 214363.6200 335638.0300 392508.2200 14783811.0000 11133369.0000 31844704.0000 17285914.0000 20617930.0000 TG(C50:3) M+Na 409262.3400 371675.4100 354083.4700 379204.7800 363190.0300 362492.3400 428063.0900 400818.3400 385961.3800 553943.5000 438743.5300 465901.8800 365874.0000 399095.7200 382511.5900 2215976.0000 2302215.7500 2341365.2500 2484110.2500 2360223.0000 508148.2500 455532.5000 441982.7800 494052.1600 510370.9100 18245042.0000 38320548.0000 45111812.0000 50186588.0000 38736908.0000 440719.5900 418394.8400 366878.2800 363063.7200 385987.8800 5433297.5000 3619477.7500 4603806.5000 6845947.5000 6754075.5000 437557.7500 409089.3400 444129.5000 423557.2500 377132.5300 31434774.0000 81620616.0000 66145524.0000 78742328.0000 68749624.0000 428937.0300 453911.5000 375532.4100 381572.7500 369892.1200 3014082.2500 2680168.0000 1251747.2500 1000576.5000 2230206.5000 430302.1200 495996.0000 471782.5900 452912.5000 441429.5000 65292876.0000 61361856.0000 57377644.0000 71176168.0000 43675088.0000 505599.9100 474764.5300 384841.9700 393211.3400 363679.5300 179068.0800 596083.5600 356172.0300 1515327.8800 1625116.3800 413641.7200 463077.0000 402717.3400 473668.7200 520802.2500 5284561.5000 4579380.0000 12095036.0000 5984508.0000 7918426.0000 TG(C50:4) M+Na 625680.3100 561587.9400 599165.6200 695281.1200 596798.5600 60870.8600 23895.6600 19861.5700 124019.8800 16754.3500 10415616.0000 23446278.0000 27369114.0000 32015910.0000 26331206.0000 16158.9200 1637335.6200 1227413.1200 1598678.0000 2222975.2500 2399672.7500 37028.8300 16872.8000 20192.7400 21577.9200 17259070.0000 46446348.0000 37780936.0000 46151036.0000 38159504.0000 636545.9400 401969.7500 208717.4400 196831.4200 523591.7200 23213.5900 15388.2800 44047.4500 64351.4300 33043806.0000 32558720.0000 30655720.0000 34897916.0000 21859762.0000 15267.1900 106801.3400 193678.3800 120424.0200 521458.8400 616376.6900 26568.3800 11475.5500 2363793.2500 2005547.0000 5368571.5000 2740630.0000 3872609.7500 TG(C52:0) M+Na 6496.9300 262275.9100 302755.4400 240212.5000 335104.7200 331657.2500 22407.5700 15079.2100 15683.1100 40648.6400 12172.6100 1805322.0000 3493174.0000 4281719.5000 4267738.5000 3689958.2500 538283.5000 342490.0600 518463.2500 746538.5000 742957.4400 14496.7700 19224.6900 3590333.7500 10070068.0000 6473428.0000 6371439.5000 5431898.0000 125137.8700 759400.2500 473642.9100 251912.3000 239999.4500 538402.3100 21354.7700 16076.7600 9621.4500 11476.7800 6805875.5000 4481679.0000 4040633.7500 6233221.5000 2684264.0000 41235.9700 26962.6900 172565.1100 234992.4400 12164.4900 550465.5600 294887.2200 1060904.3800 562251.5600 666155.9400 TG(C52:0) M+Na_1 19933.4900 18474.3300 44832.3400 33937.7200 43559.7700 76188.4100 102481.7000 21382.6900 19885.1400 766033.9400 1441112.0000 1771081.5000 1930203.0000 1452149.3800 168469.7300 55590.0300 128074.6000 158557.7200 177615.8600 1415909.3800 4383318.0000 2255361.2500 2007741.0000 1745782.3800 58191.7000 217659.5500 147073.7000 64473.3600 33327.1400 163880.4500 18623.9100 2838051.7500 1365331.0000 1268436.1200 2514696.2500 847883.0600 17194.0300 8408.6600 22945.8400 106566.9900 235645.0000 169188.8900 309869.7800 217707.9200 253603.9200 TG(C52:1) M+Na 92879.6600 69463.9100 85743.2000 95866.0400 224594.3600 71983.9600 51080.4400 137611.3600 83064.3000 117177.2100 102463.0000 89748.2900 97856.1000 85711.4500 102829.9400 2030579.3800 2534091.2500 1767330.3800 2653532.7500 2493858.2500 155448.5600 221568.6200 161677.7000 297044.9700 137623.5800 10345944.0000 15942307.0000 18523550.0000 19483542.0000 18760074.0000 106119.1000 74513.7100 90091.1600 86397.0900 86526.3100 4688266.0000 3267976.7500 3633849.7500 5556259.5000 6136281.5000 114577.8100 135055.7700 117567.0900 160950.1200 155731.8100 17399540.0000 32234242.0000 26010138.0000 27831696.0000 27184848.0000 104532.2400 98508.4800 2293607.0000 105578.3800 85390.8800 4930903.5000 3844544.0000 1793975.5000 2101013.0000 3605563.7500 195321.8000 96598.6900 134720.4400 163944.3600 103567.9600 28833018.0000 24777422.0000 22357400.0000 26804810.0000 17056398.0000 94235.6200 72425.5200 77058.2000 86206.0600 92010.4800 149593.8600 428518.1600 387543.0300 1349001.1200 1934928.1200 140679.5200 85251.0800 83629.1300 87008.3900 88312.8800 3032680.7500 2037103.3800 5570441.5000 2776482.7500 3767177.0000 TG(C52:1) M+Na_1 49721.6300 17978.5500 20200.3600 29376.6700 138248.3000 25960.6300 18693.0900 50660.1400 50453.5300 35968.3900 66379.2500 18718.4200 25666.0800 44875.0300 32093.6200 1849577.8800 1857871.3800 1900306.6200 2145304.5000 2210033.7500 113229.9800 106158.9500 177622.5000 343744.2500 67390.4500 12297667.0000 21279518.0000 24849738.0000 29643416.0000 22231000.0000 57591.8900 72228.3400 43789.6600 29497.7300 47946.9700 3993478.7500 2664430.7500 3164595.0000 4244321.5000 4575659.5000 103801.0700 125632.3200 83766.9500 165122.3300 110017.6900 20175614.0000 60485648.0000 40505264.0000 40690396.0000 32789046.0000 22842.1300 22832.7400 774962.4400 22576.0900 45013.1600 4588904.0000 3101132.2500 1647226.6200 1642773.8800 3433488.7500 187428.4500 81515.1400 102895.1600 117764.0000 42407.6900 41919092.0000 25607616.0000 25315474.0000 42313164.0000 16750565.0000 34286.1100 17674.1500 24646.3300 19342.8300 43622.1800 132309.1900 419080.6600 258803.2000 1246116.8800 1245876.5000 97270.4500 18147.3100 34992.0700 42579.9600 45100.2600 2983116.7500 2499668.0000 5966658.5000 3342712.7500 4356544.5000 TG(C52:2) M+Na 57548.6400 39741.7800 312393.9700 33501.4500 101629.4400 455288.5300 27884.1200 53829.8100 528008.0000 20656.0500 19570.9100 493861.6600 38642.3400 41001.3400 38445.8800 1386919.1200 1393868.6200 1223124.8800 1502555.0000 1355786.3800 791149.3100 1468590.3800 78083.1500 2045579.5000 68514.8800 7179362.5000 12723727.0000 13977552.0000 16146707.0000 14059220.0000 700004.3100 626283.4400 26123.7600 40832.8800 21408.6400 3108834.0000 2099435.2500 2548948.0000 3606466.7500 3823655.0000 24156.8200 35246.1700 23203.0900 87062.2300 1103592.8800 12359176.0000 25279658.0000 19722778.0000 23861530.0000 21587306.0000 21741.6700 78890.1800 448778.0900 22068.5000 698634.0000 2064872.8800 1648506.3800 853793.0000 775831.6900 1571430.5000 1343841.0000 29905.8900 74394.6000 1013141.3100 642517.4400 22647200.0000 20217512.0000 17867082.0000 19921128.0000 13842451.0000 553371.1200 17981.9300 26263.7600 20706.5900 54291.1100 123417.9500 338940.2500 234039.0500 1000884.0000 1168447.6200 88637.2100 14789.3100 567132.3100 13610.8100 32776.7700 1973312.1200 1561635.1200 4012889.7500 2023026.8800 2874605.2500 TG(C52:2) M+Na_1 607660.0600 524794.8100 458683.7800 643717.4400 1337664.8800 563516.2500 536471.2500 921762.8100 548664.1900 651135.3100 612324.5600 554343.0600 498825.2800 547410.0600 593470.3800 12870692.0000 14468389.0000 13669132.0000 16569975.0000 16799798.0000 831340.1900 227580.3300 1033777.6900 44639.4100 839232.3100 60539408.0000 101098152.0000 125898816.0000 133719512.0000 108543032.0000 700004.3100 674923.8100 623409.0000 694709.2500 575026.5000 30760392.0000 19495000.0000 25553722.0000 33854444.0000 35110848.0000 724575.5000 880298.5000 795713.2500 1101313.0000 175744.4400 99647168.0000 217322240.0000 179603472.0000 197192704.0000 153338448.0000 589185.3800 541968.2500 13308821.0000 628097.2500 727962.7500 29318302.0000 23801898.0000 12304108.0000 11617375.0000 24157232.0000 148634.6900 859450.9400 915332.3100 971359.7500 18133.9200 172499216.0000 143425360.0000 140689328.0000 185390896.0000 107780800.0000 553371.1200 486684.6600 545162.7500 524908.8100 570303.3800 1074748.7500 3481772.0000 2233610.7500 9992539.0000 11087327.0000 785735.0600 580456.4400 106789.9400 615974.0600 641750.3100 17248286.0000 13050629.0000 34504772.0000 20108368.0000 24043896.0000 TG(C52:3) M+Na 278259.4700 154341.6400 145855.0800 173823.7300 584552.3100 170021.9500 163666.9800 282737.3800 190383.8900 200248.2700 222173.1700 235271.5500 193094.0200 187148.3800 239489.8600 7936575.5000 8409857.0000 7590648.5000 9388652.0000 9668079.0000 423812.1200 706960.6900 426509.3800 1145597.3800 345278.3400 45370636.0000 84030792.0000 100815528.0000 118615584.0000 94353720.0000 285457.4100 246181.0200 248472.1400 313043.0600 208047.3300 19055906.0000 12201109.0000 16433824.0000 23313182.0000 23802362.0000 362215.3800 427825.1600 332615.7500 559254.6900 521821.9100 77698888.0000 178489088.0000 144366000.0000 164683824.0000 142044944.0000 236310.9200 244085.8800 2979202.7500 218314.1900 355409.5900 12332804.0000 11083265.0000 5389762.0000 5059264.0000 10746885.0000 558113.0600 333961.7500 450199.8400 506390.7500 226381.1700 146048560.0000 129900776.0000 129065736.0000 157859632.0000 96811000.0000 225237.1200 168620.1200 206805.4400 196297.0500 273973.0300 697818.9400 2304411.0000 1292805.8800 5767786.5000 7432861.5000 638568.3100 155431.2700 156393.1700 182678.5600 242542.1900 12200232.0000 10839251.0000 26793978.0000 14830169.0000 18799350.0000 TG(C52:4) M+Na 84194.3600 20518.5800 19598.6700 95790.1600 17880.4700 23608.1200 15208.8900 24689.2300 30950.7800 60789.2600 49212.3300 47932.2000 57366.4100 1947865.1200 2211401.2500 2036851.6200 2521987.0000 2272159.5000 142128.0800 362432.8800 136996.9700 401673.5000 61623.0500 16694815.0000 33909880.0000 39193576.0000 46010284.0000 40287708.0000 49360.3600 51852.6100 22475.3800 57708.2000 26229.2000 4339509.5000 3120752.7500 3708739.7500 5471742.5000 5861606.5000 31617.8500 150635.7000 81297.2200 181279.9400 199250.2500 26781018.0000 66783824.0000 53894688.0000 58391980.0000 48811420.0000 68774.0200 32937.5000 260368.6100 33973.1400 126805.0200 2851296.0000 1915392.1200 1047292.0000 1042069.5000 2203772.5000 113239.0000 41329.4900 83801.7000 152873.5800 30300.0500 49434404.0000 43497056.0000 40933664.0000 52981468.0000 33026998.0000 24222.2900 25390.8200 29862.5800 81423.0100 224679.6400 587492.8100 393665.5300 1718187.0000 2052652.6200 235453.6200 31049.4600 17536.1200 18369.9200 22849.2400 3923526.7500 3417098.2500 8787336.0000 4699348.5000 6156034.5000 TG(C52:5) M+Na 15392.6900 1050424.1200 989411.3100 1027512.8100 1088831.6200 1009601.5000 37224.9900 18176.6000 15628.9100 142028.8900 7569093.5000 16383927.0000 19562274.0000 26664710.0000 20818814.0000 16146.9300 2014592.8800 1607265.3800 1891021.1200 2552201.0000 2921590.0000 39120.5500 56023.3300 19313.6500 17007.3700 20556.5100 13910471.0000 39387624.0000 35597212.0000 37732108.0000 28187738.0000 25119.0000 1054992.6200 815653.1900 429428.2200 318516.7800 837935.6900 20441.1100 14588.7800 65157.1900 15714.4000 23280970.0000 23245280.0000 20664452.0000 25452520.0000 18428088.0000 7225.2300 72700.1500 241895.5600 153132.5900 573437.1200 626340.1900 22172.6300 1918074.6200 1685121.8800 4622770.5000 2611309.7500 2971526.7500 TG(C54:0) M+Na 13765.3300 4418.3000 26109.7200 25391.7600 34056.0800 31764.5200 25527.7200 215648.7500 335631.7200 401909.5000 466831.9100 363001.4700 98788.2300 53358.4400 39558.1400 94478.3100 89652.7800 498476.9100 1570350.6200 794570.0000 822858.1900 610536.8100 155241.6600 92735.2800 32568.0900 27600.3800 89476.6500 621169.5000 439047.4700 491877.6600 578884.6900 309203.5600 15672.3900 11140.4700 67581.8700 68649.2300 110843.9300 29346.5500 93807.8400 TG(C54:1) M+Na 20300.8500 10963.6800 12053.1000 407936.7200 531038.8100 491356.9100 645762.0600 794187.9400 17085.5400 48861.0000 21706.2300 54365.3800 1696053.3800 3565666.0000 5819500.5000 5986020.5000 3064050.7500 993939.7500 591625.8100 868888.6900 1006117.3100 1309466.7500 15887.0400 19549.1700 3490851.0000 15996379.0000 10481580.0000 10842705.0000 5732966.5000 181074.0200 1292890.8800 837394.0600 556919.1900 537242.6900 1305526.3800 20384.5400 16375.1600 15302.6600 6162281.5000 4608618.0000 6258602.5000 8883443.0000 3211575.7500 17436.8600 12625.8400 111771.2300 36231.8200 342377.0000 444503.2200 19303.5700 17726.3200 570107.1200 380370.9700 1289149.2500 825183.7500 987861.9400 TG(C54:1) M+Na_1 18842.6700 249535.5200 310556.0000 288373.6600 302296.7800 312011.0300 19587.2700 18418.6400 20890.4800 1511784.1200 2770876.2500 3368292.0000 3226055.7500 2626924.0000 7891.5400 656785.8100 388111.2500 455384.1200 560108.8100 716087.1900 13561.7300 3673466.0000 11929333.0000 6291706.0000 6059311.5000 4232367.0000 112216.2400 791358.2500 593750.5600 256310.0600 229112.1100 496554.0900 14376.6100 13123.0100 12367.6700 5286694.0000 3012120.0000 3099332.0000 4901247.5000 1850720.6200 21831.0400 42532.1100 28151.5100 176291.1700 188378.4800 447501.4100 329963.8800 675675.8800 471549.4100 625601.8100 TG(C54:2) M+Na 29033.2500 16462.8200 20500.2900 23729.8000 93059.5500 18263.5100 19427.9100 72200.8600 27378.6000 22480.7600 62251.3900 62911.6900 23441.3500 23495.8000 51370.6100 2233235.7500 2402146.7500 2395428.7500 2621936.0000 2643628.7500 83970.8200 485832.3800 118907.7000 170862.2700 114621.6200 7813003.5000 12479504.0000 13939487.0000 14919371.0000 13992451.0000 30794.6800 42155.8000 24145.2200 55599.0500 23942.7500 5588561.5000 3108676.2500 4109249.2500 5199623.5000 5513678.5000 47945.3800 90798.4100 72047.0000 127469.8100 185311.5200 14738875.0000 29218350.0000 22433560.0000 25518510.0000 21862666.0000 26990.0800 54006.3600 865421.3100 77484.0200 65911.5200 4647042.0000 3571332.7500 2098682.5000 1855089.8800 3574503.7500 228215.5600 101958.1900 69965.3400 118318.6600 52855.9200 21854810.0000 19455894.0000 18132990.0000 22349762.0000 14138056.0000 43019.7800 22933.6500 19401.6900 23199.7500 37483.2300 201202.0200 496434.1600 383485.7200 1465174.6200 1995931.6200 99898.7900 26254.7600 14085.5600 33647.5800 67615.0700 2103815.2500 1462476.5000 3561002.2500 2140459.7500 2673268.2500 TG(C54:2) M+Na_1 45865.2500 21779.5700 39166.3900 47575.4400 157871.5600 47888.3800 42672.7000 98724.6200 27378.6000 38803.9100 74517.0200 50329.1400 63447.1800 59430.9000 52454.2700 4022573.7500 3994360.7500 3872780.7500 4605603.5000 4520636.5000 118312.3000 302321.4100 169890.8800 473796.6200 97256.7800 14177961.0000 24946470.0000 30824902.0000 33236128.0000 23534920.0000 90104.3100 54257.7800 26095.2900 70439.5700 72186.6800 8063578.0000 5038217.5000 6442978.5000 8500961.0000 9534804.0000 109318.7300 107858.2800 83129.6200 155701.4700 177519.9800 26556632.0000 82717080.0000 56999360.0000 60531188.0000 42724324.0000 74012.4500 34385.5000 956341.5000 56513.3600 66145.7300 9447613.0000 7500733.5000 4011006.2500 3767965.7500 7042420.0000 228215.5600 66186.4100 112856.8100 117047.9700 38234.8100 48691344.0000 34855508.0000 36023312.0000 49421904.0000 23798302.0000 50651.6200 29192.8800 26163.7300 22860.4500 43281.5400 177260.0800 820138.5000 535187.9400 2467174.5000 2934090.7500 162791.9400 27759.0900 29454.5100 25329.0600 47302.5800 3899891.0000 3005184.0000 7361404.5000 4248977.0000 5895833.5000 TG(C54:3) M+Na 337214.8800 174460.7700 150114.0300 160187.9200 538792.5600 219401.2700 154438.8400 286394.6600 231603.0200 199199.5800 287768.9100 277666.7200 200833.5000 259112.9500 285286.2200 874369.0000 822499.0000 820374.5600 910355.4400 854527.0000 274879.4100 190273.8800 378918.9700 1291110.0000 318996.1600 2819884.7500 5183419.5000 5748658.0000 6591246.5000 6570242.5000 286894.0000 255515.5000 284734.8400 313063.2200 265537.4400 1584025.5000 1163695.8800 1341135.6200 1620165.0000 1756722.3800 325247.2500 317817.8800 313994.3400 452208.6200 1135788.8800 5477567.5000 11618352.0000 9090091.0000 11219027.0000 9260554.0000 232545.0800 272688.3400 72215.5400 204952.7300 405955.5000 1130917.8800 794593.6900 499049.0900 394052.7200 842224.3100 687893.6900 307296.8400 437538.9700 425242.6200 257989.1200 9887651.0000 8803791.0000 8241174.5000 9253151.0000 6504619.5000 269355.3800 186042.4200 254553.7500 172050.6400 255785.0800 60224.7500 193186.4200 94701.1500 446466.0900 471138.5300 705907.3100 181513.4400 183269.6400 208006.4200 275621.3400 874813.3100 825570.7500 1800836.3800 969938.5000 1161172.2500 TG(C54:3) M+Na_1 228158.8900 178312.7700 70603.2000 227978.8100 38035.4500 26149.0700 133258.6100 304001.7500 78744.8700 198205.2700 190456.7000 26355.4200 106362.9800 89709.6000 264800.0300 12839319.0000 14131969.0000 12572631.0000 15746355.0000 15727355.0000 330750.3100 2959123.2500 62552.8100 44606.5700 309570.5000 43830000.0000 75574216.0000 86347712.0000 98572288.0000 78787296.0000 257361.3300 75613.2300 19724.7200 32837.6400 107583.5900 30389990.0000 18676568.0000 22583962.0000 31797302.0000 33609924.0000 93861.7700 317817.8800 112661.0200 452208.6200 70057.6500 81820752.0000 183342032.0000 150482272.0000 165379920.0000 123356184.0000 187151.0500 41672.0900 3477521.0000 208222.6100 24489.7700 26170162.0000 21896854.0000 11105067.0000 10727178.0000 22128066.0000 111144.8100 307296.8400 227179.7000 468508.5000 89270.7700 127600320.0000 114456480.0000 112496616.0000 146653968.0000 92611520.0000 245823.3600 32402.6900 108455.3400 250140.2700 148637.7300 1081850.6200 3294622.7500 1993570.3800 8269048.0000 10589980.0000 484113.3800 217859.6200 183269.6400 171411.9200 169601.2000 12329469.0000 9942219.0000 23284562.0000 13526640.0000 17391194.0000 TG(C54:4) M+Na 130654.0900 167865.3600 105054.9800 136914.7500 193762.1700 158912.3000 197695.1200 199796.6700 185372.2700 204131.9500 185790.0600 172573.2700 92193.0000 142717.7800 137398.1700 503170.2500 563124.7500 493867.6600 696302.1900 666248.3100 244193.9800 1293708.6200 238145.5800 629963.8100 156832.4700 2475867.0000 4186777.0000 4365910.5000 6069990.5000 6445410.5000 146542.8600 151737.4700 98729.7800 145155.6900 85051.7800 1158216.1200 759124.0000 816674.3100 1354674.6200 1323971.3800 157330.0900 217298.0500 129226.7800 238864.9500 483008.6600 4670009.5000 11885911.0000 8475253.0000 8924928.0000 8002430.5000 134019.2700 133406.2000 460072.3400 162227.3600 224048.5000 663512.2500 588244.3100 322997.2200 270605.5300 544364.3100 198815.3000 236044.9200 221403.8900 193814.7700 297116.3400 6429284.5000 6044121.5000 5394048.0000 6337120.0000 5103887.5000 170383.6700 113710.3000 89261.4400 135731.2300 159610.3000 30896.9000 112146.1600 73309.0000 393425.8400 468835.0000 483698.5000 221059.5000 172092.6400 236558.2500 166333.9100 575024.2500 472847.8800 1415985.3800 923537.6900 828071.4400 TG(C54:4) M+Na_1 123855.9400 16423.7100 54724.1700 41149.0400 162962.0000 82788.4500 41748.2000 22116.1300 55756.1900 17896.4200 41452.3300 102341.9100 60845.0900 16125.6200 4927126.5000 5024698.5000 5036063.5000 5887282.0000 6053724.5000 46069.6800 122820.8100 99896.1900 173864.8000 14973.3200 19634064.0000 37768828.0000 40940092.0000 49262336.0000 42935196.0000 82350.3800 81883.6600 101454.7000 51078.0600 103756.3500 9707059.0000 6554380.0000 7997046.5000 11810715.0000 11740193.0000 129506.7900 178928.9800 139931.7800 69007.5600 66148.5600 35085060.0000 84563432.0000 65655372.0000 78832208.0000 63055500.0000 84263.6200 116119.8400 119309.7700 7928.4400 7576075.5000 5568062.5000 2953005.2500 2838012.0000 5449694.5000 254553.3300 108345.8800 138293.2000 192503.2300 65244.0400 63093260.0000 57206188.0000 56277968.0000 65293248.0000 43911684.0000 16641.5300 40754.9800 72587.6000 56124.0800 109183.1600 309580.2800 1030245.5600 694992.4400 2973416.7500 3273236.2500 98453.6300 23820.4200 53265.8600 42758.4200 52855.1300 5703268.0000 5153622.0000 11854531.0000 6523994.5000 8339778.0000 TG(C54:5) M+Na 2596136.0000 2450270.2500 2592490.7500 2681340.0000 2622597.2500 2997142.7500 2635472.7500 2045181.0000 2724950.2500 2813316.7500 2405602.7500 2554430.2500 2723727.2500 2745658.2500 2797364.0000 3353011.7500 3342731.7500 3202622.7500 3746415.7500 3602248.0000 3312044.7500 2793870.0000 3113636.0000 2860840.0000 3137164.0000 17105832.0000 31084750.0000 38905568.0000 48341084.0000 44056788.0000 2614395.7500 2666672.0000 2494481.2500 2597231.0000 2868811.0000 6491609.5000 4327994.0000 5422964.5000 8151336.0000 8896551.0000 2964486.7500 2686151.2500 3081693.7500 2658113.5000 2916263.7500 31353010.0000 85431304.0000 70897672.0000 70192600.0000 54486444.0000 2400509.0000 2691804.2500 2620371.0000 2674170.2500 2636957.2500 3754357.2500 3119180.7500 1490007.1200 1214169.0000 3132540.0000 3018467.2500 2963442.7500 2848973.0000 2867199.0000 2803877.2500 47067744.0000 42652428.0000 42258932.0000 50111248.0000 36983716.0000 2760449.2500 2816113.2500 2677667.7500 2789883.0000 2920150.2500 232742.0000 667213.9400 497308.3400 2068049.3800 2465502.7500 3132342.2500 2662195.7500 2488876.7500 2843895.7500 2635330.2500 4351927.0000 3926360.0000 10067476.0000 5931113.5000 6811084.0000 TG(C54:6) M+Na 201450.4800 188179.0800 193039.3900 241768.5000 245992.3600 192964.1700 172135.2300 211797.1200 236113.3000 242250.9200 186783.1100 240311.9800 210935.8900 184110.3000 176463.5000 1421600.8800 1278416.1200 1243045.5000 1792370.5000 1604476.3800 301261.8400 870848.0600 201658.6200 215812.8000 244562.5200 7590489.5000 14669400.0000 16283044.0000 23061546.0000 20892056.0000 194960.9400 196663.4200 150429.8300 187310.6900 209843.5000 2280963.7500 1894216.3800 2246431.7500 2861547.2500 3138372.2500 266506.1600 243754.5600 221555.0600 231627.5800 227097.8300 13358493.0000 36761756.0000 31385342.0000 33817284.0000 25425934.0000 166799.2500 150837.3000 150426.5200 211015.2300 189919.4200 1370659.6200 1074534.1200 605479.4400 472690.0900 1011376.9400 220893.0800 290180.6900 221298.2700 240042.6900 228248.5600 21320286.0000 22342662.0000 19267544.0000 21020040.0000 17160788.0000 268611.7500 183345.7700 210691.1900 197272.5600 222871.3300 43751.3600 185990.2700 175905.7500 642819.5600 714465.3100 183847.2700 175193.5000 270892.1600 244581.3300 290480.5000 1687239.0000 1709485.6200 4450298.0000 2405792.7500 2580753.7500 TG(C54:7) M+Na 14769.5100 673316.5000 609986.1200 646078.5600 792468.0600 846112.8100 54142.5900 3332504.7500 6849888.0000 7035651.5000 9680649.0000 9987069.0000 932218.4400 794589.9400 1014690.0600 1283425.1200 1422560.0000 14440.0900 17190.3800 25933.2300 18567.3800 7365463.5000 17372738.0000 15479195.0000 18202376.0000 12347459.0000 788914.3100 637359.5000 337124.6600 227376.4500 582981.0000 18781.3300 18218.5300 9777503.0000 10091991.0000 8382444.0000 8828639.0000 8183728.5000 20604.9800 32353.3200 222000.9400 158921.2300 377688.0900 357256.9700 866399.7500 756435.7500 1882365.6200 1093679.8800 1230187.0000 TG(C54:8) M+Na 52891.4100 87851.9600 63076.3400 83658.5200 74387.7800 976237.2500 1876622.0000 1837765.0000 2870769.0000 2883736.0000 8154.8100 162956.5200 120287.1500 167480.3000 277043.4100 276670.9700 1754996.6200 3930254.0000 4129556.0000 4199359.0000 2873137.0000 18325.0800 37293.2900 29402.8800 28427.0500 2509814.7500 2877843.7500 2455853.2500 2431514.7500 2342240.2500 25172.0400 24098.2700 73467.3200 11674.1300 234989.6700 127359.2800 488911.6200 191218.9400 321017.2800 TG(C56:1) M+Na 11116.9200 19893.6500 35011.2600 44323.7100 65135.2800 108955.9000 94289.2700 267261.2800 334797.9700 348529.7800 573490.6900 459123.9100 160288.4800 95487.8000 128075.5900 225066.3300 169721.5600 564059.0000 1744749.5000 1353114.8800 1574271.0000 755754.0000 244649.4200 141274.6700 103760.8000 64223.5300 155878.7800 14391.2700 710585.4400 578327.3100 685209.3100 973325.0600 353043.8400 12427.7300 31174.4100 32613.0100 56925.7200 62881.3900 96109.5600 75600.5200 86296.0700 TG(C56:1) M+Na_1 24538.8200 23563.2100 29644.0900 162843.2300 189537.7700 201178.6100 196777.6700 209898.8100 7471.7500 72672.5300 22958.3900 33466.9900 39638.2800 111074.2100 709049.3100 1973984.0000 1139382.6200 1181974.5000 782836.8100 13759.7700 36167.9500 39795.0800 24328.0200 23907.7700 57690.7500 451807.6600 313956.6200 238472.6700 380640.0900 212690.0800 19194.1400 23251.7000 37761.6200 25537.1500 64207.0800 38588.3700 68972.8200 TG(C56:2) M+Na 14750.4300 7739.7200 527389.8100 616955.3100 493198.9100 673862.1900 630594.8100 31632.1600 1085596.7500 1557353.8800 1784288.8800 2044703.6200 1859415.1200 12356.6600 1169063.6200 622268.0000 880290.7500 1130143.3800 1091656.1200 2266753.2500 6346730.5000 4231409.0000 4802001.5000 3390210.7500 12571.8200 29262.5800 1314280.1200 1114996.0000 662508.0000 467223.3400 849812.0000 19338.5800 3848198.0000 2925706.0000 3176707.2500 3507960.0000 2159431.7500 34924.8000 116859.9000 38001.7700 292471.6200 340351.9100 14087.8800 342227.6600 269029.8400 604333.8800 299754.0300 448200.6600 TG(C56:2) M+Na_1 7312.0900 468062.2500 532237.1900 467636.4100 576518.0000 637296.4400 17377.1800 36232.8600 1379118.8800 2146070.2500 2640822.7500 2882530.7500 2278241.5000 8512.5600 1089907.6200 620413.9400 804949.9400 1264754.5000 1262210.3800 14998.2200 4021860.0000 11931596.0000 7630005.5000 8051436.5000 5392710.0000 83935.1600 1558311.0000 1064075.8800 541962.6900 477399.7800 1069396.5000 5064964.0000 3739582.2500 3824869.0000 4841549.5000 2530444.2500 18901.9000 74373.6600 31990.2100 327151.8400 370549.7800 608115.9400 356275.7800 814264.5000 522525.5900 674207.4400 TG(C56:3) M+Na 24924.1300 18809.0600 14203.0500 447537.9100 416422.0000 485500.7800 534850.8800 460203.0000 47278.1100 103361.9100 14474.9900 1486853.0000 2246187.0000 2749379.2500 4429694.5000 2630288.2500 20977.0300 14795.5300 877054.3100 540875.7500 719263.5600 910767.3100 951934.4400 18010.2000 16859.3200 17145.6900 48250.3200 16057.5400 2812246.0000 7376539.5000 7257344.0000 8882861.0000 4961319.5000 325030.1200 6361.8800 819765.2500 605014.9400 341851.2800 208226.4500 615006.5000 114906.8400 15210.6600 28832.9200 4465187.5000 3910583.2500 3946832.7500 6843527.5000 2719598.7500 26329.2200 104718.6200 79690.2600 340578.9700 412168.7500 89227.2500 17944.1600 411996.8400 363700.2800 740367.5000 715002.1900 830391.4400 TG(C56:3) M+Na_1 17053.7400 16372.3600 19052.7600 18083.7400 3179489.7500 3322368.7500 2974512.7500 3734078.2500 3754243.0000 13291.1300 36505.5300 14878.6300 81557.1300 14623.3400 6155070.5000 9608719.0000 10399735.0000 12423183.0000 11081315.0000 24645.6400 15940.1700 6104838.0000 3375427.0000 4595348.5000 6527848.5000 6655582.5000 16516.5000 13601.0800 15915.4100 24175.3500 13129780.0000 35260356.0000 24315410.0000 29842666.0000 20051194.0000 17026.3800 297700.6200 18689.4500 7760903.5000 5918214.5000 3456154.7500 2821725.2500 5559757.5000 59129.4700 18802.7000 19533.5500 28832.9200 21022110.0000 17998744.0000 18606774.0000 20523576.0000 13532675.0000 10648.7300 200862.5500 605461.9400 357837.0300 1694869.6200 2128858.2500 90357.2500 11535.8200 1947020.3800 1734001.6200 3434561.7500 2342508.5000 2487707.0000 TG(C56:4) M+Na 5900.2700 704441.3100 757162.4400 606771.5600 810245.3100 684450.2500 18422.8800 22509.0800 95369.1900 15250.2700 2242127.2500 3754848.2500 3876293.0000 4962647.0000 4786820.5000 1209935.8800 664262.1200 1129730.3800 1418936.1200 1477541.0000 21391.4800 34349.5200 14465.4600 44367.3100 16216.0500 4194507.0000 10639875.0000 7757314.5000 7668236.0000 6295596.0000 17850.0000 72043.7500 16137.9400 985563.4400 805159.0600 539288.9400 308800.7200 722550.5600 70773.0700 37289.6200 5855796.0000 6002580.5000 4576535.0000 5962698.5000 4270095.0000 34160.9600 162219.4200 157066.2800 530620.9400 529027.6900 47767.5000 636058.7500 597875.7500 1139972.6200 619861.2500 798203.4400 TG(C56:4) M+Na_1 16950.6800 19592.7000 17701.6100 2731410.2500 3187060.7500 2798028.7500 3592609.7500 3364434.0000 21614.2200 17382.1500 54191.8100 9323395.0000 16218068.0000 18078368.0000 22727990.0000 17857166.0000 5369370.5000 3204878.0000 4358361.5000 6249534.0000 6562392.5000 16316.6900 18887.1200 41438.6900 26272.8400 23967.1200 19790658.0000 55686188.0000 42191632.0000 47820836.0000 33218424.0000 22173.3700 48981.9400 4790129.5000 4236436.5000 2249587.2500 1893003.1200 4372104.5000 84552.5900 19881.1500 44073.7100 74808.6600 30868046.0000 26898600.0000 26269018.0000 32804680.0000 20788238.0000 244905.8000 770776.2500 507821.3800 2124777.7500 2320511.0000 15947.5800 3138382.0000 2671037.7500 6406470.5000 3697222.0000 4487201.0000 TG(C56:5) M+Na 14014.3700 7385.0000 452603.3800 465377.3400 525132.0000 566660.9400 511207.1200 15664.6800 107345.5200 1628317.5000 2830907.2500 3045181.2500 4031461.2500 3905399.2500 821067.6900 628812.1900 733390.7500 1071136.6200 1169557.6200 16895.6100 22678.3200 34850.8300 3306771.2500 7683108.5000 6273372.0000 5812308.5000 5188352.5000 16603.8700 679467.0600 436295.2500 541726.7500 237323.3300 449711.5900 80475.9100 15583.1900 4369527.5000 4348160.0000 3725257.0000 4194465.5000 3420770.2500 23770.7300 41790.3000 49602.6600 295292.9400 315885.7500 15022.0800 11220.5000 451435.3400 398163.1600 927374.5000 512102.6600 637938.5600 TG(C56:5) M+Na_1 3455599.0000 3542963.0000 3398823.2500 4194725.5000 3878694.0000 25665.3900 17426.5300 111514.8400 16066.8200 11815829.0000 20521186.0000 23581858.0000 28622174.0000 24742448.0000 16985.5600 6932046.0000 4200738.5000 5451508.5000 7877896.0000 7851098.5000 25682.2600 68071.6000 22444.7300 74682.1500 20190.4800 20019158.0000 61249568.0000 44830188.0000 47307184.0000 36496228.0000 43146.4500 4626861.5000 3903138.0000 2154421.7500 1677335.0000 3888467.0000 58937.9400 20703.2100 22138.8300 75240.2800 7067.4500 32650800.0000 30624826.0000 29287584.0000 36502508.0000 24271266.0000 13284.0800 349390.4100 907908.5600 639848.0000 2476010.0000 3145772.7500 16117.8300 3177352.0000 3188672.2500 6697110.5000 3901058.7500 5003575.5000 TG(C56:6) M+Na 13632.5000 22380.2200 28547.9700 3105155.7500 2922619.2500 3047114.2500 3493516.0000 2904648.0000 39839.5000 11690.5800 94428.2800 10999595.0000 18439562.0000 19047944.0000 27273370.0000 25552150.0000 17165.0100 4879481.5000 3567102.2500 4545012.0000 6023933.5000 6525020.0000 19181.9700 32333.5300 32863.4900 43374.2800 28363.3500 21789494.0000 51006732.0000 44788004.0000 39380412.0000 33634956.0000 28466.2600 11318.1100 3877504.0000 2627754.0000 1502245.6200 1297898.8800 2648968.7500 44672.7500 18187.2600 22476.5000 29277.4000 27302398.0000 26752624.0000 24852458.0000 28354434.0000 21689140.0000 176676.3800 568164.1900 376892.5900 1756632.3800 1554342.0000 15214.0100 2553629.2500 2472242.7500 5786526.5000 3224359.7500 3978187.2500 TG(C56:7) M+Na 16444.9800 1743658.0000 1787041.3800 1811585.1200 2316910.2500 2038839.5000 19694.1600 21717.8300 99357.7700 7650368.0000 13584887.0000 14021316.0000 19559266.0000 19228920.0000 19858.2100 2407166.2500 1817486.6200 2103904.2500 3010018.7500 3087851.0000 22737.9800 76275.5900 15470.2200 89882.4800 21951.1200 16725499.0000 42350380.0000 35700748.0000 40692780.0000 28294006.0000 18064.1600 21613.4000 43596.6600 2360296.7500 1928031.8800 1284043.8800 944086.4400 2117202.2500 26364.2300 18661.6800 18794.4800 48288.5300 17482754.0000 18050414.0000 17161066.0000 17418666.0000 15728947.0000 73598.8400 505463.7200 349954.2200 918622.7500 943909.9400 1923776.1200 1694698.3800 3617852.7500 2354347.2500 2765352.2500 TG(C56:8) M+Na 6542.4200 744597.0600 701474.2500 755374.2500 984699.0600 771729.6900 18081.8900 14241.7500 52558.7000 3659720.0000 6756694.0000 6750976.0000 10037835.0000 10634561.0000 1063304.0000 968748.6900 1126538.6200 1448339.3800 1394360.0000 15655.4500 17231.1300 14659.9400 7206458.5000 17228040.0000 15796480.0000 17624638.0000 12174648.0000 11007.6900 670550.9400 507297.8400 277294.2800 235710.5000 532049.0600 12959.3200 15254.9400 9233761.0000 10251237.0000 8167389.5000 8481009.0000 8470259.0000 21288.5500 196923.0200 103296.1600 397937.1200 486328.4100 949450.8100 726699.0600 1951412.3800 1034988.1900 1189492.3800 TG(C56:9) M+Na 8664.2900 70726.0900 112510.7500 94706.7300 193689.9500 189545.1400 646094.7500 1654682.6200 1539875.5000 2409139.2500 2757240.0000 12598.9500 225261.9400 173829.1400 210959.3900 280952.6600 341449.4700 16639.5900 17242.6600 1469819.6200 3325188.2500 3258136.7500 3606707.7500 2595147.7500 3636.9800 77786.5200 92634.8800 36127.9700 9983.6200 80933.3000 1812522.1200 1862205.5000 1789970.5000 1768744.5000 1883585.0000 6232.7500 28134.7200 59465.9700 6829.1000 140060.6700 109141.5400 441770.6200 181860.1400 265957.6600 TG(C58:10) M+Na 13183.8100 142114.5600 139224.9200 226290.3300 185159.6100 170656.0500 999641.0600 1881217.0000 1933835.6200 3535098.2500 3183473.0000 190562.4200 148281.1200 187101.1900 293520.1600 325939.9100 1910979.0000 4933304.0000 4233964.0000 5076986.5000 3124172.2500 165793.8100 48457.9100 53922.4800 121873.1200 16466.4400 1875765.5000 2257001.7500 1993705.8800 1837102.5000 2658238.0000 18506.5100 13781.4100 33498.0700 74472.5300 69733.0300 179183.4200 201868.0200 474417.5300 216287.7000 334867.6600 TG(C58:11) M+Na 6139.0100 17816.1800 32574.1100 32552.0700 41839.2000 56655.8400 54169.8900 411355.4100 944984.6900 785364.7500 1411142.1200 1584227.5000 72324.0900 89521.3700 33185.2900 88950.4400 54074.6900 598543.6900 1266437.1200 1267250.8800 1508742.0000 967388.8100 30062.8400 28268.5200 867419.2500 789299.5600 738052.0000 768438.0000 1102514.3800 29117.4600 37497.6300 28721.1900 181968.2000 39299.4100 80728.3500 TG(C58:2) M+Na 7091.8000 104832.4100 100078.4600 64423.2000 78529.9000 56897.8600 17766.7800 177470.0500 242215.7500 257241.0000 313689.8400 218068.7500 5474.1800 228196.0800 106106.5000 155438.1700 227141.0800 209073.0800 15000.0200 611172.4400 1565273.1200 908289.0600 1122427.3800 742472.9400 191773.6700 199508.2700 43167.7600 62990.4100 180793.6200 6802.1900 526738.9400 500716.0900 500285.7800 476727.3400 339022.0600 35261.7500 37032.5900 69787.1500 28463.1500 30064.0600 77922.9100 69101.2400 63801.9500 TG(C58:2) M+Na_1 12746.8000 10482.0700 81546.3200 32997.6900 23365.5600 50927.1400 84423.5600 21458.7300 15999.6900 231873.0800 331526.7200 365375.8800 380439.0000 319124.8400 262371.0300 109162.4600 242264.8300 267960.9400 227304.3000 1330580.3800 4206984.0000 2477351.0000 2615596.7500 1595221.1200 13161.6000 212879.8800 184116.4500 50553.8100 51516.4100 166578.6900 666933.3100 556150.7500 510309.2200 770316.9400 373158.8400 7311.7400 8332.2000 18100.1800 14800.2800 23685.3600 23564.9000 35892.7100 65317.8100 11642.0700 143550.3800 75709.0900 193831.4200 102723.2900 92179.7900 TG(C58:3) M+Na 13229.4600 99961.6200 145536.0000 114914.1900 109821.0900 158846.0000 270808.6600 432244.1600 364576.0000 655766.5000 470101.2500 269505.0000 92269.7100 217836.3800 328913.9700 315271.0300 732641.6900 2044330.1200 1566152.8800 1923811.3800 1142887.6200 273478.1600 218106.6100 122807.1800 75443.3000 225059.5800 735824.1900 725459.8100 722024.1900 979446.6900 600308.6200 6777.2400 44664.1400 20717.0200 112951.9900 104699.1000 14542.2000 15162.5400 94571.4300 89072.0300 214624.5000 141127.4800 137996.5200 TG(C58:3) M+Na_1 10903.1500 6933.2900 403334.9700 431670.6600 418797.3400 427865.0000 504531.5900 14300.2500 762300.0000 1164670.3800 1174086.3800 1266147.2500 1386751.6200 1064330.6200 489975.4100 710799.0000 930726.6900 1001449.6900 2605918.7500 7252936.5000 4888687.5000 5499932.5000 3490362.7500 17307.0200 1167756.8800 1066335.0000 451975.9100 430637.2500 1017945.6900 17467.7300 2541148.0000 2432289.2500 2192320.2500 2505534.2500 1728062.3800 16026.3700 119260.1900 26950.3800 320577.9400 337021.1200 15000.9100 287468.3800 238666.6700 537492.1900 369562.6200 346670.2800 TG(C58:4) M+Na 370969.4100 434896.9700 410379.6600 445876.5000 325355.8400 777768.0600 1265811.0000 1243483.3800 1545820.3800 1745080.6200 605203.5600 409136.2800 494070.7500 627754.3100 595510.1900 1897815.3800 4269278.0000 3393742.0000 3912986.7500 2587714.2500 538806.6900 458533.1200 320806.4400 178932.7500 394478.8800 2066901.0000 2058985.3800 1937469.5000 2032353.5000 1557215.0000 23653.2700 67276.5700 34505.2500 316301.0900 345617.4700 256033.5500 241923.0600 525914.5600 306332.3100 383528.5300 TG(C58:4) M+Na_1 17116.8900 16164.8100 14152.2000 15437.4500 765716.8100 840572.5600 713021.4400 743972.4400 695556.0000 1697384.3800 2516550.7500 2595858.7500 2898719.7500 3147439.0000 8954.9600 1523406.6200 858156.3100 1116395.0000 1763319.3800 1688368.1200 13969.0300 6232.7500 4512578.5000 12129109.0000 8449319.0000 10271248.0000 6487281.5000 1646443.6200 1345967.5000 648674.1900 609421.6900 1194044.8800 14045.7400 10438.3600 4803085.5000 4720635.0000 4384074.5000 5210670.0000 3640500.0000 41247.8100 139860.9700 80018.0100 614328.7500 609108.4400 588909.9400 667950.0600 1267462.8800 729030.6900 831710.2500 TG(C58:5) M+Na 298247.5900 248954.6200 210579.0500 322247.1900 339815.9100 15055.6100 631534.3100 1087051.5000 1131818.0000 1809314.5000 1616860.8800 503936.7500 307270.2500 415873.0900 492162.5000 553743.9400 14868.4600 1470933.6200 3327176.2500 2844061.2500 3546856.2500 2287887.7500 421125.6200 234797.0500 150757.0800 193861.4800 289354.6900 17179.8100 1911883.0000 1735245.1200 1593802.6200 1855121.0000 1411701.0000 32374.1400 36497.0000 155692.3600 148648.2700 195670.0000 156693.2300 398671.0000 279796.1600 329977.8400 TG(C58:5) M+Na_1 1786255.5000 1987525.8800 1847237.8800 2234881.2500 2002922.8800 16082.7900 4026495.2500 6912205.5000 7017200.0000 8570807.0000 8160988.5000 3109665.0000 1873513.0000 2704959.7500 3608522.2500 3172360.7500 16132.0900 13928.7100 19452.0000 16717.7100 9684381.0000 24457618.0000 18595642.0000 21061582.0000 14209181.0000 18319.4000 2742579.2500 2235623.2500 1321200.3800 1140806.3800 2373843.2500 41928.8600 11517436.0000 10601148.0000 10363925.0000 11266675.0000 9152573.0000 19234.6300 14297.7400 180356.8300 404415.5900 357121.5300 1428515.8800 1616213.3800 1542452.5000 1326963.6200 2697461.7500 1825106.0000 2005979.8800 TG(C58:6) M+Na 1754512.0000 1749582.5000 1640723.1200 2087553.3800 2182859.7500 18479.9200 18080.2600 4451451.5000 7372133.5000 7901543.5000 9969647.0000 9555797.0000 15895.9700 2520263.7500 1913100.8800 2497473.2500 3048845.7500 3103931.0000 18858.7600 17837.7500 18444.4400 17613.1900 8882394.0000 21853986.0000 18143694.0000 20974648.0000 14625149.0000 17017.2900 2602128.2500 1791911.0000 1008653.1900 803643.5000 1984325.3800 22386.7200 12113896.0000 11409185.0000 10875506.0000 11629540.0000 9375993.0000 4051.1400 121953.9800 246814.1200 211686.0000 874015.8100 871023.5600 1240843.6200 1249601.5000 2477794.7500 1490272.3800 1653073.3800 TG(C58:7) M+Na 352364.1600 325718.8800 405094.7200 332786.6200 366016.5300 18294.4800 953877.4400 1629037.3800 1557391.5000 2134071.0000 2212011.0000 14303.6300 391634.5300 370892.0900 458198.3800 509323.2800 511069.0000 19527.1800 15547.7700 37577.9700 1807487.5000 4743355.5000 3728690.0000 4460152.5000 3133207.2500 19967.5300 24116.6600 365183.0900 402845.4700 219937.5800 188560.8600 373670.1600 17785.1900 13605.5100 2355981.0000 2283458.0000 2110388.2500 2281798.7500 1883401.5000 96644.5900 30936.2900 151897.9500 185986.1100 234642.2300 187218.5600 381627.5300 206483.1100 346003.1600 TG(C58:7) M+Na_1 2125873.7500 2091612.0000 2076825.0000 2569169.0000 2419410.0000 33785.9600 3543756.2500 6010569.5000 6752632.0000 9213380.0000 9154343.0000 17624.7000 2901245.0000 2199323.2500 2616872.7500 3344548.7500 3378077.2500 14673.9000 15016.6300 7514474.5000 17302824.0000 14722615.0000 15275608.0000 12077779.0000 2946448.7500 1833897.0000 865023.2500 968861.0600 2033665.1200 20592.2500 10533032.0000 10205077.0000 9191670.0000 9137301.0000 8248443.5000 56467.9400 154225.5300 162516.3300 640775.0600 678689.0600 1001575.8100 894295.6900 2068317.0000 1327076.6200 1355952.3800 TG(C58:7) M+Na_2 933632.0000 807843.0600 853914.9400 1301171.5000 989171.5000 18065.3500 3539069.0000 5776588.0000 6201086.5000 8532800.0000 7845201.5000 1073538.1200 915502.2500 1128170.1200 1751538.3800 1619411.0000 7450764.5000 19198728.0000 16814624.0000 15951332.0000 10944653.0000 1105042.3800 842911.5600 483772.1600 383791.6200 960224.8100 8250494.0000 8164922.5000 7309252.0000 7216981.5000 7284993.5000 75223.9400 179993.9200 221821.4200 570361.6900 693544.0000 871755.0000 724670.1900 1771625.8800 1024211.7500 1275082.5000 TG(C58:8) M+Na 14143.5900 1774897.6200 1600241.3800 1489699.5000 1820612.8800 1752879.1200 34887.7600 4278796.5000 8448229.0000 8848065.0000 13513568.0000 12220179.0000 2085865.6200 1429283.6200 1890808.0000 2873149.7500 2557899.2500 18679.1700 40837.3700 20157.4000 22884.8500 9786093.0000 25136518.0000 22690902.0000 24682680.0000 16322377.0000 16531.8000 2095212.3800 1778062.0000 975141.8100 710026.3100 1856416.8800 24663.6200 13685.3500 17684.6400 11754203.0000 12750912.0000 11757320.0000 12454096.0000 10901853.0000 15292.4300 136785.0000 345821.0900 292834.2800 857584.6900 802917.8100 1359346.3800 957963.0000 2162019.0000 1229258.1200 1675471.3800 TG(C58:9) M+Na 544657.4400 417816.9700 453208.4700 592389.6900 629941.0600 19599.3000 1971528.8800 4042271.7500 3915372.7500 5816290.0000 6258183.5000 711857.0000 544816.9400 799383.0600 920487.8100 899595.3100 3344945.7500 8386546.5000 7642749.5000 8599477.0000 5598302.0000 481730.5300 372388.2500 210582.1400 199741.2300 364419.2200 5045776.5000 5420279.5000 4495485.0000 4478530.5000 4651582.5000 35521.8000 103861.7300 195381.9400 227288.3800 392847.7500 446363.5000 1013445.9400 626293.8100 599545.0600 Thiamine 3530320.7500 2500365.0000 2907974.0000 3172033.2500 2614046.0000 3452940.0000 3477616.7500 3978190.7500 3628136.2500 3491211.0000 3825673.7500 2971475.2500 4273589.5000 3640304.7500 3858236.7500 3547789.2500 2887436.7500 2753065.2500 3289059.7500 4798280.0000 5092151.5000 5331216.5000 4956547.5000 4224899.5000 4537769.5000 2157798.7500 3851695.2500 3811395.7500 4063136.0000 3754593.0000 4101476.0000 2931018.0000 3699889.0000 3817795.2500 4839261.5000 2043674.0000 2552308.2500 1957669.0000 1728970.3800 1455614.6200 5317862.0000 4723169.5000 5045268.0000 4217251.5000 3963353.2500 2334579.2500 382369.1600 4121490.2500 8656337.0000 4626794.0000 3456900.0000 3075281.2500 3544654.7500 3885173.0000 3046781.2500 3301666.7500 2052728.0000 1174243.3800 4989439.5000 5163981.5000 3884077.7500 3887943.2500 4074950.2500 4005274.7500 4503490.0000 1754336.1200 3457276.2500 40990.7600 3010002.0000 3092285.2500 3567094.7500 3657571.7500 3997049.2500 3600207.2500 2652191.2500 1217570.7500 4497561.5000 1573167.0000 2583364.7500 2506458.0000 3646564.7500 3832158.2500 3385565.2500 3317017.2500 4080695.2500 1138893.8800 1637856.8800 1671819.5000 1614621.5000 1855597.5000 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name pubchem_id inchi_key kegg_id other_id other_id_type ri ri_type moverz_quant 1-deoxymethylsphinganine NA 6.072 272.294861 4-Hydroxyproline C01157 6.822 132.06572 5-Oxoproline C01879 6.89 130.050186 Acetylcarnitine C02571 6.677 205.128616 Adenine C00147 2.221 136.061981 Adenosine C00212 2.684 268.104034 ADP C00008 6.914 428.036743 AMP C00020 6.677 348.070496 ATP C00002 7.262 508.003113 Betaine C00719 6.249 118.086502 Butanoyl-Carnitine C02862 5.932 232.154816 C18-Deoxysphingosine NA 6.209 284.294891 C18-Phytosphingosine NA 6.086 318.300507 C18-Sphinganine NA 6.28 302.305206 C18-Sphingosine NA 6.177 300.289734 CDP-choline C00307 6.958 489.115143 Cer(d18:1/16:0) NA 9.317 538.519348 Cer(d18:1/18:0) NA 9.771 566.550659 Cer(d18:1/18:1) NA 9.37 564.535095 Cer(d18:1/20:0) NA 10.223 594.58197 Cer(d18:1/20:3) NA 9.73 588.534424 Cer(d18:1/20:4) NA 9.375 586.518372 Cer(d18:1/22:0) NA 10.81 622.612976 Cer(d18:1/22:1) NA 10.261 620.598145 Cer(d18:1/24:0) NA 11.043 650.644714 Cer(d18:1/24:0)_1 NA 11.503 650.64502 Cer(d18:1/24:1) NA 10.738 648.628967 Cer(d18:1/26:0) NA 11.763 678.67572 Cer(d18:1/26:0)_1 NA 12.363 678.675842 Cer(d18:1/26:1) NA 11.307 676.661011 Cholesterol[-H2O] C00187 8.617 369.351593 Choline C00114 10.644 104.107422 Citrulline C00327 7.083 176.103119 CMP C00055 6.817 324.059296 CoenzymeQ10-NH4+ C11378 13.076 880.717468 Creatine C00300 6.604 132.077057 Creatinine C00791 3.533 114.066505 Cytidine C00475 5.395 244.09317 Cytosine C00380 3.057 112.05088 Cytosine_1 C00380 5.342 112.050858 Deoxy-Cer (m18:1/18:0) NA 9.738 550.55481 Deoxy-Cer (m18:1/18:1) NA 9.712 548.539978 Deoxy-Cer (m18:1/20:0) NA 10.244 578.586853 Deoxy-Cer (m18:1/22:0) NA 10.846 606.617737 Deoxy-Cer (m18:1/22:1) NA 10.809 604.602783 Deoxy-Cer (m18:1/24:0) NA 11.523 634.64917 Deoxy-Cer (m18:1/24:1) NA 10.849 632.632996 Deoxy-Cer (m18:1/26:1) NA 11.569 660.665039 Deoxy-DHCer (m18:0/18:0) NA 10.19 552.571838 Deoxy-DHCer (m18:0/18:1) NA 9.738 550.55481 Deoxy-DHCer (m18:0/20:0) NA 10.77 580.601868 Deoxy-DHCer (m18:0/22:0) NA 11.486 608.633606 Deoxy-DHCer (m18:0/22:1) NA 10.846 606.617737 Deoxy-DHCer (m18:0/24:0) NA 12.386 636.664917 Deoxy-DHCer (m18:0/24:1) NA 11.523 634.64917 DG(C32:0 )[-H2O] M+H NA 18.605 551.503052 DG(C34:0)[-H2O] M+H NA 21.651 579.534668 DG(C34:1)[-H2O] M+H NA 18.811 577.518799 DG(C36:1)[-H2O] M+H NA 9.684 605.550537 DG(C36:1)[-H2O] M+H_1 NA 10.511 605.55072 DG(C36:1)[-H2O] M+H_2 NA 21.968 605.551025 DG(C36:2)[-H2O] M+H NA 19.208 603.534912 DHCer (d18:0/18:0) NA 9.883 568.566589 DHCer (d18:0/18:1) NA 9.771 566.550659 DHCer (d18:0/20:0) NA 10.417 596.597778 DHCer (d18:0/22:0) NA 11.033 624.628967 DHCer (d18:0/22:1) NA 10.81 622.612976 DHCer (d18:0/24:0) NA 11.808 652.6604 DHCer (d18:0/24:1) NA 11.043 650.644714 DHCer (d18:0/24:1)_1 NA 11.503 650.64502 Dihydrofolic acid C00415 5.139 444.157379 Gal/GlcCer(d18:1/16:0) NA 9.006 700.57135 Gal/GlcCer(d18:1/22:0) NA 10.241 784.66626 Gal/GlcCer(d18:1/24:0) NA 10.841 812.696472 Guanine C00242 5.07 152.056839 Hypotaurine C00519 6.611 110.027359 L-Arginine C00062 13.095 175.119186 L-Asparagine C00152 7.412 133.060989 L-Carnitine C00318 7.169 162.112717 L-Glutamic acid C00025 6.611 148.060562 L-Glutamine C00064 6.905 147.076645 L-Histidine C00135 12.373 156.07692 L-Isoleucine C00407 5.834 132.102203 L-Kynurenine C00328 5.692 209.092316 L-Kynurenine_1 C00328 6.373 209.092377 L-Leucine C00123 6.478 132.102142 L-Lysine C00047 13.881 147.112991 L-Methionine C00073 6.409 150.058411 LPC(C14:0) NA 6.268 468.308624 LPC(C16:0) NA 6.784 496.339905 LPC(C16:1) NA 6.449 494.324432 LPC(C18:0) NA 7.261 524.371338 LPC(C18:1) NA 6.889 522.355713 LPC(C18:2) NA 6.59 520.339966 LPC(C20:0) NA 7.682 552.402222 LPC(C20:3) NA 6.823 546.35553 LPC(C20:4) NA 6.525 544.340027 LPC(C20:5) NA 6.207 542.324646 LPC(C22:0) NA 8.086 580.434021 LPC(C22:5) NA 6.608 570.35553 LPC(C22:6) NA 6.468 568.339844 L-Phenylalanine C00079 5.832 166.086411 L-Proline C00148 6.492 116.070992 L-Serine C00065 7.059 106.050247 L-Threonine C00188 6.908 120.065834 L-Tryptophan C00078 5.566 205.097382 L-Tyrosine C00082 6.31 182.081314 MG(C16:0) [-H2O] M+H NA 6.848 313.27356 MG(C18:0) [-H2O] M+H NA 7.347 341.30484 MG(C18:1) [-H2O] M+H NA 6.94 339.289185 NAD C00003 6.692 664.117249 NADH C00004 6.697 666.12384 O-LPC(C16:0) NA 6.936 482.36084 O-LPC(C16:1) NA 6.978 480.344177 O-LPC(C18:0) NA 7.38 510.393127 O-LPC(C18:1) NA 7.111 508.37619 O-LPC(C18:1)_1 NA 7.489 508.376312 O-LPC(C18:2) NA 7.092 506.360779 O-LPC(C20:3) NA 7.452 532.376343 O-LPC(C20:4) NA 7.104 530.359009 O-LPC(C20:4)_1 NA 7.437 530.359131 O-LPC(C20:5) NA 7.044 528.343201 PC(C28:0) NA 8.584 678.507202 PC(C30:0) NA 8.857 706.537903 PC(C30:1) NA 8.629 704.522888 PC(C32:0) NA 9.156 734.570068 PC(C32:1) NA 8.923 732.554016 PC(C32:2) NA 8.729 730.538025 PC(C34:0) NA 9.575 762.599426 PC(C34:1) NA 9.219 760.584717 PC(C34:2) NA 8.968 758.568848 PC(C34:3) NA 8.796 756.552856 PC(C34:4) NA 8.624 754.538025 PC(C36:0) NA 10.099 790.631592 PC(C36:1) NA 9.606 788.61676 PC(C36:2) NA 9.284 786.600342 PC(C36:3) NA 9.024 784.584778 PC(C36:4) NA 8.923 782.569519 PC(C36:5) NA 8.66 780.553406 PC(C38:0) NA 10.593 818.662354 PC(C38:1) NA 10.054 816.6474 PC(C38:2) NA 9.667 814.632141 PC(C38:3) NA 9.366 812.615356 PC(C38:4) NA 9.117 810.599609 PC(C38:5) NA 8.944 808.584778 PC(C38:6) NA 8.776 806.568542 PC(C38:7) NA 8.56 804.552551 PC(C40:0) NA 11.376 846.694214 PC(C40:1) NA 10.619 844.677368 PC(C40:2) NA 10.095 842.661499 PC(C40:3) NA 9.772 840.646667 PC(C40:4) NA 9.446 838.632202 PC(C40:5) NA 9.125 836.61615 PC(C40:6) NA 9.007 834.600281 PC(C40:7) NA 8.807 832.585266 PC(C40:8) NA 8.621 830.569092 PC(O-C28:0) NA 8.781 664.527466 PC(O-C30:0) NA 9.077 692.559021 PC(O-C30:1) NA 9.044 690.542053 PC(O-C32:0) NA 9.468 720.589783 PC(O-C32:1) NA 9.145 718.573853 PC(O-C32:1)_1 NA 9.382 718.573669 PC(O-C32:2) NA 9.068 716.557861 PC(O-C34:0) NA 9.937 748.620239 PC(O-C34:1) NA 9.538 746.604858 PC(O-C34:2) NA 9.446 744.589417 PC(O-C34:3) NA 9.098 742.574158 PC(O-C36:0) NA 9.99 776.650513 PC(O-C36:0)_1 NA 10.5 776.651123 PC(O-C36:1) NA 10.066 774.636719 PC(O-C36:2) NA 9.564 772.621338 PC(O-C36:2)_1 NA 9.974 772.6203 PC(O-C36:3) NA 9.45 770.604614 PC(O-C36:4) NA 9.094 768.589783 PC(O-C36:5) NA 9.105 766.573914 PC(O-C38:0) NA 10.554 804.68335 PC(O-C38:0)_1 NA 11.218 804.683533 PC(O-C38:1) NA 10.683 802.667908 PC(O-C38:2) NA 10.027 800.652222 PC(O-C38:2)_1 NA 10.428 800.651978 PC(O-C38:3) NA 9.988 798.63623 PC(O-C38:4) NA 9.588 796.619812 PC(O-C38:5) NA 9.169 794.606201 PC(O-C38:6) NA 9.068 792.588745 PC(O-C38:7) NA 8.869 790.574951 PC(O-C40:1) NA 11.312 830.699402 PC(O-C40:2) NA 10.612 828.683899 PC(O-C40:2)_1 NA 11.009 828.68396 PC(O-C40:3) NA 10.202 826.668152 PC(O-C40:4) NA 9.837 824.651428 PC(O-C40:5) NA 9.673 822.636658 PC(O-C40:6) NA 9.344 820.620667 Propionyl-Carnitine C03017 6.284 218.138901 Pyridoxine C00314 1.82 170.081253 Pyridoxine_1 C00314 4.647 170.081146 Riboflavin C00255 4.622 377.146027 SM(d18:1/14:0) NA 8.609 675.543823 SM(d18:1/16:0) NA 8.901 703.575256 SM(d18:1/16:1) NA 8.65 701.558777 SM(d18:1/18:0) NA 9.235 731.605896 SM(d18:1/18:1) NA 8.954 729.591492 SM(d18:1/20:0) NA 9.628 759.638245 SM(d18:1/22:0) NA 10.13 787.66803 SM(d18:1/24:0) NA 10.746 815.699219 SM(d18:1/24:1) NA 10.116 813.685425 Taurine C00245 6.084 126.022102 TG(C48:0) M+Na NA 16.571 829.725098 TG(C48:0) M+Na_1 NA 18.059 829.726501 TG(C48:1) M+Na NA 15.376 827.707703 TG(C48:1) M+Na_1 NA 16.299 827.70929 TG(C48:2) M+Na NA 14.85 825.694824 TG(C48:3) M+Na NA 13.895 823.679016 TG(C50:0) M+Na NA 18.377 857.756958 TG(C50:0) M+Na_1 NA 20.87 857.756958 TG(C50:1) M+Na NA 16.45 855.741272 TG(C50:1) M+Na_1 NA 18.383 855.741394 TG(C50:2) M+Na NA 15.717 853.726318 TG(C50:2) M+Na_1 NA 16.598 853.726074 TG(C50:3) M+Na NA 15.592 851.71051 TG(C50:4) M+Na NA 14.271 849.694275 TG(C52:0) M+Na NA 21.609 885.785461 TG(C52:0) M+Na_1 NA 25.107 885.788452 TG(C52:1) M+Na NA 18.671 883.769958 TG(C52:1) M+Na_1 NA 21.246 883.772644 TG(C52:2) M+Na NA 17.098 881.754761 TG(C52:2) M+Na_1 NA 18.713 881.755859 TG(C52:3) M+Na NA 16.7 879.740723 TG(C52:4) M+Na NA 15.374 877.726379 TG(C52:5) M+Na NA 14.438 875.708496 TG(C54:0) M+Na NA 25.615 913.819336 TG(C54:1) M+Na NA 21.912 911.802979 TG(C54:1) M+Na_1 NA 25.545 911.804443 TG(C54:2) M+Na NA 19.604 909.786194 TG(C54:2) M+Na_1 NA 21.625 909.787476 TG(C54:3) M+Na NA 18.042 907.772217 TG(C54:3) M+Na_1 NA 19.144 907.772461 TG(C54:4) M+Na NA 16.208 905.756958 TG(C54:4) M+Na_1 NA 17.104 905.757629 TG(C54:5) M+Na NA 16.017 903.742554 TG(C54:6) M+Na NA 15.336 901.725769 TG(C54:7) M+Na NA 13.751 899.710693 TG(C54:8) M+Na NA 12.89 897.694214 TG(C56:1) M+Na NA 26.287 939.835144 TG(C56:1) M+Na_1 NA 30.894 939.836243 TG(C56:2) M+Na NA 22.782 937.8172 TG(C56:2) M+Na_1 NA 26.07 937.818054 TG(C56:3) M+Na NA 20.38 935.803833 TG(C56:3) M+Na_1 NA 22.259 935.804504 TG(C56:4) M+Na NA 18.436 933.785583 TG(C56:4) M+Na_1 NA 19.794 933.78595 TG(C56:5) M+Na NA 16.494 931.772278 TG(C56:5) M+Na_1 NA 18.145 931.772583 TG(C56:6) M+Na NA 16.358 929.757141 TG(C56:7) M+Na NA 15.12 927.739258 TG(C56:8) M+Na NA 13.963 925.725403 TG(C56:9) M+Na NA 13.09 923.710999 TG(C58:10) M+Na NA 13.365 949.724731 TG(C58:11) M+Na NA 12.547 947.708923 TG(C58:2) M+Na NA 26.783 965.847717 TG(C58:2) M+Na_1 NA 31.562 965.850037 TG(C58:3) M+Na NA 23.281 963.835388 TG(C58:3) M+Na_1 NA 26.762 963.835938 TG(C58:4) M+Na NA 20.527 961.817261 TG(C58:4) M+Na_1 NA 23.254 961.818054 TG(C58:5) M+Na NA 18.226 959.804199 TG(C58:5) M+Na_1 NA 20.441 959.804688 TG(C58:6) M+Na NA 18.18 957.787231 TG(C58:7) M+Na NA 15.481 955.770447 TG(C58:7) M+Na_1 NA 16.362 955.77063 TG(C58:7) M+Na_2 NA 17.011 955.77063 TG(C58:8) M+Na NA 15.364 953.756165 TG(C58:9) M+Na NA 14.175 951.740173 Thiamine C00378 11.664 266.116028 METABOLITES_END #END