#METABOLOMICS WORKBENCH Armando_Alcazar_20250213_122112 DATATRACK_ID:5620 STUDY_ID:ST003730 ANALYSIS_ID:AN006120 PROJECT_ID:PR002316 VERSION 1 CREATED_ON February 14, 2025, 4:51 pm #PROJECT PR:PROJECT_TITLE Virus infection of honey bee queens PR:PROJECT_SUMMARY In this study, we investigated the impact of infection on honey bee queens by PR:PROJECT_SUMMARY conducting controlled laboratory infections. We then analyzed their lipid PR:PROJECT_SUMMARY profiles using head extracts. PR:INSTITUTE University of British Columbia PR:DEPARTMENT Biochemistry and Molecular Biology, Life Sciences Institute PR:LAST_NAME Alcazar Magana PR:FIRST_NAME Armando PR:ADDRESS 2350 Health Sciences Mall, Vancouver, BC, V6T1Z3, Canada PR:EMAIL armando.alcazarmagana@ubc.ca PR:PHONE 5416097172 #STUDY ST:STUDY_TITLE Virus infection of honey bee queens alters lipid profiles and indirectly ST:STUDY_TITLE suppresses a retinue pheromone component via reducing ovary mass ST:STUDY_SUMMARY In this study, we investigated the effects of viral infection on honey bee ST:STUDY_SUMMARY queens by conducting controlled laboratory infections and performing lipidomic ST:STUDY_SUMMARY profiling. Our analysis revealed that virus infections specifically reduce the ST:STUDY_SUMMARY queen retinue pheromone (QRP) component methyl oleate, a key signal in colony ST:STUDY_SUMMARY communication. Additionally, lipidomics data suggest that viral infection leads ST:STUDY_SUMMARY to a decrease in triacylglycerol abundances, potentially impacting queen energy ST:STUDY_SUMMARY metabolism and pheromone production. ST:INSTITUTE University of British Columbia ST:DEPARTMENT Biochemistry and Molecular Biology, Life Sciences Institute ST:LABORATORY Foster Lab ST:LAST_NAME Alcazar Magana ST:FIRST_NAME Armando ST:ADDRESS 2350 Health Sciences Mall ST:EMAIL armando.alcazarmagana@ubc.ca ST:PHONE 5416097172 #SUBJECT SU:SUBJECT_TYPE Insect SU:SUBJECT_SPECIES Apis mellifera SU:TAXONOMY_ID 7460 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Raw file names and additional sample data SUBJECT_SAMPLE_FACTORS - FQ1 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ1 L_2-7-2024_R-A1_16326; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ1 L_2-8-2024_R-A1_16422 SUBJECT_SAMPLE_FACTORS - FQ2 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ2 L_2-6-2024_R-A2_16321; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ2 L_2-8-2024_R-A2_16417 SUBJECT_SAMPLE_FACTORS - FQ3 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ3 L_2-6-2024_R-A3_16314; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ3 L_2-8-2024_R-A3_16410 SUBJECT_SAMPLE_FACTORS - FQ4 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ4 L_2-6-2024_R-A4_16315; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ4 L_2-8-2024_R-A4_16411 SUBJECT_SAMPLE_FACTORS - FQ5 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ5 L_2-7-2024_R-A5_16345; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ5 L_2-8-2024_R-A5_16441 SUBJECT_SAMPLE_FACTORS - FQ6 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ6 L_2-7-2024_R-A6_16338; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ6 L_2-8-2024_R-A6_16434 SUBJECT_SAMPLE_FACTORS - FQ7 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ7 L_2-6-2024_R-A7_16320; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ7 L_2-8-2024_R-A7_16416 SUBJECT_SAMPLE_FACTORS - FQ8 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ8 L_2-7-2024_R-A8_16330; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ8 L_2-8-2024_R-A8_16426 SUBJECT_SAMPLE_FACTORS - FQ9 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ9 L_2-6-2024_R-A9_16317; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ9 L_2-8-2024_R-A9_16413 SUBJECT_SAMPLE_FACTORS - FQ10 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ10 L_2-7-2024_R-B1_16323; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ10 L_2-8-2024_R-B1_16419 SUBJECT_SAMPLE_FACTORS - FQ11 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ11 L_2-7-2024_R-B2_16343; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ11 L_2-8-2024_R-B2_16439 SUBJECT_SAMPLE_FACTORS - FQ12 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ12 L_2-7-2024_R-B3_16340; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ12 L_2-8-2024_R-B3_16436 SUBJECT_SAMPLE_FACTORS - FQ13 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ13 L_2-7-2024_R-B4_16331; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ13 L_2-8-2024_R-B4_16427 SUBJECT_SAMPLE_FACTORS - FQ14 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ14 L_2-7-2024_R-B5_16335; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ14 L_2-8-2024_R-B5_16431 SUBJECT_SAMPLE_FACTORS - FQ16 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ16 L_2-6-2024_R-B6_16313; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ16 L_2-8-2024_R-B6_16409 SUBJECT_SAMPLE_FACTORS - FQ17 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ17 L_2-7-2024_R-B7_16333; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ17 L_2-8-2024_R-B7_16429 SUBJECT_SAMPLE_FACTORS - FQ18 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ18 L_2-7-2024_R-B8_16344; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ18 L_2-8-2024_R-B8_16440 SUBJECT_SAMPLE_FACTORS - FQ19 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ19 L_2-7-2024_R-B9_16324; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ19 L_2-8-2024_R-B9_16420 SUBJECT_SAMPLE_FACTORS - FQ20 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ21 L_2-6-2024_R-C1_16312; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ21 L_2-8-2024_R-C1_16408 SUBJECT_SAMPLE_FACTORS - FQ21 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ22 L_2-7-2024_R-C2_16339; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ22 L_2-8-2024_R-C2_16435 SUBJECT_SAMPLE_FACTORS - FQ22 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ23 L_2-6-2024_R-C3_16322; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ23 L_2-8-2024_R-C3_16418 SUBJECT_SAMPLE_FACTORS - FQ23 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ24 L_2-6-2024_R-C4_16316; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ24 L_2-8-2024_R-C4_16412 SUBJECT_SAMPLE_FACTORS - FQ24 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ25 L_2-7-2024_R-C5_16342; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ25 L_2-8-2024_R-C5_16438 SUBJECT_SAMPLE_FACTORS - FQ27 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ27 L_2-7-2024_R-C6_16329; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ27 L_2-8-2024_R-C6_16425 SUBJECT_SAMPLE_FACTORS - FQ28 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ28 L_2-7-2024_R-C7_16325; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ28 L_2-8-2024_R-C7_16421 SUBJECT_SAMPLE_FACTORS - FQ29 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ29 L_2-7-2024_R-C8_16341; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ29 L_2-8-2024_R-C8_16437 SUBJECT_SAMPLE_FACTORS - FQ30 Sample source:Bee head | Treatment:Infected | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ30 L_2-7-2024_R-C9_16332; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ30 L_2-8-2024_R-C9_16428 SUBJECT_SAMPLE_FACTORS - FQ31 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ31 L_2-6-2024_R-D1_16311; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ31 L_2-8-2024_R-D1_16407 SUBJECT_SAMPLE_FACTORS - FQ32 Sample source:Bee head | Treatment:Control | Bee type:Field Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=FQ32 L_2-7-2024_R-D2_16334; RAW_FILE_NAME(Raw file name Lipidomics NEG)=FQ32 L_2-8-2024_R-D2_16430 SUBJECT_SAMPLE_FACTORS - CQ1 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ1 L_2-7-2024_B-A1_16371; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ1 L_2-9-2024_B-A1_16466 SUBJECT_SAMPLE_FACTORS - CQ2 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ2 L_2-7-2024_B-A2_16383; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ2 L_2-9-2024_B-A2_16478 SUBJECT_SAMPLE_FACTORS - CQ3 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ3 L_2-7-2024_B-A3_16374; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ3 L_2-9-2024_B-A3_16469 SUBJECT_SAMPLE_FACTORS - CQ4 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ4 L_2-7-2024_B-A4_16379; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ4 L_2-9-2024_B-A4_16474 SUBJECT_SAMPLE_FACTORS - CQ5 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ5 L_2-7-2024_B-A5_16365; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ5 L_2-9-2024_B-A5_16460 SUBJECT_SAMPLE_FACTORS - CQ6 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ6 L_2-7-2024_B-A6_16378; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ6 L_2-9-2024_B-A6_16473 SUBJECT_SAMPLE_FACTORS - CQ7 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ7 L_2-7-2024_B-A7_16393; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ7 L_2-9-2024_B-A7_16488 SUBJECT_SAMPLE_FACTORS - CQ8 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ8 L_2-7-2024_B-A8_16387; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ8 L_2-9-2024_B-A8_16482 SUBJECT_SAMPLE_FACTORS - CQ9 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ9 L_2-7-2024_B-A9_16373; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ9 L_2-9-2024_B-A9_16468 SUBJECT_SAMPLE_FACTORS - CQ10 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ10 L_2-7-2024_B-B1_16370; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ10 L_2-9-2024_B-B1_16465 SUBJECT_SAMPLE_FACTORS - CQ11 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ11 L_2-7-2024_B-B2_16363; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ11 L_2-9-2024_B-B2_16458 SUBJECT_SAMPLE_FACTORS - CQ12 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ12 L_2-7-2024_B-B3_16368; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ12 L_2-9-2024_B-B3_16463 SUBJECT_SAMPLE_FACTORS - CQ13 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ13 L_2-7-2024_B-B4_16369; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ13 L_2-9-2024_B-B4_16464 SUBJECT_SAMPLE_FACTORS - CQ14 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ14 L_2-7-2024_B-B5_16381; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ14 L_2-9-2024_B-B5_16476 SUBJECT_SAMPLE_FACTORS - CQ15 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ15 L_2-7-2024_B-B6_16389; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ15 L_2-9-2024_B-B6_16484 SUBJECT_SAMPLE_FACTORS - CQ16 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ16 L_2-7-2024_B-B7_16360; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ16 L_2-9-2024_B-B7_16455 SUBJECT_SAMPLE_FACTORS - CQ17 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ17 L_2-7-2024_B-B8_16388; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ17 L_2-9-2024_B-B8_16483 SUBJECT_SAMPLE_FACTORS - CQ18 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ18 L_2-7-2024_B-B9_16362; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ18 L_2-9-2024_B-B9_16457 SUBJECT_SAMPLE_FACTORS - CQ19 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ19 L_2-7-2024_B-C1_16386; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ19 L_2-9-2024_B-C1_16481 SUBJECT_SAMPLE_FACTORS - CQ20 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ20 L_2-7-2024_B-C2_16382; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ20 L_2-9-2024_B-C2_16477 SUBJECT_SAMPLE_FACTORS - CQ22 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ22 L_2-7-2024_B-C4_16361; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ22 L_2-9-2024_B-C4_16456 SUBJECT_SAMPLE_FACTORS - CQ23 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ23 L_2-8-2024_B-C5_16394; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ23 L_2-9-2024_B-C5_16489 SUBJECT_SAMPLE_FACTORS - CQ24 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ24 L_2-7-2024_B-C6_16364; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ24 L_2-9-2024_B-C6_16459 SUBJECT_SAMPLE_FACTORS - CQ25 Sample source:Bee head | Treatment:live | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ25 L_2-7-2024_B-C7_16390; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ25 L_2-9-2024_B-C7_16485 SUBJECT_SAMPLE_FACTORS - CQ27 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ27 L_2-7-2024_B-C9_16359; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ27 L_2-9-2024_B-C9_16454 SUBJECT_SAMPLE_FACTORS - CQ28 Sample source:Bee head | Treatment:control | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ28 L_2-7-2024_B-D1_16372; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ28 L_2-9-2024_B-D1_16467 SUBJECT_SAMPLE_FACTORS - CQ29 Sample source:Bee head | Treatment:UV | Bee type:Cage Trial RAW_FILE_NAME(Raw file name Lipidomics POS)=CQ29 L_2-7-2024_B-D2_16392; RAW_FILE_NAME(Raw file name Lipidomics NEG)=CQ29 L_2-9-2024_B-D2_16487 #COLLECTION CO:COLLECTION_SUMMARY The samples were derived entirely from cage trials and field according to CO:COLLECTION_SUMMARY standard queen rearing methods as described by Chapman A, et al., Scientific CO:COLLECTION_SUMMARY Reports. 2024;14(1):17285. CO:SAMPLE_TYPE queen bee head #TREATMENT TR:TREATMENT_SUMMARY The samples were derived entirely from cage trials and field samples as TR:TREATMENT_SUMMARY described by Chapman A, et al., Scientific Reports. 2024;14(1):17285. Briefly, TR:TREATMENT_SUMMARY in the cage trial, young (< 1 month old) queens were microinjected with either TR:TREATMENT_SUMMARY saline (N=9, control group), a live virus inoculum (N-9, live group), or a TR:TREATMENT_SUMMARY UV-inactivated virus inoculum (N=9, UV group). The queens were observed for TR:TREATMENT_SUMMARY seven days after injection, then were euthanized, dissected, and samples were TR:TREATMENT_SUMMARY stored at -70 °C. For the field samples, the queens were blindly divided into TR:TREATMENT_SUMMARY two groups, with one receiving a saline injection (N=15, control) and the other TR:TREATMENT_SUMMARY receiving the same live virus inoculum described above (N=14, Infected) #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Two-phase extraction was conducted according to methods previously described at SP:SAMPLEPREP_SUMMARY J. Lipid Res. 49, 1137–1146 (2008) SP:PROCESSING_STORAGE_CONDITIONS -80℃ SP:EXTRACT_STORAGE 4℃ #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY ESI+. Lipids were separated on an ACQUITY UPLC CSH C18 analytical column (130Å, CH:CHROMATOGRAPHY_SUMMARY 1.7 µm, 2.1 mm X 100 mm, Waters) with a multi-step elution gradient optimized CH:CHROMATOGRAPHY_SUMMARY to resolve polar lipids such as hydroxylated fatty acids analyzed. CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Thermo Vanquish CH:COLUMN_NAME Waters ACQUITY UPLC CSH C18 (100 x 2.1mm,1.7um) CH:SOLVENT_A 100% water; 10 mM ammonium formate; 0.1% formic acid CH:SOLVENT_B 10% acetonitrile/90% isopropanol; 10 mM ammonium formate; 0.1% formic acid CH:FLOW_GRADIENT 0 min (20% B), 0–2 min (20% B), 2–11 min (80% B), 11–11.5 min (99% B), CH:FLOW_GRADIENT 11.5–13.2 min (99% B), 13.2–14 min (5% B), and 14–18 min (5% B). CH:FLOW_RATE 0.4 ml/min CH:COLUMN_TEMPERATURE 65 °C #ANALYSIS AN:ANALYSIS_TYPE MS AN:LABORATORY_NAME Foster Lab #MS MS:INSTRUMENT_NAME Bruker Impact II MS:INSTRUMENT_TYPE QTOF MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS For positive ion mode, the mass spectrometer settings were as follows: capillary MS:MS_COMMENTS voltage of 4500 V, nebulizer gas pressure of 2.0 bar, dry gas flow rate of 9 L MS:MS_COMMENTS min-1, dry gas temperature of 220°C, mass scan range of 60-1300 m/z, and a MS:MS_COMMENTS total cycle time of 0.6 s. To obtain comprehensive structural information, MS:MS_COMMENTS collision energy of 20 V was ramped through each MS/MS scan from 100 to 250%. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Relative Abundance MS_METABOLITE_DATA_START Samples FQ1 FQ2 FQ3 FQ4 FQ5 FQ6 FQ7 FQ8 FQ9 FQ10 FQ11 FQ12 FQ13 FQ14 FQ16 FQ17 FQ18 FQ19 FQ20 FQ21 FQ22 FQ23 FQ24 FQ27 FQ28 FQ29 FQ30 FQ31 FQ32 CQ1 CQ2 CQ3 CQ4 CQ5 CQ6 CQ7 CQ8 CQ9 CQ10 CQ11 CQ12 CQ13 CQ14 CQ15 CQ16 CQ17 CQ18 CQ19 CQ20 CQ22 CQ23 CQ24 CQ25 CQ27 CQ28 CQ29 Factors Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Infected | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:Control | Bee type:Field Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:live | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial Sample source:Bee head | Treatment:control | Bee type:Cage Trial Sample source:Bee head | Treatment:UV | Bee type:Cage Trial 9-HDA_9(R)-hydroxydec-2(E)-enoic acid 334389.34 358133.24 368568.12 148592.38 353514.07 233666.03 335256.11 246002.04 238230.07 353582.60 195722.12 246575.09 250269.79 255909.50 217582.90 126783.17 318375.15 199418.93 172118.34 272930.97 403353.31 238467.80 166800.78 302668.34 307475.50 247768.34 324638.41 281653.02 254867.31 369543.50 315675.16 163105.93 91288.65 178218.32 204548.61 209243.38 306088.28 361674.75 331397.89 150633.55 57346.64 151937.16 274163.86 155981.32 171037.92 145551.86 126786.71 394957.92 385194.03 198000.39 183715.35 302407.63 183606.30 186166.09 172610.22 265693.80 9-ODA_E-9-oxodec-2-enoic acid 884088.47 897273.43 755912.41 574619.85 788788.29 660947.31 793910.27 586965.95 663758.80 704611.68 753421.50 833494.85 719307.60 688001.64 592219.31 556313.79 714145.86 715629.21 671528.07 952931.74 782143.92 659242.26 531541.19 949461.12 653021.80 736510.76 734206.27 755081.80 653437.37 519665.53 777416.13 571413.15 410468.83 830836.90 915787.51 663714.67 863346.68 829663.00 919895.40 485077.10 365034.00 502456.31 946866.16 853755.73 539648.21 689991.75 553626.13 875260.00 916203.33 695948.42 838329.77 795365.34 681190.48 747858.33 715688.07 816137.16 HOB_methyl p-hydroxybenzoate 55253.44 45413.97 53517.52 30615.68 56931.56 15609.24 18733.47 15405.50 24463.65 51952.84 55712.66 63903.43 67515.04 43240.73 72976.64 27110.69 12926.16 55754.53 42593.23 31330.65 39030.47 24310.13 17814.13 73500.01 24262.24 34372.42 54275.60 28781.83 50836.83 10887.44 6311.25 6352.51 3214.34 7661.49 4252.93 5972.68 5942.85 3922.10 6749.92 5706.63 1058.67 13317.72 20984.14 9606.59 5981.47 17332.80 7645.51 11950.30 14455.29 7531.76 9101.85 9351.36 9068.86 12636.97 9633.77 9627.98 HVA_4-hydroxy-3-methoxyphenylethanol 8059.75 6896.51 11285.85 6799.66 9422.81 3535.39 2022.65 5403.42 4183.51 10001.36 7457.13 9407.27 10304.95 13916.18 12812.29 5275.54 2446.12 10160.47 6072.37 6047.83 4889.46 6386.34 5332.34 8916.97 3945.34 7250.33 8686.70 4387.31 5955.62 2243.71 2767.54 1506.63 842.50 2213.95 1985.32 1186.69 2585.53 1985.04 2558.58 1537.02 713.73 1611.08 4980.90 3395.58 1859.34 4294.62 1669.45 3609.72 4372.54 2495.58 4315.14 4267.00 3261.07 7048.10 4385.43 3818.67 LEA_linolenic acid 246.03 250.12 178.01 464.61 315.04 290.98 1435.05 710.24 349.39 227.66 263.04 235.18 229.68 482.94 199.60 347.12 214.34 405.44 464.47 208.42 328.20 469.54 369.32 1229.89 219.66 219.40 245.33 1274.03 244.01 264.58 302.02 297.59 291.70 316.92 260.65 341.52 286.68 300.80 315.29 262.89 3961.19 345.15 320.76 288.82 280.58 334.82 241.71 340.80 349.41 261.42 308.97 267.96 294.28 260.04 298.14 312.76 MO_methyl oleate 10812.99 8320.29 7642.66 5381.97 9680.22 8638.32 3129.11 10017.95 8603.66 6510.50 7619.69 5333.95 7199.11 10387.72 7968.40 5548.00 5798.78 5169.70 3565.47 7245.24 6096.29 6412.51 4496.65 10056.04 4701.02 11727.83 6112.65 5884.52 9702.30 4419.70 5866.55 5201.65 4376.06 6882.70 4387.78 4961.50 5211.93 6811.95 4480.44 3143.79 2876.04 4526.98 6554.23 4535.62 4063.52 4662.76 3980.11 5253.43 5817.66 2777.47 3173.75 3479.63 5292.61 4121.86 5029.88 4353.42 CA_E-3-(4-hydroxy-3-methoxyphenyl)-prop-2-en-1-ol 163.45 99.60 130.11 78.05 142.53 97.19 79.24 107.90 92.88 123.89 143.64 129.17 150.63 130.39 141.03 125.44 112.23 166.53 137.91 124.55 105.15 117.67 109.53 132.78 107.90 95.99 141.52 115.97 101.51 99.72 97.97 89.56 98.57 99.67 86.74 75.93 92.26 85.73 110.67 91.00 100.69 110.61 95.53 86.59 86.10 80.93 74.20 88.39 101.91 83.35 73.00 89.26 93.16 84.59 95.41 79.73 10-HAD_10-Hydroxy-2-Decenoic Acid 110664.68 61945.61 79356.34 35755.85 77941.98 34651.40 53907.64 40237.59 44015.52 64927.92 67019.21 62032.31 127804.77 74774.46 41510.11 31963.28 44511.94 30997.52 41497.55 81047.19 63390.88 47499.29 23324.82 62134.69 119286.30 75633.90 107227.85 42765.73 41666.86 80252.93 65255.44 21991.05 12570.36 59183.15 43439.35 19683.74 79418.59 52447.11 51410.66 21484.87 4861.16 13335.01 43107.13 35312.56 12224.54 23116.64 12635.47 54354.13 46583.51 29191.13 40920.26 29053.60 39208.76 43295.96 28110.85 71530.89 ISTD_Chol Ester (18:1-d7)_700185 15483.21 17188.37 20795.14 20669.80 14236.91 16796.85 16892.52 18190.45 17575.56 19678.24 19639.96 18066.56 20262.14 15716.89 14556.48 15474.47 14793.70 15868.62 13883.94 19387.73 16419.31 17778.52 20366.95 15072.89 19830.31 16743.31 12621.42 16847.34 19326.03 13133.12 6896.30 8638.13 8222.82 12343.32 12337.40 6121.67 5257.13 10713.47 7629.32 11215.44 11680.86 12633.78 9211.11 9508.16 8559.74 11566.54 8222.18 7554.13 8754.37 14247.92 10518.78 14076.65 10155.92 11444.65 9979.61 11125.16 ISTD_TG (15:0-18:1-d7-15:0)_791648 14787.20 9997.84 10717.91 15620.95 9219.59 9204.49 17602.00 7961.43 9128.25 9422.62 11420.42 11707.47 7755.12 8169.03 9547.73 10826.11 7611.33 10242.08 10597.04 10810.17 12302.06 12264.63 8427.57 10672.74 11035.92 10807.82 16949.70 10960.70 13058.26 21102.75 14313.42 23872.99 30079.86 15143.32 16376.00 29322.16 34315.97 14224.77 22014.59 15401.19 17230.08 17318.93 20156.23 20561.29 15182.03 15625.71 12530.86 16929.75 21255.53 16433.78 17614.96 14433.67 16390.84 12480.56 19531.92 28164.46 ISTD_SM (18:1-d9)_791649 3398.63 3459.92 3569.08 3587.66 3662.28 3435.69 3445.45 2973.66 3688.90 3482.20 3641.72 3648.43 3175.57 3217.59 3626.24 3498.05 2901.38 3566.78 3129.78 3522.37 3227.04 3520.31 3477.06 3476.09 3428.44 3503.11 3516.88 3078.74 3487.04 3377.37 3803.65 4101.01 4051.73 4166.01 3937.54 4189.26 4127.41 3807.20 3831.12 3716.24 3923.23 4000.05 4121.20 4114.48 4021.31 3988.86 3573.24 3765.69 3748.81 3723.33 3968.97 3565.44 3970.07 3770.02 3918.70 3820.46 ISTD_PC (15:0-18:1-d7)_791637 19247.46 19179.43 20391.33 20690.77 20006.30 19249.03 17581.42 15050.74 20017.86 19249.19 19788.44 20428.21 17245.32 17241.69 19628.70 19538.68 15789.00 20404.47 17081.73 18645.04 18233.60 18447.63 18294.37 18494.83 20379.90 20344.95 18858.39 16175.66 19217.22 18309.25 19675.74 21904.23 20935.85 21005.85 20825.83 21493.57 20980.64 20330.88 20531.13 19709.12 10190.55 21975.46 21303.19 21852.31 21394.50 20250.08 20189.97 19112.74 22382.77 20760.01 20343.13 19439.17 20625.63 20587.55 21111.05 19386.89 ISTD_MG (18:1-d7)_791646 112.49 97.08 88.28 78.02 110.90 92.52 89.34 94.82 94.49 104.03 101.91 112.55 114.20 103.59 87.48 111.96 140.85 110.83 92.87 100.27 92.91 99.50 98.97 108.55 132.72 107.97 91.91 77.94 93.55 139.65 140.73 138.95 154.39 109.76 131.61 148.41 146.73 129.58 123.92 138.27 122.00 114.97 132.28 118.02 117.24 142.75 137.96 130.41 118.20 132.75 146.03 99.13 115.29 109.49 109.77 119.35 ISTD_Cholesterol-d7_700041 241.28 366.10 200.86 529.44 336.05 234.48 433.32 290.81 332.44 573.47 479.30 340.30 555.10 203.50 412.00 231.45 376.23 240.98 337.36 437.01 501.72 337.18 407.27 246.85 425.66 488.18 390.69 616.60 444.34 539.26 357.16 509.19 239.03 319.37 313.38 449.35 239.67 412.66 403.47 282.35 182.95 389.61 275.05 454.62 167.73 807.40 285.33 448.81 563.27 311.39 552.50 505.36 232.64 385.33 210.20 413.71 (Z)-9,12,13-trihydroxyoctadec-15-enoic acid 1170.83 1226.23 988.27 731.73 1236.89 849.91 1480.99 1118.95 682.27 1016.17 1362.13 1340.26 938.33 1129.77 711.41 985.02 1250.16 1058.06 736.22 2062.31 1280.33 1127.83 648.11 1670.15 801.80 1214.67 1372.73 833.13 601.09 949.50 1122.24 841.37 610.30 1260.60 1307.04 910.65 1108.24 1027.44 1570.52 601.33 527.37 657.58 1098.21 1305.34 880.67 853.14 729.09 1263.02 1549.43 805.42 1268.89 1294.63 723.64 1121.84 721.38 1239.44 10-HYDROXYDECANOATE 52029.32 27446.11 29470.53 17637.64 37853.87 16038.80 18204.28 16104.80 15653.80 33755.00 28984.02 25549.01 41189.30 29630.86 18262.38 13632.62 13957.36 10008.92 16691.19 18139.29 21140.61 19172.38 9253.27 22179.55 20873.70 15759.65 51567.98 11891.22 19510.04 7750.05 9318.39 5427.02 2911.96 8903.49 5619.31 4148.15 12333.06 8241.95 12058.38 3019.19 1361.35 3850.55 10674.69 6904.55 3499.70 5294.62 3125.58 8825.79 8952.03 4718.46 5842.13 5059.34 5152.81 10265.69 5809.32 7546.66 PGB2 425.10 346.73 272.80 276.98 354.97 422.95 318.67 309.31 292.15 324.24 532.69 325.45 384.81 382.43 363.68 379.26 365.09 246.50 283.67 577.42 317.52 316.34 200.41 397.18 335.68 348.24 626.80 230.48 252.96 327.28 340.69 325.63 221.64 364.08 385.46 405.61 326.08 271.68 355.63 257.36 222.18 240.47 431.24 469.03 255.60 363.47 254.83 483.13 550.15 223.47 458.89 278.12 316.94 364.50 335.46 343.63 PGG2 2329.97 2281.46 2062.22 1279.61 1840.36 1268.37 2276.27 1448.16 1280.80 1419.21 1706.31 2112.78 1329.69 1639.10 1076.32 1725.37 2146.41 1637.03 1406.33 3009.09 2264.55 1798.64 1389.48 3082.55 1680.70 2021.09 2077.20 1778.81 1377.96 1183.49 1400.11 995.83 582.48 1379.54 1994.24 1038.69 1612.20 1445.06 1838.01 864.09 270.28 549.28 2014.62 1398.99 707.48 866.66 839.35 2068.50 1860.06 1202.73 1326.39 1691.43 1239.83 1575.30 1156.01 1949.99 19(R)-hydroxy-PGE2 412.60 476.21 439.11 104.29 273.46 200.48 496.95 273.41 316.55 290.34 176.22 263.21 415.39 225.04 286.69 78.58 330.25 176.77 184.78 334.00 479.22 174.73 163.40 376.50 268.75 189.31 397.31 317.26 172.34 77.16 175.47 43.82 42.12 77.05 84.10 71.32 152.87 136.03 158.51 56.04 16.66 51.89 136.09 71.45 70.85 56.87 46.52 242.32 270.96 66.15 66.49 164.48 79.76 72.19 68.55 54.69 12-Hydroxydodecanoic acid 3148.41 2843.41 3069.21 1618.09 2914.66 2269.24 2265.31 2378.57 2264.28 3398.69 2205.16 2684.49 2215.77 2614.76 2006.55 1968.39 2431.79 1774.35 1607.32 2278.61 2950.76 1868.40 1916.23 2128.16 2702.16 2311.48 3211.63 2276.85 2289.50 2477.02 1863.52 1269.76 949.45 1341.05 1243.96 1388.87 2101.28 2449.54 1906.80 928.32 608.70 844.47 1802.99 1299.73 1054.66 1213.21 923.82 2091.85 1800.76 1017.81 1339.96 1589.19 1248.14 1101.20 1102.56 1721.41 3-Hydroxycapric acid 18949.77 22607.90 24401.17 6729.25 21360.42 11744.24 18933.73 13705.07 17762.82 17897.58 9472.95 12900.52 15453.74 14744.59 12986.27 7333.17 16921.11 9107.31 10104.16 14681.19 18154.14 10656.68 8137.96 21051.67 13423.28 14915.93 15064.59 15039.76 12659.26 11738.87 20091.00 8888.17 6110.58 12025.44 12098.48 13153.64 18036.80 24192.20 26813.75 5991.98 4679.45 11924.73 16149.68 10084.89 10775.25 11706.85 9063.06 36233.58 31866.43 13196.35 13286.12 17824.71 12294.77 10285.99 9297.95 10147.51 DL-b-Hydroxycaprylic acid 80701.22 117874.91 75202.21 34001.27 109339.15 76675.15 23095.90 46744.21 72570.76 86051.93 57003.39 65436.74 79152.94 52703.26 58397.08 36821.53 35682.03 54173.28 59563.36 51017.85 52249.34 53850.01 23879.36 80254.12 56757.23 43215.67 78185.85 64632.23 74083.26 34550.05 81675.85 29954.41 19129.47 64785.88 68855.70 27609.35 58601.25 56368.02 71618.75 29993.63 12167.25 23056.48 83804.26 79978.97 43109.47 57262.39 45334.80 105974.12 91108.60 75784.12 71922.15 65900.50 77233.49 63049.35 49793.31 84186.53 13,14-dihydro-PGE1 18565.77 10152.70 15197.78 3941.21 9935.13 5480.85 10463.92 5524.08 7366.79 7715.78 8306.71 7853.92 16386.86 10153.50 5871.06 5408.58 7795.88 3144.18 5941.77 10575.11 11316.58 5901.03 3917.74 8972.77 12093.50 10643.05 16441.04 6286.82 6122.70 3050.05 3229.07 1408.94 789.00 2718.54 2005.83 1239.14 4148.76 2378.61 3612.44 743.36 243.55 1122.43 2915.42 2714.42 1115.64 2333.69 968.58 4720.00 4234.22 1615.51 2220.34 2016.97 2092.57 2635.51 1778.50 3572.81 13,14-dihydro-19(R)-hydroxyPGE1 430.68 195.69 270.06 82.75 271.95 192.35 206.58 129.57 183.97 146.90 257.00 192.30 363.58 225.06 213.00 156.91 131.50 92.87 194.94 209.88 225.06 117.64 89.45 242.76 184.46 135.43 376.40 121.61 162.97 37.56 84.44 42.93 42.72 59.27 44.72 46.70 80.33 48.30 75.40 35.89 19.29 32.77 73.38 68.11 32.24 61.39 36.71 66.68 71.66 44.20 64.44 43.10 51.48 71.23 70.47 81.72 7-Oxo-11-dodecenoic acid 64986.63 61341.21 46327.73 29530.39 47424.91 32657.30 41508.21 36751.56 41354.45 38241.97 48148.13 50884.67 44117.90 40480.37 26249.17 39221.63 43309.43 38348.35 26229.55 72362.41 49486.19 37121.94 32151.16 70415.06 45242.17 47858.02 56649.14 41051.04 32359.10 30632.32 40544.42 26712.02 17341.32 49146.80 54248.16 27215.62 42294.91 48319.34 49525.40 23292.50 11854.94 15371.69 51184.02 44716.37 20185.94 28548.27 24589.06 44808.89 46911.23 30767.40 43524.88 38072.60 33950.07 38380.90 31650.03 49197.37 Oleic Acid ethyl ester 10667.38 12975.07 9770.91 7206.01 10664.78 32400.69 4448.31 9440.11 21343.09 5559.42 9779.76 9756.96 6377.50 7650.60 8684.66 12305.66 9809.90 8514.86 15971.04 8953.81 7078.91 6167.63 4649.76 12041.09 11523.32 9816.46 13639.07 8881.86 11280.01 10402.71 28931.02 19672.17 8464.48 12645.35 16710.84 12040.22 21611.66 12239.50 7483.06 4844.96 4456.15 18436.20 9741.31 12532.88 9253.64 12499.35 9232.21 12539.70 13185.86 8065.13 3947.66 11142.11 14584.93 10070.37 14986.60 15552.60 13,14-dihydro-15-keto Prostaglandin D1 41274.19 26469.54 36451.90 10606.25 24994.77 13057.19 29119.51 12825.16 16912.44 18132.87 21367.43 22381.96 32222.06 22437.27 14894.86 12870.13 20935.10 10312.28 15474.83 36668.19 29976.45 15364.56 11757.34 27843.43 28537.84 32210.97 36586.15 18178.18 14622.65 10800.74 9484.65 4357.42 2613.79 8941.36 7464.56 4385.37 12315.05 6774.41 11605.85 2931.75 1366.81 3707.03 9973.69 8117.43 3574.20 6941.64 3347.60 16843.89 13205.75 5400.10 7938.98 6361.32 7280.58 8253.25 6024.72 12438.78 2,3-dinor Prostaglandin E1 70945.89 77929.77 54380.14 22575.97 45777.65 39312.01 39318.99 28018.19 49984.03 39268.20 47612.32 48869.87 49469.73 33357.46 35306.03 32273.04 29347.37 35780.89 36919.80 53476.06 42616.62 34848.69 26738.12 67178.62 44127.49 61838.43 55587.72 43129.58 45787.38 6878.21 17103.47 5807.44 4006.16 13577.96 18065.54 6829.53 20189.98 11630.12 12699.72 5288.51 1090.78 5769.64 22590.82 18224.97 8099.34 16262.95 9346.89 31081.87 27227.18 18000.91 18252.63 14486.91 19712.09 14698.38 16015.02 18761.65 13,14-dihydro Prostaglandin F1α 3735.19 1197.05 2200.66 584.51 1457.55 843.78 1356.08 780.23 981.08 1204.62 1299.34 1510.56 2710.92 1725.44 956.22 879.88 920.50 381.44 889.97 1154.24 1546.19 873.37 552.58 1138.63 1413.48 1016.62 3252.61 742.14 849.42 147.90 316.78 108.05 89.02 195.68 161.65 119.40 443.45 216.77 468.07 83.63 42.27 129.87 344.81 267.58 116.24 198.05 107.99 431.12 362.34 137.31 181.95 155.89 147.29 286.56 196.62 239.87 13,14-dihydro-15-keto-tetranor PGF1β 4564.03 3560.73 1915.82 1226.52 2617.25 4289.13 1280.36 1457.87 3647.99 2941.63 2149.57 2749.56 3178.91 2468.55 1485.15 2818.27 1538.37 2143.98 1525.45 2317.96 1943.56 1868.48 1964.73 3434.50 2359.44 3034.55 3867.13 2303.07 2595.96 307.27 764.10 418.92 303.69 714.05 883.16 320.61 682.23 671.94 699.98 288.69 122.55 232.43 1078.16 1285.97 425.95 920.94 543.19 1226.26 985.51 1065.40 1114.67 749.18 1196.37 703.41 681.53 809.78 LysoPE(16:1(9Z)/0:0) 7.37 3.40 8.76 109.19 22.25 12.27 460.43 236.40 29.55 8.71 5.76 10.71 15.20 86.06 19.33 35.70 29.58 79.09 65.17 14.78 103.14 115.19 44.88 381.08 13.49 10.89 25.40 263.56 20.35 12.46 13.26 3.29 9.81 7.65 7.16 8.28 12.07 11.36 7.18 47.83 1133.93 11.08 7.71 6.76 9.34 10.23 17.33 10.77 10.99 16.41 9.45 14.90 4.52 9.81 7.56 8.42 12-OPDA 2587.22 1941.27 2126.30 673.17 2168.43 1392.68 1357.01 1140.92 1554.87 1742.52 1388.00 1498.73 2404.98 1230.32 1288.03 988.03 1135.47 878.11 937.15 1699.42 1606.53 1082.90 892.40 1414.90 2277.24 2267.43 2337.38 1153.21 1740.75 640.67 963.61 344.37 308.08 670.94 525.07 345.98 876.49 512.52 631.63 272.67 153.21 343.96 707.63 726.78 367.58 610.19 337.14 1251.76 993.55 607.81 673.05 570.38 800.28 613.65 495.99 1028.52 9S,10S,11R-trihydroxy-12Z-octadecenoic acid 690.69 1172.25 1371.16 234.16 1089.05 643.41 546.42 461.28 890.26 758.04 456.49 640.06 896.87 649.05 512.77 387.59 624.74 357.53 596.50 487.89 655.72 585.41 291.67 792.82 668.88 652.00 686.79 677.20 489.06 134.67 283.54 112.83 73.63 137.68 175.19 137.50 211.47 231.50 398.71 92.64 40.75 169.15 222.78 203.53 144.31 298.78 126.04 573.77 579.73 227.09 232.31 236.87 288.07 159.19 132.20 141.04 14,15-DEHYDRO-LEUKOTRIENE B4 179.88 151.85 133.91 198.71 84.91 158.22 147.04 141.54 98.36 114.63 190.66 148.08 97.49 98.67 72.48 104.08 192.92 102.83 60.86 331.59 168.27 111.46 85.42 212.27 198.66 197.44 297.31 104.53 105.08 223.06 132.74 138.34 81.07 183.31 211.74 144.02 169.19 120.09 246.02 98.51 64.65 84.43 241.16 169.17 113.49 115.09 40.34 201.98 272.14 91.30 148.07 131.49 100.02 144.58 100.97 134.25 Cer 8:0;2O/6:0 619.47 498.20 412.66 428.00 467.60 367.99 322.87 660.16 335.31 402.47 490.54 623.38 294.43 479.63 362.73 269.33 443.95 436.47 215.04 703.27 473.45 306.19 320.66 641.31 614.13 341.14 688.97 517.69 375.25 294.68 420.96 389.16 215.69 903.74 570.00 489.15 578.57 519.52 664.72 219.53 203.36 104.59 423.23 275.81 255.86 220.00 180.44 695.44 583.64 199.91 385.02 505.67 285.45 312.26 322.34 288.61 Cer 8:0;2O/8:0 248.76 159.82 127.54 175.94 124.72 118.42 110.41 157.47 78.27 111.32 108.65 184.53 58.23 108.66 112.56 86.06 119.49 118.07 63.56 214.55 138.34 146.75 110.45 226.91 161.46 106.10 202.35 195.75 134.95 61.37 118.02 115.81 105.67 233.12 231.45 203.85 152.31 151.37 269.10 65.34 53.51 24.73 115.33 62.03 61.08 34.71 57.12 220.54 162.13 50.10 71.04 138.19 69.38 56.72 111.71 101.81 CL 32:2_32:2 529.62 767.30 1043.90 1570.40 720.54 751.24 891.58 687.53 1209.25 680.48 1290.54 669.18 860.77 543.49 501.81 1504.36 1085.80 514.26 413.75 921.72 1277.65 1053.99 1389.87 536.74 672.71 1045.23 591.01 674.25 1047.95 408.08 258.56 539.15 452.69 453.29 446.50 370.88 220.31 413.36 585.43 395.45 371.40 442.59 288.34 406.55 451.97 247.46 464.17 260.38 281.83 326.22 478.82 455.31 277.37 338.90 385.45 253.23 CL 34:2_32:2 5038.14 5390.87 6852.65 9670.02 4120.38 4850.77 3595.75 4586.33 7625.62 5195.83 6626.37 4279.08 4803.69 3982.79 4368.67 5530.21 5118.22 4147.16 3482.18 4928.18 6775.99 5625.22 6600.11 3709.57 5653.82 5359.35 4066.80 4009.98 6127.35 3328.39 2690.54 4896.12 3544.62 5006.42 3463.63 3940.83 2495.78 4223.45 5193.16 3869.83 3543.38 3880.88 3175.11 3316.02 4189.46 1926.66 3979.70 2594.70 2537.49 3226.21 4021.81 4443.93 2387.37 3855.40 3398.59 2241.57 CL 34:2_34:2 16322.34 18842.88 19149.27 21916.23 15028.06 13689.41 8048.76 11251.68 20678.87 17510.20 16412.12 13356.70 12873.82 10643.59 14726.68 12158.01 11643.22 16125.52 10752.43 14170.60 18136.43 15537.54 14865.91 12434.71 19116.19 12736.07 12172.13 12865.54 15055.96 13153.40 12983.40 18704.74 13803.14 19191.90 13442.50 16260.67 11894.91 18499.77 20882.57 13754.26 14863.19 15569.49 14341.02 14196.07 17450.55 8442.86 16912.67 11737.40 11572.88 14731.64 15802.89 17269.35 10626.38 14339.35 15442.56 9238.29 CL 34:2_34:4 3105.94 3232.99 4115.12 5347.13 2583.61 2322.17 1611.83 3221.93 4804.14 3006.88 3866.56 2460.94 2477.42 2557.00 2659.46 4645.73 2443.30 2675.20 2387.36 3033.03 2713.76 3391.55 4398.66 1830.65 2448.62 2928.10 3011.04 2492.86 3339.30 1168.28 782.41 1478.55 970.56 1463.77 911.37 1060.42 697.79 1465.46 1584.38 933.35 728.11 1388.64 1264.39 992.46 1483.95 753.84 1226.91 1181.75 891.75 1003.29 1010.49 1256.89 797.33 1660.97 1050.39 703.27 CL 34:2_36:2 28909.51 34854.73 31120.79 29529.15 26491.14 22218.36 13181.83 16422.67 30006.35 30963.32 25173.36 22046.71 20129.38 16207.77 28196.07 18724.23 16149.49 30863.62 18365.45 23631.36 26601.13 24434.15 20206.19 23399.79 32561.38 18627.26 20103.33 22533.18 22172.85 25007.56 27056.22 31661.48 24598.70 32375.17 24655.76 27654.91 24531.39 37067.94 37157.80 23272.68 26630.76 29250.48 26304.55 27033.14 32856.77 17394.96 33904.86 25301.01 27265.66 30787.30 30278.02 29658.18 22735.51 23182.19 29961.25 20112.10 CL 34:4_36:4 1534.65 1423.26 1512.70 1563.74 1143.12 951.67 746.09 1468.57 1931.43 1259.95 1381.14 1017.54 1086.57 1265.78 941.05 1732.38 860.84 1045.43 1348.94 1047.91 1002.31 1284.35 1515.02 790.72 845.46 1158.96 1276.61 1033.46 1288.92 509.56 417.97 635.97 577.51 715.84 510.85 561.24 466.50 682.57 789.75 558.41 541.93 662.79 521.68 569.72 620.12 444.36 647.34 564.03 532.09 557.66 517.65 728.97 506.41 691.75 593.77 455.85 CL 36:2_36:2 22987.89 30579.55 25167.96 18845.07 21921.42 18086.43 11382.01 11837.73 21795.32 28744.74 18556.64 16414.01 15653.01 13125.47 23028.91 16549.05 11419.29 27573.18 15251.71 19706.18 21861.15 19219.05 12669.22 20808.51 23653.76 13843.42 15511.23 20187.75 16699.24 24158.93 25829.47 26925.77 26768.69 28624.56 22822.60 23562.02 24834.40 37441.28 32874.63 20226.80 26576.73 35548.19 22299.25 22976.52 28811.80 15107.33 31590.11 25004.63 29072.23 29505.10 26297.05 26805.29 21239.42 18597.19 26899.79 19443.94 cuminyl alcohol 58086.00 60429.72 63851.48 24508.12 62810.87 39638.60 58458.62 42571.65 39054.92 62770.73 32172.61 41963.72 42709.75 43313.60 36130.16 21063.98 56883.76 33113.21 26878.77 46251.60 73762.55 40165.68 29420.22 48117.46 54438.47 43234.48 56891.29 46255.84 43894.63 69752.94 55080.98 27473.06 15636.11 26941.95 31191.06 35231.46 53162.61 63775.50 52878.55 26858.55 8788.55 25087.14 43847.73 22979.37 28621.71 21727.77 19669.06 67693.69 63643.90 32200.83 27610.53 51813.21 30602.79 30292.80 27788.74 46605.25 DG 16:0_16:1 41269.00 20099.63 28392.90 38445.30 30784.73 20577.44 9837.97 22027.24 33142.40 19587.91 25589.21 23491.72 27577.49 21403.47 16473.53 11349.90 19446.73 15783.72 20029.05 17505.82 20713.28 13478.32 28389.45 16553.65 20056.80 21707.60 25621.35 17982.34 15001.95 5619.65 15650.42 23901.70 11297.66 10266.33 13085.76 12642.03 14939.26 12710.53 7490.35 10874.65 12012.79 20565.41 13963.47 10624.48 9330.10 19375.85 14700.89 10477.53 15914.86 9247.37 11017.52 14898.50 10927.29 8789.04 9559.71 8411.22 DG 18:1_18:1 77478.54 66647.30 68035.77 64499.29 71250.05 53483.76 53458.64 60330.31 69993.49 64272.15 71597.46 70888.03 82312.62 60083.00 66342.51 70031.66 58405.07 84154.89 70292.84 72397.45 75964.39 65982.11 58288.52 70403.54 55559.22 54779.81 70248.51 74439.58 49437.68 70115.70 83704.36 107325.40 72407.18 80903.73 76083.67 88273.30 106778.26 103143.36 87764.94 52539.50 88478.63 99913.94 81184.40 76598.33 66754.32 89968.37 85360.26 72748.07 95142.36 68344.02 68918.66 77546.57 85882.82 61624.72 72701.01 75364.21 DG 18:1_18:2 9566.89 7278.69 7313.10 8968.65 8711.94 6388.53 4929.66 6670.40 9181.31 7354.31 8611.76 6898.66 8717.77 6618.25 7598.25 9663.13 6335.24 7609.35 8033.12 7443.59 6838.88 5761.98 7717.99 6112.22 6463.95 6779.03 7524.48 7161.26 5451.05 5352.13 5800.73 7120.21 5782.69 5268.64 4772.98 5821.25 6025.49 6260.83 6480.47 3923.74 4544.70 7171.99 5793.39 5478.81 5141.74 5751.02 5009.71 5450.69 5196.24 4750.12 4745.16 4872.37 5491.25 4717.09 5015.02 4809.09 DG 18:1_18:3 9866.09 6700.24 7431.02 7422.82 8292.62 6182.20 4849.74 7100.84 8204.51 6959.84 8699.38 5810.20 8766.55 7499.14 6645.26 7833.27 5884.41 6247.31 7810.71 5829.28 5037.75 5207.12 7179.74 6175.81 5735.89 5963.71 7085.86 6879.78 5562.49 4818.85 4476.72 4428.01 4187.09 3214.12 3953.98 4140.02 4205.14 4309.56 4665.19 3246.20 3640.64 3838.68 4912.03 4119.82 3981.47 4229.25 3755.75 3386.24 4018.52 4000.02 3551.76 3637.05 4665.93 4112.35 4190.39 3826.05 DG 19:0_19:0 9569.57 10644.08 8438.29 8847.37 8942.60 8904.35 6544.80 7838.06 10656.03 8902.39 7504.97 8551.41 9475.97 8930.27 7822.05 6151.27 6321.19 6731.21 5624.37 7790.30 8709.09 8008.40 7013.63 8476.29 6038.27 7539.19 7914.64 7544.21 8738.82 9478.20 15670.49 11566.78 8758.67 10435.99 12229.88 13311.81 16476.16 13840.49 7751.19 8990.47 16471.55 11085.09 11848.71 9128.48 10542.17 12380.19 8721.08 11227.61 10465.95 9781.62 11026.09 12598.61 8520.59 11580.06 16669.67 9629.90 DG O-16:0_18:1 23287.21 17950.37 12580.87 13768.24 16932.24 20774.62 17294.53 13316.24 17013.54 14819.38 13241.43 13968.61 13322.13 9831.50 10260.95 9699.30 8525.14 10088.89 13277.79 16599.33 17974.97 14854.12 8669.74 15505.20 12450.75 15044.43 17397.67 14250.49 20060.25 23532.19 24896.24 27565.15 18268.77 25690.48 27678.67 64390.67 50551.55 26877.12 20298.80 26296.81 32126.53 43182.30 31001.15 27165.07 27201.69 37649.46 27683.27 29106.98 30094.52 38984.63 24691.34 23577.89 30012.39 25858.54 42201.34 68654.90 DG O-20:0_18:1 47529.33 42174.57 30756.54 30502.42 35624.86 38003.74 43466.04 33177.74 37725.76 31362.05 31134.61 36842.67 30090.97 31911.50 29998.85 28560.72 23013.88 35041.19 20519.58 30175.01 37960.24 41641.91 22426.76 49871.29 38454.28 45587.11 38383.13 44228.07 38177.17 70637.56 65507.74 75813.69 51887.93 62865.53 54967.63 106573.47 118959.34 66061.05 68838.74 56601.25 68761.74 71030.41 53626.92 65378.13 77595.91 68400.56 60987.70 60951.08 72582.98 56528.42 58314.02 51458.26 59740.51 57457.59 85309.73 63406.19 DG O-20:0_21:1 2124.23 2350.74 2022.29 2363.44 2270.96 2307.39 2315.08 2188.10 2760.50 1770.84 2416.13 2026.66 2588.41 1854.49 2264.19 1968.23 1714.25 2011.75 1451.87 1936.53 2139.48 2243.67 1743.12 2619.50 2194.56 2058.69 2283.13 2107.93 2008.21 2925.99 2995.43 3687.80 1930.37 3537.00 2811.15 5106.90 5950.27 3461.86 3952.87 3605.33 3286.66 3712.38 3823.34 3346.94 3674.94 3580.16 3238.39 3610.48 4018.04 2430.50 3054.91 2661.78 2934.23 3112.05 4410.05 3888.34 Glyceryl trioleate 289680.28 409410.81 271151.10 239417.03 510979.86 350018.13 87375.99 342542.38 267931.93 368249.83 258448.49 241871.18 364702.74 307122.26 423554.34 168680.04 133189.22 246507.48 279291.86 220431.62 178357.74 308883.99 188353.50 228881.54 196682.22 207974.55 322160.97 199462.52 301055.29 155554.58 645028.14 467216.08 522921.94 359844.60 474259.84 561858.79 463346.42 523469.00 231310.98 148426.50 321109.37 490717.99 332831.71 228382.28 462148.26 519907.74 429308.29 393976.39 503051.34 446235.28 219563.01 477684.54 495102.38 376410.01 495798.81 361239.98 hexadecanedioic acid 2159.84 2171.31 1557.15 1453.87 1531.96 1630.58 1822.81 1573.28 1287.57 1679.62 1892.42 2582.83 1510.88 1572.98 992.87 1485.04 1559.09 1011.51 660.75 2240.62 1792.70 1553.63 988.36 2145.88 1243.83 1501.19 3182.79 976.67 1181.32 1531.97 1554.59 1299.91 747.67 1413.53 2052.98 1725.56 1822.95 1908.58 2070.22 905.32 566.53 1135.27 1955.19 1482.65 950.56 1149.66 780.74 1278.06 1797.35 1185.55 1316.07 1373.00 1045.47 1350.20 1247.01 1244.05 Prostaglandin D2 2902.46 2404.75 2519.13 876.72 1818.77 1351.87 3125.77 1101.97 1188.11 1730.50 1292.49 1612.32 1671.12 1377.52 1432.67 1086.21 1882.92 920.27 1268.20 2311.56 3053.43 1353.84 1397.73 2026.51 2073.88 2086.92 2407.30 1988.88 1310.69 561.77 585.35 211.38 132.18 356.58 375.61 316.47 636.71 506.54 611.15 211.28 60.87 213.07 703.01 375.34 220.69 313.80 175.76 947.45 873.07 301.30 447.46 592.19 436.71 464.90 305.85 579.01 Prostaglandin E1 4180.90 2718.23 3318.57 1013.41 2277.99 1404.88 2427.58 1086.61 1567.03 1498.86 2275.36 2326.70 2874.33 2215.78 1387.19 1375.98 1669.12 1022.58 1631.54 3294.64 2460.49 1461.89 995.12 2975.05 2171.25 2306.03 3742.19 1673.69 1398.95 388.22 636.61 268.18 132.31 635.99 566.75 254.80 785.70 470.36 858.59 173.03 65.07 282.03 767.51 651.14 286.52 535.92 252.94 1115.15 1038.46 416.55 639.01 476.54 509.28 680.60 459.49 689.64 Prostaglandin F3a 77235.66 46062.07 62184.50 18625.08 38896.65 18198.25 57274.38 17113.12 25476.54 25849.01 45259.33 42238.08 55266.93 30968.12 25974.45 23875.46 37145.38 25319.64 28095.87 94126.45 54665.70 30365.52 19582.11 58072.09 64736.07 80948.07 69714.67 34978.70 22743.31 25636.83 26051.31 7692.81 3337.20 25584.84 19885.74 7717.37 30588.33 13591.80 19451.11 6240.06 992.11 5675.02 20669.31 14684.01 5505.70 11849.33 5420.30 31064.15 30526.47 13816.12 22275.66 15998.53 19470.41 22667.01 14443.54 36072.29 13,14-Dihydro PGE1 1671.65 2116.81 1080.96 507.40 1178.25 994.15 501.35 673.58 1194.99 1020.02 1227.18 892.78 1426.09 1157.09 719.54 894.08 660.72 493.24 846.20 1151.33 862.04 674.81 411.12 1495.28 1003.11 935.31 1604.76 915.80 966.29 104.90 252.84 157.73 106.90 321.50 275.58 110.02 315.40 233.36 399.71 70.99 15.10 104.08 369.10 350.38 133.17 317.73 143.51 434.13 414.08 263.22 322.49 231.69 271.21 230.13 239.68 314.15 6-Keto-prostaglandin F1a 2719.87 2283.41 2421.30 875.88 1753.85 1168.16 2532.38 1136.12 1260.97 1381.98 1387.35 1614.57 1607.51 1300.13 1170.04 935.31 2086.02 1176.70 1148.90 2871.20 2422.08 1357.08 1204.28 2254.87 1959.03 2196.15 2344.10 1622.81 1145.54 836.67 867.89 482.08 387.22 710.93 818.88 588.34 929.89 790.07 971.59 411.09 237.20 410.91 958.54 709.07 525.78 595.33 397.41 1327.78 1253.86 539.84 759.20 756.23 698.13 744.42 577.94 935.62 11-Dehydro-thromboxane B2 344.85 514.85 267.95 101.81 180.45 230.32 275.80 141.06 218.30 172.13 232.68 339.11 146.06 171.46 166.05 95.83 177.47 228.52 166.19 485.40 230.94 177.98 184.01 487.56 133.82 164.27 280.24 265.37 168.16 60.36 213.99 78.31 62.48 262.36 222.95 124.48 192.39 158.14 270.94 99.19 39.00 70.93 185.26 189.93 83.70 126.52 74.68 240.04 275.35 149.92 181.31 214.08 166.21 163.46 142.31 119.72 9,10,13-TriHOME 22385.58 13085.53 16335.58 4283.77 14831.46 7756.89 7857.58 6079.48 9029.39 11284.20 11345.90 12221.29 17572.10 10252.80 7830.48 8063.04 5958.56 3959.03 7084.10 7762.54 9543.07 7586.07 3929.19 10454.14 10471.81 8493.67 16477.49 6065.18 9355.44 1115.88 2540.71 991.75 683.60 1721.18 1589.35 896.82 2846.97 1646.97 2966.08 704.90 227.74 1027.66 3134.40 2373.92 1122.65 2313.15 1066.78 4118.06 3907.26 1985.35 2235.45 1693.81 2120.49 2526.30 1864.21 2337.66 Thromboxane B3_Isomer 2434.45 1123.15 2286.53 476.88 1415.18 708.40 2284.19 883.61 1034.14 850.74 1530.04 1150.18 2673.27 1251.55 1170.98 737.53 1162.89 713.24 881.72 3080.07 2047.72 913.63 582.28 1423.98 2255.27 2383.07 1872.69 967.95 836.45 803.95 1018.53 308.10 175.58 947.73 557.63 274.62 890.68 455.13 474.58 209.75 80.89 187.34 542.49 806.87 240.32 581.88 253.05 732.96 796.92 412.50 795.27 543.29 456.71 608.28 462.09 971.22 Thromboxane B3 7888.50 11522.13 6175.91 2175.08 5148.07 5346.56 6421.56 3319.61 4855.10 4252.33 5535.73 8411.98 3925.59 4252.80 3681.16 2408.42 4128.82 5386.74 4079.12 11247.59 6006.72 4350.87 3705.71 11693.83 3373.63 3987.90 6287.48 5500.14 3770.05 1440.89 5497.95 1529.94 886.31 5688.05 5689.82 3172.69 4638.62 3604.42 6394.80 1773.29 753.20 1470.34 4346.89 4595.07 2006.34 3170.07 1921.39 6226.89 6844.83 3624.55 5069.85 4862.60 3204.86 3706.30 3301.14 2735.64 Prostaglandin D1 4121.99 2449.92 3632.04 950.60 2502.21 1299.80 2974.39 1353.78 1682.97 1803.34 2245.90 2109.75 3396.10 2270.57 1433.17 1284.23 2161.21 984.16 1420.74 3893.40 3006.91 1458.79 1115.59 2678.33 3144.47 3514.08 3602.08 1709.49 1546.99 1424.35 1214.39 563.32 394.62 1039.69 936.44 557.92 1543.47 870.32 1316.84 402.44 251.17 451.17 1112.69 1012.24 456.42 815.54 410.13 1968.75 1540.95 666.54 976.64 762.23 906.94 932.09 730.86 1584.05 Arachidyl carnitine 116.88 85.00 105.14 138.94 200.67 81.51 54.29 62.77 121.63 133.14 146.48 138.15 178.48 141.29 60.78 96.87 65.92 139.95 167.12 134.86 61.53 63.69 182.87 99.55 79.76 68.81 95.13 81.16 97.87 100.60 66.54 58.01 139.62 106.54 84.29 125.63 100.61 81.22 107.63 62.29 109.98 111.03 98.43 85.81 74.52 45.81 59.69 97.55 70.81 76.53 56.82 86.61 58.44 87.61 72.61 44.89 DG(16:0/22:1(13Z)/0:0) 322.95 328.51 179.83 252.71 239.39 196.04 274.69 185.71 301.21 319.12 204.60 296.10 373.92 188.82 269.05 169.31 218.74 170.16 117.25 127.49 202.56 191.64 203.42 315.09 141.95 204.21 199.40 169.59 332.05 412.61 438.40 359.33 434.93 399.62 409.40 409.28 403.07 488.53 298.47 236.31 341.56 191.12 402.65 355.65 396.47 666.03 362.55 444.78 377.09 181.29 320.00 275.41 241.73 434.41 349.76 231.12 DG(18:0/18:1(11Z)/0:0) 2129.71 1483.17 2121.06 1916.94 2597.57 1832.26 1785.81 2317.40 1690.78 1562.59 2134.08 611.65 2606.26 959.90 1940.01 1833.31 2006.64 975.94 1913.53 488.09 550.96 887.53 2018.60 1828.81 2238.44 1467.90 1472.99 526.02 1330.18 1345.63 885.97 2518.16 1418.86 1974.01 1636.25 1624.29 919.49 1962.33 1632.90 1524.75 1534.80 2702.72 1687.95 1183.67 1593.89 2125.31 1856.47 1347.04 1061.65 1277.47 1269.32 1716.46 2024.16 1297.75 1051.76 1713.40 PC(18:0/16:0) 54653.79 56796.35 58101.61 56658.12 57980.36 55282.00 54598.23 55182.25 63017.51 55224.38 57718.82 54003.75 53349.28 52718.07 53259.27 51922.98 49837.74 55421.57 50959.02 56230.69 51335.08 52833.73 61759.19 51625.88 61086.90 56470.45 53897.35 51539.77 57005.95 54084.92 64720.16 64903.72 64674.74 60445.71 58217.82 75714.44 61933.20 68603.54 58507.10 54740.43 41177.11 62798.00 64450.51 58836.78 60405.88 50599.45 54314.70 57201.73 68014.53 64069.70 57992.38 59899.60 59569.46 60657.51 62598.98 61257.74 PC(18:0/18:1(11Z)) 592459.13 647931.76 586166.15 551935.66 593583.04 549467.02 420584.53 482400.49 704403.20 573536.32 541582.95 521175.60 551741.11 486009.89 668764.09 499128.15 433146.13 589865.70 510219.58 531711.74 487245.09 504853.15 518848.22 428369.65 546417.71 533378.48 495697.89 413585.15 584183.27 433038.37 521720.94 615091.80 548682.03 550895.05 474037.87 609583.57 541972.85 640070.88 530550.85 432414.72 275600.78 661035.12 608282.22 544322.36 613118.90 425506.27 504986.35 463291.13 517193.26 576668.64 614512.58 569624.12 515203.40 531751.07 524583.49 525177.83 PC(18:3(9Z,12Z,15Z)/P-16:0) 6820.03 6994.90 6381.40 7183.50 6795.38 5991.24 3894.74 5637.21 8236.07 7029.96 7042.55 5856.15 7030.47 6139.24 4506.56 7051.73 4541.09 6260.08 5941.21 4539.79 3702.81 6335.59 6564.25 5754.91 6140.12 6198.08 6890.43 6008.52 6899.20 3877.32 3824.69 4666.51 5442.27 5227.45 2810.77 5646.88 4436.34 5329.19 5076.86 3363.52 3218.52 4666.65 5730.86 4135.42 4709.76 3959.25 4008.00 5199.11 4702.90 4658.22 3845.15 4153.83 4480.00 4578.14 4379.28 4951.00 PE(16:1(9Z)/P-18:1(11Z)) 2700.47 3162.97 3019.89 2875.74 3224.44 2748.95 2371.74 2752.91 3268.44 2892.40 2680.74 2743.51 2347.28 2539.21 2416.11 3219.68 2287.74 3041.53 2540.79 2879.22 2719.05 2455.28 2782.27 2395.33 2747.25 2903.50 2253.79 2717.59 2668.54 2038.80 2108.65 2351.52 2669.05 2119.49 2057.69 2776.66 2505.87 2564.98 2598.29 1557.40 1562.51 2623.03 2933.07 2451.92 2362.62 2059.84 1992.06 2505.07 2457.75 2385.74 2290.50 2225.12 2115.74 1904.51 2615.86 2416.51 PE(20:0/16:1(9Z)) 160885.45 152550.53 156567.73 139719.50 158937.95 154489.95 135721.28 129578.19 145327.28 161383.83 125671.50 131049.87 111227.93 118541.79 140295.22 137291.61 111714.94 156090.20 135887.84 138955.69 126701.14 148349.75 133207.06 118619.24 148155.89 146972.64 120189.40 131373.84 160518.01 141236.36 170462.68 167196.24 167208.21 160673.93 166198.42 203863.42 171642.16 181244.30 167219.52 131645.21 101256.95 233213.21 166600.59 146381.43 182581.98 143881.72 153053.48 164265.23 181468.81 158892.01 154091.94 150990.66 170283.40 148672.93 158864.42 177417.63 PE(20:1(11Z)/24:0) 1832.09 1359.23 3853.21 1618.64 1823.99 1354.62 5250.74 1464.36 1086.05 1503.65 1725.33 2692.23 1945.53 1183.53 1407.96 1431.13 1939.35 1748.27 1601.47 1364.98 1495.73 1413.90 2432.54 985.83 1321.70 1833.58 3376.43 953.00 681.76 1166.03 942.40 1299.69 1194.46 704.14 1127.81 1088.09 1198.51 1211.23 1610.50 1218.20 1091.56 6814.05 952.66 2052.44 2794.04 2283.85 3090.22 2843.27 2772.74 801.04 1521.61 2063.15 5112.76 1386.64 924.48 1892.49 PE(20:3(5Z,8Z,11Z)/P-16:0) 8034.70 7834.36 8106.59 7715.90 7443.53 6963.75 4356.73 6224.19 8228.01 7045.46 6996.30 6477.19 6132.89 6363.85 7576.73 7487.91 5650.69 6754.14 6937.94 6992.50 4826.70 6553.09 8403.19 5478.82 6730.25 6750.91 6469.58 5622.50 7511.23 6679.67 7665.67 7408.61 8126.43 6570.09 7030.92 9156.22 7479.43 8093.38 8034.04 6233.30 3423.10 8033.71 8399.79 6916.86 6536.33 6425.47 6172.15 7693.75 7515.51 7181.16 7046.44 6360.70 7392.38 6796.52 7464.16 7674.22 PE(22:4(7Z,10Z,13Z,16Z)/22:4(7Z,10Z,13Z,16Z)) 7849.86 8363.00 7380.23 6823.07 7524.14 7182.01 6471.69 6388.89 8279.90 7211.91 6841.20 7424.13 6966.29 6880.50 8460.46 6951.77 6336.43 7432.02 6787.53 7388.13 6590.71 6649.51 7211.98 5893.13 7482.78 7366.65 6871.34 5486.54 7440.08 5901.19 7231.76 7788.53 7277.66 7071.39 6298.00 7302.76 6716.34 7859.09 7175.22 6392.71 3807.99 7644.29 7521.93 6967.14 8222.79 5496.99 7335.31 6023.84 6243.33 7727.01 7253.68 7437.49 6765.68 7261.94 6798.94 7007.21 PE(22:4(7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) 16285.45 15971.45 15879.81 16751.79 15867.62 16540.07 15122.19 16772.04 15749.22 16644.76 17073.56 17011.49 16196.77 16780.24 16364.21 17407.85 16700.19 16059.59 16990.40 16896.42 15730.85 16888.52 16059.88 16408.45 16217.14 16415.15 16399.08 15910.70 16487.04 16927.52 15356.12 15235.82 16579.30 14739.32 15173.40 16349.37 15213.31 12673.04 15024.06 17778.65 15862.78 15429.07 14989.89 14305.06 17045.13 16723.96 16725.28 14997.53 15270.63 16392.50 14882.84 15450.41 16488.04 16345.02 16026.12 15931.66 PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2(11Z,14Z)) 9775.21 8434.73 9442.79 9434.80 9067.63 9073.67 8224.09 8639.30 8904.82 9278.97 9247.92 9464.35 8945.16 8430.26 9421.23 8331.59 7596.25 8364.42 8479.63 8219.71 7852.67 8793.95 8770.21 7939.72 8540.42 8697.28 8711.17 7424.72 9469.12 8341.24 9325.73 9988.90 10155.04 9601.85 9431.73 10581.83 9896.64 9518.50 8846.39 8946.68 7051.11 10004.87 9778.14 8650.85 8846.38 9460.95 9884.66 9456.22 9223.03 9169.98 9286.27 10045.30 9139.24 9275.25 9322.02 9601.17 PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-16:0) 3469.88 2807.92 3339.41 3613.04 3541.47 3041.53 2683.82 3232.25 4156.39 2838.50 3221.41 2408.30 2868.75 3045.20 2631.36 1479.59 2281.84 2419.72 2008.39 2161.60 2173.45 2433.93 3118.32 1706.94 2906.43 2971.00 2204.24 1741.00 3050.84 1150.23 1978.68 2805.68 1857.13 1954.34 2052.02 2074.24 2464.92 2040.59 1534.71 1690.84 1255.29 2921.77 1809.35 1902.10 1699.77 1925.78 2108.17 1988.97 2336.16 1976.93 2458.76 1990.72 1608.19 1991.54 1850.58 1581.73 CL(18:2(9Z,12Z)/18:2(9Z,12Z)/18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) 3404.71 3981.10 3694.82 3689.79 3020.98 2855.71 2508.35 3106.28 4423.35 3618.90 3183.15 2770.77 2768.51 2772.19 2698.56 3325.83 2216.60 3322.05 3354.68 3152.32 2885.97 3408.69 3349.74 2661.50 3234.28 2994.52 3036.65 3215.69 3296.99 1694.81 1770.36 2250.44 2043.85 2544.75 1834.98 1773.44 1570.30 2565.62 2406.25 1756.72 1763.12 2763.35 1655.58 1871.84 2358.58 1530.92 2281.87 1823.76 1778.39 1989.80 1645.78 2396.55 1589.48 2193.70 2282.06 1575.00 3-Oxododecanoic acid 44349.30 45392.61 35247.61 22557.25 38567.48 38106.55 24251.36 29970.15 31078.97 37449.07 40106.91 30169.01 30987.53 40849.89 24762.43 30525.33 32594.98 23137.77 24977.16 41654.58 32809.33 24622.42 16956.48 38572.12 27986.58 29450.43 45852.70 29977.98 28937.65 23485.14 28695.02 31382.43 18254.56 33236.60 32821.86 24582.98 34450.31 39968.19 37706.67 15639.15 10526.04 14540.20 39658.82 31386.88 19588.63 24497.58 18241.16 37826.78 34936.03 20487.32 30382.48 29537.71 25379.33 22884.84 25505.55 32563.54 PC(P-16:0/18:1(11Z)) 15325.80 15996.73 16370.01 13371.51 15124.62 15604.12 12970.79 13371.07 13045.94 15646.10 12920.63 12466.31 10108.32 13383.89 14605.93 12996.60 11663.99 15016.90 14725.89 13238.42 12834.37 14623.46 12352.47 11004.18 13825.61 13977.21 12811.04 12902.18 15969.45 12754.31 14536.01 20466.86 16537.46 15256.97 15909.59 23545.79 19800.56 18417.04 15636.20 11761.29 12825.99 42481.69 19136.29 15419.00 21782.07 15779.08 17911.81 18302.55 20081.05 19068.52 13336.49 19168.42 18961.94 14477.20 20355.05 30293.78 PC(P-18:1(9Z)/14:1(9Z)) 1478.42 1598.43 1771.11 1574.40 1554.82 1855.18 1111.25 1625.66 1386.06 1545.92 1512.85 1312.37 1051.55 1347.52 1174.09 2318.13 839.10 2059.42 1751.27 1475.70 1106.19 1639.14 647.47 1178.31 1148.37 1267.33 1338.13 1475.57 1842.79 1062.36 828.42 844.24 941.96 910.13 935.70 1152.03 1289.08 1005.77 1110.62 816.92 676.89 1101.16 1313.77 1061.32 1079.34 738.53 995.44 1245.81 990.04 1192.92 930.08 1118.04 1177.08 941.06 1059.33 1018.36 PE(P-18:0/16:1(9Z)) 4049.24 4350.40 4371.76 5333.00 4778.23 4448.27 4436.37 4189.81 4754.76 3651.10 6182.52 4241.68 4024.48 3600.31 3686.03 5629.48 4321.25 4572.48 4711.46 6014.52 4426.55 4523.45 6024.15 4944.79 4998.81 3658.11 4014.19 3793.93 3991.60 4042.75 3602.24 4800.35 4631.44 4985.53 3976.85 4797.19 4961.54 5496.00 4453.54 3620.85 4365.22 4894.75 4339.26 3715.35 3912.75 3245.68 3889.02 3919.55 4986.19 3641.00 4058.99 4253.49 4248.45 4075.05 4592.76 3932.70 SM(d18:1/22:0) 8076.25 8587.88 9924.42 10084.57 8863.55 8776.89 13624.92 8561.93 11625.07 8156.71 11354.81 9503.64 9411.84 8614.37 10403.62 11537.19 8219.36 11903.11 6516.94 10329.78 8775.23 9022.50 15707.06 8384.58 8602.77 9206.56 8625.27 9206.88 8678.76 9544.99 10576.49 9505.45 12200.96 10972.08 9417.57 10345.22 12132.96 10999.05 14436.73 9455.86 8209.38 9730.09 11928.15 13179.13 10015.13 9987.46 8901.25 11861.52 7179.95 9431.84 12044.48 8851.54 11836.56 10152.98 11258.29 10704.63 5,6-Dihydroxyprostaglandin F1a 1368.33 518.03 1044.00 213.25 698.43 332.82 784.74 399.29 471.06 349.28 760.84 534.90 1290.88 855.97 443.64 379.20 451.63 276.58 500.66 1067.44 697.17 379.03 182.81 704.30 879.90 737.99 1105.02 335.70 422.99 214.13 281.45 120.69 67.25 289.22 222.50 96.54 361.37 164.67 199.40 74.78 43.05 92.43 251.52 258.19 143.77 210.50 92.92 249.95 248.27 164.75 232.94 122.43 190.07 229.83 138.65 323.90 20-dihydroxyleukotriene B4 2503.74 2567.77 2863.52 1267.85 1854.91 1410.29 2586.13 1429.98 1236.77 1453.94 1811.37 2476.87 1324.70 1572.09 1160.98 2090.31 2002.73 1792.22 1363.92 3217.89 2602.69 1774.52 1405.01 3487.01 1577.39 1777.43 2320.43 1779.71 1616.41 1304.96 1664.43 1027.73 621.97 1501.65 2273.87 1503.81 2015.12 1755.86 2211.20 1212.01 361.38 732.00 2488.33 1636.45 956.82 1254.57 858.94 2183.31 2034.70 1345.83 1820.50 1939.85 1545.41 1634.81 1520.44 2436.77 Prostaglandin E2 ethanolamide 249.32 140.33 239.25 93.76 250.22 130.58 95.71 101.08 236.87 196.92 335.39 218.24 316.61 192.01 123.01 148.23 208.73 97.09 118.05 304.25 149.47 129.89 82.02 194.42 329.22 218.78 220.64 170.78 111.21 59.73 78.26 19.85 19.16 133.62 62.89 26.57 91.42 79.86 65.38 25.41 16.67 13.48 79.43 50.33 21.17 34.91 42.10 69.91 50.79 54.21 82.70 16.67 94.08 58.97 30.23 47.55 PC(O-16:0/18:0) 23797.81 27723.94 27194.91 25556.51 24372.19 26229.02 22754.53 20084.35 28093.78 24546.86 26063.12 24492.73 23581.63 21110.66 24778.08 26576.70 21748.51 31249.86 19043.35 27500.10 25557.98 23573.70 28444.35 22874.06 29199.77 29671.08 23014.15 22699.06 28802.71 24279.59 33625.30 32552.21 34998.22 28914.97 29607.71 32843.62 35602.59 35018.47 32013.72 27011.65 16690.00 30719.14 34212.52 34019.20 30633.10 26117.86 26220.09 26885.33 27113.49 31224.58 34410.20 27733.27 33533.51 27068.06 30372.18 30448.16 PC(O-16:1(9Z)/18:2(9Z,12Z)) 18004.68 20013.79 14180.30 15206.05 20158.00 17341.15 14040.41 14505.49 20908.02 20341.54 14884.04 15201.13 15367.10 16121.57 14857.37 15990.16 13264.28 17072.21 15651.06 16352.87 13479.90 15509.25 15008.03 14907.40 13799.23 16579.13 16027.52 14987.43 15367.38 16269.06 19375.13 17577.69 18899.92 19297.47 15368.78 21550.09 19325.27 19066.64 18041.20 12338.23 11353.07 19069.25 17380.26 16649.88 19577.91 13839.36 14771.69 16968.68 17673.03 16982.41 16925.78 16110.43 17505.68 15321.57 19512.04 17224.96 Dihydrotachysterol 32144.82 39633.68 20296.48 14509.51 61684.32 28624.05 139436.29 16332.13 8829.67 22207.27 13811.43 22491.59 16578.92 22976.83 73742.85 55859.92 19990.18 33816.05 8725.07 15676.06 7568.31 27081.33 26172.38 10492.27 20459.95 16027.88 29754.13 12129.63 19720.98 103349.64 67475.18 77154.02 87346.76 100652.34 73687.27 55136.65 43773.44 117394.92 100402.87 77468.82 117879.43 114443.23 138047.64 102876.88 69501.91 59566.34 107009.14 101247.95 78874.66 53295.95 78929.48 78575.57 65729.53 132122.46 40528.70 58845.13 xi-7-Hydroxyhexadecanedioic acid 59385.25 78849.64 54933.69 18890.92 66752.32 49540.91 25628.11 29105.84 56017.33 57912.82 35364.91 37997.43 55808.70 29637.41 37169.68 32344.83 16633.10 27579.00 27843.88 28355.89 30665.18 28327.06 16775.20 43191.34 47287.02 40814.78 43454.76 39482.22 59237.80 4245.84 14282.21 4818.29 5069.45 9676.77 12583.94 3700.08 12654.60 10397.39 12296.30 3538.12 703.57 5180.15 17351.48 21892.32 8416.53 17276.50 9393.60 32150.56 21889.58 20576.12 19502.48 12382.16 23582.41 15339.27 13167.07 19022.36 Dehydrophytosphingosine 447.87 1074.81 928.41 1153.59 797.40 1212.57 2134.56 2607.17 704.83 1526.09 1079.07 1241.26 1116.05 1193.41 1616.31 676.77 2053.75 1050.38 1253.24 1629.26 1800.58 1575.95 1920.13 1037.81 1981.66 2018.17 1763.54 1259.41 2211.32 1598.62 1166.02 1503.63 489.12 308.55 791.99 1707.79 838.62 1620.62 970.04 900.60 374.28 1343.00 460.24 1007.31 421.69 1724.80 485.76 802.62 1630.96 349.89 713.06 2410.89 471.07 924.57 796.42 2369.23 (E)-4-Octenoic acid 9766.12 14341.78 8465.25 4178.49 14475.00 9741.02 2979.07 5860.37 8464.06 10280.33 7010.46 8285.91 9804.34 6852.48 6552.30 5037.98 4684.89 6787.73 6746.52 6573.53 6317.59 6144.40 3589.13 9840.21 7086.60 5693.28 9955.27 7039.89 9538.74 4968.87 10710.12 4484.52 3010.83 8245.32 8870.87 3865.21 7890.60 7488.54 8963.05 4323.93 1985.38 3389.82 11196.61 10683.52 5763.03 8110.00 6257.25 14111.79 11772.88 9845.39 9539.47 8295.24 10486.56 7853.75 6813.70 11785.13 TG(14:0/20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)) 5755.10 3691.76 4803.06 3052.16 3080.85 3000.31 2327.04 4733.27 4091.32 3519.07 3763.50 5108.18 4363.16 4731.63 5405.92 6386.04 4542.58 5696.44 6359.96 5179.54 3045.54 5298.56 5788.67 4502.01 4471.77 4425.71 5497.29 4729.22 3578.10 4792.53 3382.94 4750.52 4770.04 5203.07 3239.92 3297.25 2607.07 4409.96 3185.98 3043.87 3757.98 3948.87 5051.68 3779.73 4872.19 3648.67 4012.97 5109.02 3988.06 4302.48 2854.66 4071.11 5043.11 4190.62 4627.53 5005.76 TG(15:0/16:1(9Z)/18:3(9Z,12Z,15Z)) 2466.72 5830.56 2287.18 3025.07 7655.06 6465.16 1297.62 3835.34 3873.85 5300.79 2029.78 3738.37 4062.96 4257.18 5147.48 2720.29 1948.58 1089.02 2500.43 2018.43 1482.47 5820.26 2972.84 1573.46 1500.23 2016.84 3886.71 1354.73 5540.79 3241.80 5622.94 3761.98 3618.65 2855.01 2362.13 7790.34 4780.41 4638.83 1574.20 2056.64 4637.65 6087.57 2686.58 2776.17 6440.79 3424.99 2772.86 5929.37 7776.32 5917.79 2443.08 4362.95 9397.27 2890.54 4788.12 5010.34 TG(15:0/18:2(9Z,12Z)/14:1(9Z)) 6072.14 14645.81 6250.98 9255.55 21125.57 20151.54 2797.21 10457.75 11814.00 15800.02 6015.55 10749.37 12529.91 12616.57 12755.10 7324.53 5402.68 2439.48 5801.58 4651.10 3976.19 15709.57 7986.41 3687.49 3744.73 5230.77 9853.34 2923.14 18174.13 6912.93 11055.33 8354.44 8261.60 6505.39 6012.64 14119.77 6440.10 8289.26 3048.71 4425.57 7909.36 11661.67 5091.34 4568.93 11996.66 6282.13 5071.63 11230.73 15964.65 10903.99 4939.88 10380.57 15419.57 6461.28 9128.31 9953.50 TG(15:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) 4664.52 3823.64 5234.46 3499.49 3991.60 4190.91 2490.03 4058.44 3789.43 3295.19 6901.89 3564.30 4746.71 5117.50 4988.40 4625.49 4700.46 4908.74 8109.57 4443.01 4287.30 3595.95 4547.87 4471.20 4961.13 4454.24 4573.31 5206.47 3688.61 2748.30 1847.57 2949.10 2653.50 3583.84 2563.46 2641.57 1619.34 3220.15 2708.23 3213.26 3705.22 2924.92 3402.07 3538.69 3246.60 2729.47 3517.64 3577.17 2144.65 3443.98 2889.91 2773.53 2753.25 3662.04 3278.61 3108.71 TG(18:0/20:0/18:2(9Z,12Z)) 50641.91 62265.33 53187.21 49721.25 72866.78 70680.85 22311.26 61152.65 56268.52 57943.69 53782.74 45109.25 64179.83 59675.19 60496.17 33284.72 26970.57 39288.46 53953.42 31749.05 33815.19 52383.28 30555.67 47735.43 39544.31 42656.77 58914.46 43314.53 57444.97 47118.61 112553.14 80971.63 73693.85 54736.67 58342.79 116887.22 114502.39 57686.68 69883.89 36641.85 52860.20 61122.37 55165.44 51346.77 75313.93 72187.75 55747.60 65079.18 89152.80 51634.31 53525.37 57313.83 60025.15 51083.73 74783.26 51640.74 TG(18:0/20:0/20:3n6) 48136.83 27983.90 41473.88 47437.85 35464.16 49937.93 22643.76 41090.51 37472.21 30989.84 42146.52 45709.42 31944.87 46660.97 25976.84 41415.10 41670.53 53055.94 36472.74 37598.15 50926.78 45820.54 26305.79 61370.97 44691.42 51606.41 46999.21 51107.18 49924.81 55041.13 45620.43 40200.15 48923.07 53990.53 52944.71 39096.90 43382.05 39253.10 39702.20 41231.64 53669.14 42007.01 43356.86 40255.91 52812.45 44830.28 53537.87 45103.13 40228.50 54127.86 49498.29 39853.41 52446.10 44327.85 49806.10 35441.19 TG(18:0/20:1(11Z)/20:2n6) 8170.67 12043.43 8048.06 9524.75 14839.75 10423.03 2758.23 10372.61 9465.17 10986.95 8163.67 7603.63 10696.20 9797.28 11389.27 5116.55 5223.61 7620.03 7332.07 7336.81 6168.19 10295.43 5982.27 8538.76 6971.72 7629.04 10958.28 5996.71 8543.43 4844.29 18037.10 9547.73 9282.59 10585.96 13313.05 20189.22 13230.34 13943.41 6375.21 5041.17 9939.20 16607.68 9569.35 8859.08 12112.18 13010.69 7588.64 9773.29 17320.65 12987.85 7313.93 13490.11 17884.40 10858.97 15316.90 14503.93 TG(16:1(9Z)/16:1(9Z)/18:4(6Z,9Z,12Z,15Z)) 8540.50 12869.57 12920.65 21217.30 13706.98 15992.34 2619.62 14318.19 13801.77 14128.34 15158.30 9622.11 14791.23 12526.67 7469.28 7048.33 12557.85 7366.37 7131.77 14110.47 14092.89 15698.76 13963.61 12904.14 10616.64 20497.52 15083.32 7943.53 16567.47 2745.08 7683.94 5055.27 2964.02 6466.59 5579.86 8719.91 4444.03 6324.04 2161.14 5378.12 6608.22 13442.27 4744.89 8824.09 6103.46 6742.05 3680.43 4153.23 6765.49 12518.77 7604.31 9641.42 10869.46 9739.06 6427.09 8975.51 TG(18:1(11Z)/18:0/20:3n6) 4052.91 4431.02 3128.03 4191.27 4329.71 3788.70 2697.54 2369.41 3947.09 3970.04 4527.59 4745.93 4192.27 3294.13 3929.99 3591.24 4466.47 2886.77 4058.35 3630.03 5332.03 3983.18 2863.44 5390.77 5227.34 4776.33 7509.31 6678.02 4900.81 3997.39 6704.15 4562.70 4540.10 4225.97 4462.52 5640.00 3892.36 3939.23 4651.04 3527.64 5056.27 4424.51 3696.47 4035.28 4112.13 5077.64 5101.35 4484.56 5488.78 4852.38 4034.63 4460.98 4575.35 3613.52 5006.91 3995.83 TG(20:1(11Z)/14:0/20:3n6) 2935.74 5472.55 3339.53 3034.43 6766.29 5447.27 1394.01 5324.11 4807.51 3996.77 4714.97 2308.73 5774.02 4809.65 5138.54 2723.93 1403.39 1680.86 2182.79 2263.62 1633.30 2593.77 1738.17 1777.88 1769.55 1967.04 2802.53 1887.31 4438.35 831.20 3628.12 2393.50 1256.42 1822.98 2295.53 3013.65 3389.74 2069.78 1907.71 1303.93 1674.30 2755.03 1281.60 1092.91 2259.92 2056.70 1487.59 1590.62 2356.25 1477.45 1330.87 2236.31 1670.37 1882.19 1904.82 1560.57 TG(22:1(13Z)/15:0/20:4(8Z,11Z,14Z,17Z)) 2663.39 2845.77 2667.15 2621.21 4054.88 2744.70 2126.48 3029.10 2734.25 3284.01 3132.50 2614.00 2491.84 2821.84 3136.61 2822.31 2347.24 3059.52 2873.54 2477.69 2255.24 3357.84 2587.42 3235.19 2865.07 3091.51 3617.67 4509.83 3904.47 7574.43 5371.13 7901.56 7712.51 3963.78 2700.91 7246.33 9305.89 3583.55 9238.24 3941.31 3632.35 2706.67 4713.29 6008.77 5801.24 5785.23 6002.97 6564.49 5345.21 2858.18 5433.38 3139.03 4544.48 3538.93 5762.74 3104.46 TG(22:2(13Z,16Z)/20:1(11Z)/O-18:0) 1448.92 1642.05 1621.03 1105.37 1670.85 1729.16 1653.34 1632.66 1759.89 1265.45 1212.86 1785.87 1723.80 1566.90 1776.48 1694.34 1474.80 2586.54 1402.64 1184.58 1770.23 1861.13 1094.18 2914.70 2419.56 2131.54 1890.32 4919.80 1942.97 5862.99 7967.76 9833.64 7806.92 4533.92 3525.24 12155.02 16312.77 4250.97 10102.86 3555.56 3754.37 2344.23 4860.07 5505.79 7026.04 6276.94 5661.36 6607.75 5912.45 2299.22 4795.48 3409.89 4452.67 3638.01 6679.19 2519.74 CL(18:0/16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:1(9Z)) 4187.26 6555.24 5553.95 5308.14 5156.34 3781.54 2878.39 4272.14 6464.10 4302.35 5321.77 4089.36 4062.63 3813.57 5387.34 5006.95 3140.63 4997.35 3509.23 4537.51 3561.75 4301.97 3772.74 3624.54 3676.54 3162.93 4004.96 4696.66 4456.93 2775.36 3176.45 3207.73 2194.09 3071.70 2391.62 2335.27 2840.98 3678.85 3568.31 2413.21 1835.53 2712.66 2846.91 2764.27 3067.29 1942.82 3176.85 3097.83 3410.11 2925.48 2572.88 2999.05 2165.18 2848.95 2736.77 2216.46 CL(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:1(11Z)/16:1(9Z)) 3116.40 5667.24 4536.14 4542.55 4299.20 3592.46 2063.51 2804.75 4759.18 3137.98 4098.04 3806.05 3373.50 2604.11 4412.28 3241.57 2598.85 4573.48 1869.76 4072.83 4154.19 3753.76 3255.51 3203.58 4898.50 2460.16 3467.84 4103.63 3469.92 3352.57 4250.37 4720.29 3329.14 4383.25 3301.15 3782.36 4105.84 5047.89 5078.68 3595.39 3438.62 4023.30 3784.05 3872.79 4179.38 2316.65 4911.37 3399.04 3995.56 4027.37 4124.71 4281.21 2831.18 3240.88 4133.90 2749.40 13-HDoHE 1144.96 1387.99 829.25 577.96 2203.13 1126.23 4147.28 611.43 503.40 821.49 615.74 805.25 781.98 899.08 2213.85 2317.36 840.19 1268.67 565.39 717.22 430.74 936.35 1187.54 518.00 865.13 707.99 1099.22 560.87 827.87 3319.66 2105.18 2351.00 2767.49 3243.46 2626.32 1664.64 1269.40 3790.87 3048.78 2405.62 3643.80 3844.41 4516.27 3383.14 2109.33 1842.57 3347.95 3128.59 2251.36 1818.47 2702.41 2534.88 2191.88 3875.21 1304.24 1979.55 3-hydroxypentadecanoyl carnitine 608.74 397.47 352.60 168.56 321.93 252.60 169.92 233.66 212.42 306.80 374.04 246.69 372.57 392.95 176.37 274.71 241.84 122.50 174.39 306.42 232.72 186.55 126.55 272.34 294.99 225.02 532.69 190.94 260.87 73.34 87.18 96.60 72.48 145.28 88.01 52.52 122.50 78.97 134.83 57.36 38.88 69.26 114.55 118.89 64.65 107.17 68.17 99.31 121.13 68.82 113.28 87.47 81.04 100.78 69.85 113.46 10-Hydroxy-E4-neuroprostane 507.40 298.69 436.89 183.80 537.31 228.51 250.36 97.94 640.19 333.12 498.61 484.39 595.07 309.96 132.18 149.19 516.27 312.92 83.90 862.74 402.11 440.05 278.83 471.57 1071.52 750.95 451.18 395.97 166.02 194.03 253.38 47.57 44.39 402.45 174.08 41.44 263.68 178.94 197.12 64.21 15.60 16.37 152.22 148.48 45.88 66.77 62.25 170.20 93.44 144.33 187.52 34.63 222.92 102.35 100.79 110.31 17-phenyl-18,19,20-trinor-prostaglandin D2 3761.88 2162.54 2379.56 808.16 2369.58 1352.40 1603.85 1153.73 1340.07 1810.37 1902.32 2208.86 3035.88 1822.42 1477.80 1274.75 1162.75 777.18 1201.72 1714.75 2126.65 1354.94 867.27 1906.46 2132.24 1585.63 2703.61 1135.36 1561.43 377.25 548.66 242.19 213.04 466.49 366.17 235.15 682.74 394.08 586.09 220.57 102.25 235.03 676.12 552.08 243.68 547.10 252.96 815.66 738.20 406.64 499.82 356.22 534.93 530.19 411.92 631.58 CL(i-12:0/i-24:0/i-24:0/18:2(9Z,11Z)) 14260.61 14608.41 14729.05 14052.75 14695.52 12563.12 9141.56 10520.37 17461.14 13946.48 12162.22 11915.23 11922.89 10065.26 15794.91 9760.50 7777.54 13463.33 10809.27 10235.37 10919.80 11680.44 10129.29 8653.58 11091.22 11580.04 9981.27 8399.36 12766.06 10382.44 13125.07 13875.31 13061.00 14405.86 12337.18 15452.55 14929.30 12177.69 11075.10 9122.81 4541.68 15214.17 14273.71 11839.27 12890.09 11195.52 11844.68 12758.44 12819.90 11323.24 14096.50 12322.68 11571.23 11563.20 11684.61 12395.35 TG(i-15:0/a-21:0/i-18:0)[rac] 4425.42 5168.19 4335.71 3266.41 4615.02 4740.33 4469.38 4218.58 5699.14 3655.77 3819.04 5265.88 4609.98 4010.08 5006.90 4883.12 3718.71 6042.59 5031.13 3770.56 5179.96 5575.39 2836.77 7629.02 5692.93 6344.72 6587.04 13714.90 5522.20 13309.82 24384.18 26159.78 20463.92 14629.93 9022.12 40727.67 62466.90 14474.11 32759.38 11972.32 11948.21 8115.17 15843.59 15712.82 22781.69 21741.51 19396.08 22358.24 20978.64 6735.78 15484.18 10818.13 13118.14 11040.09 22173.45 9787.01 CL(16:1(9Z)/18:2(9Z,11Z)/20:4(5Z,8Z,11Z,14Z)/16:0) 1782.81 1936.00 1944.31 2145.05 1443.75 1197.19 1061.86 1812.57 2488.75 1664.51 1828.25 1182.73 1440.04 1461.40 1494.37 2288.12 1200.30 1481.73 1728.08 1483.82 1314.81 1626.82 1923.32 1108.04 1292.13 1529.84 1570.31 1425.88 1725.06 734.46 650.11 847.82 749.58 885.97 624.81 817.26 643.87 940.35 1143.24 699.26 636.64 887.09 755.74 737.89 916.41 564.09 866.62 806.62 744.58 781.58 715.02 921.85 614.47 890.16 786.00 620.17 CL(18:1(9Z)/16:1(9Z)/16:0/20:4(5Z,8Z,11Z,14Z)) 10103.75 10981.93 11071.20 12098.25 8104.97 6543.11 4692.76 8000.32 13481.26 9598.44 9475.78 6787.05 7147.88 7003.81 9257.18 9438.11 5359.73 9077.23 8247.83 7305.68 6101.59 8545.65 8384.46 6108.45 7860.55 7374.31 7876.86 7226.41 8884.29 4369.43 3176.30 4776.06 2766.92 4994.57 3096.66 3475.76 2665.43 5487.54 5606.75 2919.51 2479.18 4287.44 4403.42 3204.82 4919.41 2438.59 4586.77 4021.37 3317.51 4276.84 3133.14 4618.25 2569.88 5225.44 4077.65 2604.79 CL(18:1(8Z)/18:1(8Z)/20:4(5Z,8Z,11Z,14Z)/16:0) 14315.86 17061.51 15520.47 14311.02 13919.02 9553.64 7079.96 10241.00 17908.72 15065.41 12244.60 9874.49 9987.30 9476.03 14586.23 12772.52 7041.02 14141.24 12052.72 10729.78 8879.53 11072.83 9501.06 9687.32 11985.65 9639.50 10228.95 10863.95 11384.44 7377.10 6480.64 7589.12 4829.87 8045.40 5499.95 6019.68 5482.56 10314.27 9173.15 5094.34 4818.27 7511.35 7531.50 5997.44 8416.66 4488.99 8407.25 7423.22 6875.66 8144.67 5605.88 7628.10 4847.63 7804.88 7538.30 4760.61 CL(20:4(5Z,8Z,11Z,14Z)/16:0/18:2(9Z,11Z)/18:2(9Z,12Z)) 9474.60 11143.81 10611.80 10791.85 7855.55 7063.19 5924.16 8795.48 13044.60 10186.36 8850.93 6614.61 7462.73 7751.18 8993.85 9720.98 5524.81 8540.05 9628.01 7014.82 6356.36 8654.99 8019.37 6807.33 8041.43 7689.87 7744.09 7495.32 8937.00 4175.91 3672.75 5268.36 3748.72 5612.03 3758.01 3984.83 3267.43 5965.24 5576.01 4049.54 3547.42 5742.19 4360.56 3804.48 5635.10 3114.22 4993.56 3983.96 3778.30 4930.78 3483.69 5577.31 3525.95 5501.05 4833.40 3506.53 PE-NMe2(18:0/18:2(9Z,12Z)) 23587.11 21239.33 22393.57 15002.90 25383.99 18797.29 29316.28 13523.61 18486.80 24190.75 12203.55 20984.02 20756.85 17519.22 32022.77 15183.69 14148.58 22142.14 24169.01 15711.86 15937.86 17197.67 12550.67 12085.39 17967.41 17598.16 21459.34 11492.94 14964.11 18959.97 21780.82 29957.89 25025.82 20109.28 19418.71 23304.56 23868.15 28068.02 22815.03 20071.90 11050.45 43727.19 27564.93 30510.06 26990.01 25125.94 27360.59 31766.24 32113.05 17797.70 27582.14 22911.91 27240.66 29465.49 18568.60 25163.75 PA(24:0/22:2(13Z,16Z)) 5705.91 4507.74 6341.82 6101.56 3595.11 4784.79 2493.38 5097.71 5355.92 5411.14 4472.27 5789.19 5020.62 5730.17 4805.03 3794.31 5336.37 4526.45 4281.72 4986.69 5592.30 5001.17 6443.84 5568.75 5816.84 6402.64 5057.31 4651.15 5585.15 1880.58 2956.69 3341.40 2697.01 3766.94 3503.70 2622.55 2359.59 3323.08 2574.34 4106.54 4443.78 3928.54 3134.00 2095.90 4186.14 2953.22 3263.78 2042.60 2337.34 4176.62 2926.66 3964.68 1889.73 4372.22 3107.13 2987.62 CL(8:0/8:0/18:2(9Z,11Z)/23:0) 2468.29 2109.32 2361.11 2286.12 2128.25 2265.67 2289.61 2200.26 2241.01 2191.73 2216.51 2375.00 2383.89 2307.46 2313.27 2405.83 2526.41 2196.44 2444.94 2422.73 2429.84 2285.35 2454.89 2322.71 2197.87 2332.00 2338.85 2475.75 2354.06 2434.15 2245.34 1968.32 2341.76 1956.26 2082.28 2181.11 2106.85 1717.00 1976.51 2499.89 2645.60 1790.05 2122.60 1984.80 2299.32 2412.45 2324.01 2224.21 1894.56 2115.66 2224.56 2005.02 2540.87 2086.37 2156.37 2429.36 LysoPE(P-18:0/0:0) 31.35 33.34 34.61 242.52 74.15 88.57 1282.92 520.19 85.47 26.14 40.97 25.11 46.84 309.95 40.32 174.74 47.84 246.24 345.74 80.84 148.70 243.40 146.88 1017.06 51.29 47.77 69.81 847.36 60.47 51.33 38.37 41.69 49.38 54.72 48.37 61.36 43.57 49.53 56.35 159.39 3180.39 86.41 54.81 55.08 51.06 38.18 36.64 46.38 44.79 54.48 40.51 61.32 53.98 27.07 36.04 47.41 Eicosanedioic acid 760.99 764.78 701.00 707.90 771.01 750.80 848.95 736.95 807.11 727.41 803.04 769.54 736.03 686.44 691.39 760.03 593.04 840.33 634.04 743.06 746.44 650.92 797.78 745.88 758.46 769.83 726.12 635.51 781.55 799.84 707.68 901.54 843.47 951.30 808.13 886.48 844.18 847.43 936.80 703.99 948.90 1024.52 934.57 827.51 892.68 693.20 863.27 760.99 806.85 775.18 796.34 890.31 753.40 782.28 862.87 804.02 1-O-Hexadecyl-sn-glycero-3-phosphocholine 82.52 60.09 94.29 144.41 157.76 175.69 1568.91 639.54 74.90 83.83 79.89 85.44 50.42 228.92 32.24 88.99 46.49 221.72 335.15 104.42 229.73 641.82 93.78 1114.15 57.97 71.94 82.46 1555.47 126.04 57.00 44.69 49.23 47.06 39.10 30.56 55.30 73.98 71.38 63.79 133.97 6334.82 196.36 87.58 67.91 111.33 84.26 74.12 67.51 138.76 59.28 98.27 53.88 58.90 51.79 80.65 97.17 19-Hydroxyprostaglandin E2 1083.94 699.59 821.79 183.71 519.03 266.09 820.22 222.04 365.20 310.69 591.54 587.87 981.67 364.92 351.26 132.44 378.19 265.64 301.48 1179.78 786.36 274.76 162.66 771.94 817.60 766.25 819.20 445.39 226.66 221.47 512.49 93.08 47.07 459.66 328.28 126.24 514.07 188.27 335.69 77.95 8.38 79.81 271.79 243.69 75.68 228.96 78.13 464.63 474.21 172.24 287.35 231.36 314.70 239.79 189.55 236.62 Cer(d16:1/23:0) 2076.19 1663.76 1188.55 802.98 720.14 2211.10 1644.31 422.32 2457.85 1144.96 657.59 1634.91 668.31 1438.12 1060.13 1390.71 541.13 1323.19 1420.77 1848.81 1694.86 1227.46 489.92 1542.03 982.95 997.07 960.89 984.72 1472.76 2201.50 4496.29 1572.99 1192.50 1496.91 1511.35 1409.29 3099.06 981.78 807.14 873.02 1013.68 1695.46 1394.85 1599.45 927.83 1151.13 904.36 1444.33 2116.01 1735.48 1141.17 1597.29 1624.94 1571.10 1143.65 1635.16 PS(19:1(9Z)/22:4(7Z,10Z,13Z,16Z)) 2176.45 2168.50 2002.82 2293.16 2342.00 2142.50 1613.31 1945.68 2376.86 2225.45 2233.57 2100.18 1976.10 1950.55 2270.99 2411.24 1885.44 1999.11 2100.37 2053.98 1685.56 2055.03 2240.84 1791.07 1880.91 2442.11 1989.61 1612.79 2281.09 1939.83 2080.63 2265.38 2351.08 2273.16 2071.36 2353.15 2192.16 2260.23 2158.69 1815.42 1486.32 2377.40 2289.64 2255.75 2218.55 2133.26 2017.14 2438.06 2209.83 2008.17 2002.30 1954.74 2182.86 2206.12 2165.78 2132.79 MG(18:1(9Z)-O(12,13)/0:0/0:0) 696.85 716.70 609.46 899.62 804.58 643.32 510.03 639.66 822.59 530.86 916.27 682.47 725.18 765.82 743.64 372.24 450.07 399.19 374.08 569.68 507.82 594.19 556.07 1120.92 700.64 594.32 624.49 578.23 1078.00 962.33 1661.83 1744.71 1808.33 2004.33 1638.85 1590.49 1866.08 1559.95 2000.40 1775.41 1502.26 1513.54 1478.34 987.26 1374.38 1204.68 871.65 1253.09 1266.44 1189.17 1182.89 1171.16 1071.71 1052.62 1363.31 947.54 MG(0:0/18:3(9,11,15)-OH(13)/0:0) 86.02 86.24 47.35 22.17 47.99 38.73 42.63 35.15 64.48 43.55 44.08 65.40 39.54 25.78 30.14 32.53 30.80 34.02 38.83 52.43 49.82 27.73 30.69 69.00 40.23 75.83 58.33 40.58 49.98 15.42 15.27 7.83 19.14 16.17 24.50 9.24 20.89 13.47 13.98 13.94 4.56 4.76 23.71 18.93 2.67 18.99 12.52 31.77 38.27 12.99 31.90 20.04 40.96 20.01 21.35 20.55 PE(20:1(11Z)/PGJ2) 1667.11 1628.84 1583.65 1822.64 1724.44 1613.79 1294.61 1534.11 1915.16 1690.03 1780.30 1794.75 1403.34 1491.54 1422.14 1752.12 1363.72 1628.98 1581.38 1679.33 1525.29 1607.39 2049.16 1445.80 1648.74 1723.72 1599.17 1345.66 1718.78 1346.35 1615.99 1678.04 1663.53 1642.72 1523.69 1885.30 1722.11 1404.28 1492.51 1241.44 744.01 1745.00 1801.08 1878.09 1507.13 1607.96 1546.02 1959.60 1714.63 1371.13 1649.71 1550.55 1445.64 1505.70 1830.18 1663.27 PA(22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)/22:2(13Z,16Z)) 1904.33 1730.26 1877.55 2113.94 1877.86 1833.65 1666.36 1877.79 2252.06 1673.00 1906.24 1498.98 1706.61 1694.05 1661.63 1242.89 1604.79 1770.49 1260.46 1478.22 1724.65 1645.21 1640.28 1318.62 1883.31 1863.86 1336.15 1315.09 1722.37 904.61 1055.45 1503.87 1191.49 1254.23 1179.80 1275.57 1321.71 1183.04 1130.90 1227.73 1052.55 1720.40 1109.61 1302.40 1278.16 1102.65 1385.65 1187.03 1245.89 1511.38 1520.50 1334.68 1093.69 1184.14 1242.02 971.83 PA(PGE2/8:0) 2765.86 1748.60 730.60 339.14 719.71 349.63 1965.76 310.82 543.59 610.94 1216.90 1211.06 901.82 531.64 917.37 334.30 875.57 554.34 597.54 1421.84 1443.83 374.29 330.81 1394.95 731.74 703.81 1336.75 1047.06 445.79 85.11 154.96 118.18 72.31 353.62 239.62 178.93 390.33 114.29 133.39 134.44 52.42 109.12 234.54 374.07 108.40 288.02 117.22 195.01 322.90 156.31 529.02 446.91 359.46 174.76 210.17 378.64 PA(PGD1/8:0) 2928.50 1433.46 1056.03 377.26 812.06 452.88 2761.10 485.36 799.54 917.68 1132.55 965.26 1394.51 671.35 1120.43 356.30 1066.49 451.06 629.31 1306.80 1743.47 385.12 336.45 988.38 1109.96 882.91 1775.17 797.40 564.77 203.08 151.04 107.52 109.51 327.64 176.28 170.40 458.43 111.02 164.04 125.91 99.43 116.12 243.94 343.34 94.04 324.02 108.08 203.87 258.80 186.00 492.79 439.02 290.38 148.55 148.23 517.12 PE(PGJ2/22:0) 5599.48 4951.72 5362.07 5583.05 5361.25 5852.79 6004.58 6093.55 4822.64 5445.01 5832.58 6038.78 5829.07 5924.34 5309.83 6386.83 6830.00 5137.21 6016.80 6136.56 5826.57 5803.85 6099.66 6499.51 5444.38 5838.66 6018.99 6265.70 5760.73 6032.01 5300.47 4767.05 5730.33 4714.78 5202.74 5392.99 4999.93 3958.61 4723.44 6682.34 7860.13 4316.86 5072.18 5110.41 5666.04 6330.43 5757.55 5405.56 4986.88 5396.27 5084.67 4972.24 6054.73 5429.20 5658.01 5691.22 PE(22:4(7Z,10Z,13Z,16Z)/PGJ2) 1001.14 833.26 704.98 930.24 895.15 777.47 535.30 735.47 927.69 771.25 885.96 897.71 713.77 765.73 633.28 748.24 494.72 542.90 781.91 790.22 495.93 736.48 830.91 627.20 657.74 769.29 928.09 509.03 890.01 508.28 747.72 694.48 670.32 671.93 670.01 719.99 665.16 633.23 574.23 464.56 268.33 756.12 872.62 690.76 754.79 751.51 515.01 941.91 834.88 596.65 620.22 649.44 653.72 694.82 793.61 747.20 PE(20:4(6E,8Z,11Z,14Z)-OH(5S)/P-16:0) 32720.50 32735.01 31082.40 30392.38 32526.32 28799.49 19380.64 27411.71 34751.03 31271.40 32686.22 27198.40 27505.12 27690.74 28113.23 30090.58 23523.74 30197.48 27000.50 27585.63 24900.78 27088.34 28453.78 23243.48 29122.69 30037.26 28152.04 21718.80 31328.01 22471.09 27258.40 28037.15 29134.77 27221.56 25389.13 33472.16 31809.58 28967.39 26147.92 20149.09 9963.20 31008.68 31712.60 27984.94 25888.76 24164.62 23194.36 29043.64 29088.15 25732.93 27905.04 25997.43 28151.05 23884.34 26791.42 27857.96 PE(PGJ2/P-18:0) 3691.72 3256.54 3362.20 3581.62 3616.07 3381.04 2280.29 3317.05 3741.13 3599.35 3983.94 3451.58 3079.09 3274.05 3277.67 4619.13 3294.51 3026.99 3757.01 3849.18 3071.59 3296.32 4187.02 3037.64 3355.26 3580.75 3597.31 2931.87 3715.52 3307.06 3441.39 2995.69 3688.55 2850.86 3178.89 4030.30 3538.05 3000.88 3215.54 2780.56 926.85 3247.03 3825.24 4385.58 2908.98 3680.70 3058.04 4201.74 3772.29 3264.76 3477.02 3128.69 3919.03 3096.39 3607.60 3858.71 PE(20:5(5Z,8Z,11Z,14Z,16E)-OH(18)/P-18:0) 2037.25 2090.23 2445.74 2261.16 2415.24 2084.92 3181.79 2063.06 2415.48 1998.71 2423.77 2126.95 2087.30 1574.24 2019.45 2231.97 1823.85 2234.84 2076.23 2509.54 1441.27 2614.08 2040.73 2116.55 2617.80 2194.78 1786.63 1819.46 2013.74 1732.48 1797.44 2363.72 1628.96 1939.04 1532.36 2292.54 1726.39 1966.32 1623.39 1662.46 1276.68 3325.21 2320.03 2501.55 2016.13 2365.54 2530.82 2448.55 2830.72 2235.01 2219.31 2000.53 2006.77 2361.16 1824.48 1582.46 PE(18:3(9,11,15)-OH(13)/P-18:0) 727.12 722.93 734.94 773.14 762.23 672.98 480.30 684.85 735.00 755.55 750.64 633.29 638.52 622.33 684.51 817.56 578.57 738.15 576.64 666.14 663.53 610.21 765.03 632.50 816.01 740.53 682.64 649.96 770.19 545.29 501.59 678.41 777.74 608.41 368.28 859.42 687.25 719.74 643.22 463.86 346.82 878.64 769.96 563.91 669.95 573.84 628.63 611.49 764.30 798.81 670.67 608.52 715.16 628.71 596.58 719.95 PC(20:4(5Z,8Z,11Z,14Z)-OH(16R)/16:0) 12077.61 14371.63 10092.01 13099.39 12924.32 13960.18 8924.53 12113.58 14583.35 12834.25 12622.11 12228.50 10711.89 9272.14 12862.87 14505.41 11304.79 13490.71 7450.34 12170.41 10526.58 12197.05 12878.97 10073.28 13172.13 12531.47 10326.75 11208.43 13574.21 8837.40 12047.48 11280.80 11351.14 13186.97 10740.72 11236.86 10660.58 13431.63 12421.87 8451.03 5049.77 12981.34 8586.27 15541.26 14068.65 11815.86 13180.61 14853.84 11957.05 8945.42 9579.73 8621.51 11471.24 10119.00 11640.66 9856.68 PC(17:0/PGJ2) 6776.43 6362.86 6742.35 7505.04 7246.27 6616.90 5487.96 6754.35 7791.22 6081.54 7596.33 5636.47 6392.96 6378.89 6176.45 4954.21 6733.66 6904.76 4558.60 5733.15 6688.31 6046.67 6858.99 4919.94 6507.92 8020.03 5525.10 4388.98 6807.13 4759.52 5327.38 7109.42 6614.78 5598.46 5683.53 6595.64 6788.88 5891.60 5299.80 4903.82 4212.27 7269.96 6030.14 7209.88 5570.87 5924.56 5831.62 5835.27 6258.70 5655.67 7862.80 5289.94 5799.81 5437.86 5395.52 5062.54 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17)) 748.29 758.79 671.35 688.00 736.84 705.61 439.85 781.12 844.93 705.03 786.63 717.23 612.41 638.06 695.94 595.91 406.46 652.45 646.59 629.24 455.10 722.38 717.47 488.79 537.15 621.86 665.48 414.47 696.55 496.46 535.96 544.39 494.05 574.81 500.33 533.65 582.07 544.49 504.69 417.14 279.38 604.97 518.39 520.19 503.16 536.59 475.39 577.69 613.40 452.29 517.94 535.17 489.61 649.71 513.89 536.74 PC(20:0/18:3(10,12,15)-OH(9)) 12982.89 15884.87 15219.40 14111.84 21615.96 21232.72 12463.51 17959.78 21197.26 18659.82 18749.65 17260.78 12935.20 17505.38 18533.08 17659.84 11980.07 12755.09 19918.68 14564.29 12433.93 19265.14 15685.40 14530.75 11134.55 12356.50 12307.36 12658.30 18444.17 26975.57 23760.42 33480.53 33000.10 37156.78 21532.22 35040.45 27548.85 31765.36 27677.56 23024.52 38483.20 26472.17 31876.94 23915.98 29059.65 17477.85 22221.21 24154.38 26362.77 21886.78 27361.34 27179.65 21498.15 23324.16 23452.78 24614.56 PC(PGJ2/P-18:0) 3653.82 3616.80 3013.73 3569.42 3560.98 3172.91 2578.04 3196.68 3927.34 3422.82 3485.62 3234.70 2999.05 3159.74 3336.60 3255.95 2540.21 2648.41 3294.22 2936.70 2717.88 3594.74 2930.66 2934.59 2641.15 3086.41 3222.73 2601.11 3256.36 3164.40 4330.97 3913.60 4952.35 4754.11 3719.12 4751.57 4513.18 4723.92 3522.82 2906.17 2971.41 3722.75 4267.58 3849.21 3307.57 3496.64 3121.29 4291.91 3993.89 3134.34 4083.84 3466.67 3496.27 3422.15 3540.51 4144.69 PC(P-18:1(11Z)/20:5(5Z,8Z,11Z,14Z,16E)-OH(18R)) 21016.39 22110.03 19702.20 22228.81 23421.92 20871.74 14556.99 19031.82 26716.72 21775.98 21410.19 18200.69 18862.37 18017.95 23363.49 22600.38 16165.51 19945.33 20424.09 19304.45 14631.00 19773.26 21081.58 16142.12 19312.05 21295.96 19084.46 15237.54 21268.21 16746.82 20783.44 23191.79 23181.07 22603.01 19480.59 24210.20 21812.89 24429.14 21839.41 14565.52 9561.51 27384.45 23838.76 22937.07 22360.04 19669.87 19521.15 23874.91 22780.65 18302.12 20109.69 18550.79 20909.81 20616.75 21883.15 19860.60 DG(20:5(5Z,8Z,11Z,14Z,16E)-OH(18)/0:0/21:0) 507.40 568.56 501.39 397.46 486.59 1240.81 285.68 475.98 964.27 240.57 447.33 479.78 344.75 382.68 486.88 591.59 447.12 468.40 797.25 438.41 382.17 301.77 249.38 571.85 513.69 455.59 599.77 460.98 579.09 506.10 1372.24 957.90 471.96 609.40 837.17 697.55 1116.66 627.71 405.88 274.67 270.30 911.54 576.87 756.73 527.31 715.32 460.71 707.66 716.77 413.09 281.11 583.46 783.66 518.08 782.06 912.62 DG(i-20:0/PGF1alpha/0:0) 60184.55 62289.59 59420.96 62044.79 64481.69 56977.81 42942.92 49237.35 70649.62 59681.85 59746.32 55148.78 54104.16 50216.66 61271.39 61771.96 49427.68 66312.83 49518.11 58765.48 57309.50 53318.42 62743.04 49478.39 64563.53 62331.96 50465.50 48158.39 63045.66 55584.41 68711.12 70799.14 73575.45 52550.78 63009.75 75499.51 71603.25 75462.77 61611.53 53563.00 26095.63 69262.06 73329.02 73832.62 66195.58 57400.93 58919.49 51436.18 64615.89 69613.31 75609.99 63465.58 67788.29 57456.95 62379.79 61891.59 LPC 16:0 2657.19 3958.16 2143.99 14104.53 5554.32 5253.62 84502.28 27826.09 7319.83 2482.58 3020.57 2251.13 3062.46 15345.72 2182.93 6515.91 3455.50 11826.95 15693.87 3247.73 11527.68 18019.38 7338.99 43757.20 2799.04 2428.74 5464.48 41233.51 5249.50 1957.42 2709.47 2787.77 2247.31 2693.45 1856.76 2297.80 2941.81 2384.91 2179.14 7066.13 192480.41 2850.76 3350.82 2255.89 2195.34 2765.78 2277.36 2661.07 2618.21 2153.16 3373.89 2575.63 2526.45 2412.95 2115.64 2455.02 LPC 17:0-SN1 168.99 236.91 158.42 346.26 315.85 281.65 8247.28 823.92 266.23 138.12 137.65 142.73 151.48 610.83 164.18 307.92 183.35 554.27 851.33 199.85 506.68 794.30 216.34 1961.91 168.74 120.99 340.02 1122.95 210.05 130.76 158.22 184.76 121.19 116.76 129.82 150.55 167.34 173.82 163.44 440.72 7450.52 232.94 201.12 192.48 163.01 152.51 156.97 220.13 157.15 103.42 150.22 168.96 170.13 226.34 133.39 133.66 LPC 18:0 2740.73 4156.96 2357.39 15354.65 6796.86 6342.47 73557.81 29317.97 8353.29 2888.58 3281.15 2305.35 3187.51 19120.69 2734.19 8662.27 3944.43 16936.78 19190.99 4651.48 14859.92 24462.18 9021.99 67839.30 2978.68 2744.73 5663.43 56017.04 6680.24 2130.89 2862.87 2471.62 2402.24 2745.02 1571.53 2484.44 2773.92 2632.85 2088.09 7808.23 207080.60 3273.17 4141.94 2819.97 2370.33 2730.32 2471.72 2517.73 2695.46 2560.97 3419.25 2749.56 2721.61 2604.75 2728.69 2846.85 LPC 18:1 22227.12 18262.41 18788.79 7534.90 16823.62 10733.05 11548.31 11636.71 13889.06 12936.20 16034.57 13640.60 21824.00 13352.84 20383.86 15652.29 11917.59 12295.04 10852.55 17141.93 16981.57 17496.79 7250.12 13675.56 15522.74 10488.55 18861.27 8669.82 22242.31 9816.58 14318.23 7692.80 7564.21 17872.99 8884.12 10525.10 12484.56 16055.33 13629.09 8058.22 10704.37 12686.15 17207.60 10486.03 10729.70 10119.31 11424.95 16991.88 13252.13 7568.17 9740.38 10145.58 9439.46 8472.24 11170.69 11786.61 LPC 18:1-SN1 7220.11 13725.70 5463.08 36292.53 18915.18 15727.49 201470.42 87246.51 19838.68 7347.83 8230.97 6361.90 9582.62 49970.23 8654.97 23074.33 10763.51 45646.54 52699.82 13003.13 37740.97 64411.42 19953.90 172702.64 8190.12 7009.69 14986.76 144152.86 14271.42 8066.60 10673.45 12388.96 8158.16 12471.18 6568.25 10548.67 11305.10 10602.94 9826.24 36154.98 897502.47 12656.64 15485.68 12413.48 8579.00 9884.52 8673.91 9624.23 9875.06 8073.26 11718.12 11133.93 8778.81 10332.73 8710.78 9792.30 LPC 18:3 2571.55 2264.73 2071.53 3450.64 2321.16 1920.57 12376.01 8038.25 2542.62 1484.81 1851.79 1583.69 2243.99 4871.60 1277.47 2686.99 1517.18 2830.29 4526.05 2144.33 3179.82 5193.55 2598.97 10377.18 2434.34 2378.67 2708.65 10787.77 2028.83 864.90 1056.94 1204.75 857.95 901.55 795.64 744.80 1194.61 957.09 830.44 1236.16 32280.37 1031.27 1153.48 955.87 805.31 1116.16 913.13 1120.90 1231.41 833.91 1125.48 941.99 1086.26 856.19 872.45 1049.04 LPC 20:0-SN1 116.94 187.66 125.52 511.59 215.89 183.16 2245.05 859.75 269.17 130.33 163.28 136.80 125.46 492.89 107.93 240.90 162.23 427.20 491.64 158.87 446.15 719.51 273.28 1807.77 143.26 102.02 194.81 1547.56 159.97 104.21 164.31 151.08 105.67 106.63 87.86 149.07 159.37 115.05 81.92 252.95 6123.97 153.21 143.23 153.09 138.79 93.97 114.62 137.41 105.41 105.04 122.56 128.01 143.04 98.54 122.54 116.72 LPC 38:6 10492.00 11173.91 8563.31 8115.64 10492.55 10561.41 8034.61 9128.88 10539.29 12441.76 9897.57 9099.74 9407.53 10302.20 10719.15 7849.87 6964.63 9402.30 9694.81 10240.09 7921.22 10102.43 7409.40 9458.94 8305.16 9768.86 10091.28 8350.11 11050.15 13721.55 20961.07 16184.45 18624.17 21818.61 18580.86 23739.86 17691.11 17901.15 16186.84 15223.31 11890.48 18868.60 14590.01 15329.72 18346.15 12936.35 14210.92 16088.54 17736.01 17614.82 17875.18 14512.70 19661.80 14271.62 18118.00 16523.03 LPE 18:0 373.54 613.47 302.43 2989.80 1357.03 1008.58 16403.12 7206.81 1355.05 390.06 488.03 308.03 391.42 3375.28 401.48 1604.36 740.58 2842.55 3308.36 689.45 2201.87 4043.41 1635.29 11526.81 495.64 442.53 910.74 12412.64 763.44 311.68 343.58 311.76 408.27 294.64 255.61 304.70 351.56 381.19 310.33 1218.80 30444.83 428.10 449.74 518.93 292.93 294.65 332.89 293.74 354.22 248.74 386.47 380.99 337.40 350.11 291.65 299.49 LPE 38:6 9136.42 9721.23 8642.18 8541.77 9166.01 8586.78 8035.99 7945.99 9718.54 9891.90 9260.09 8013.39 8019.60 7884.15 7470.09 8917.48 7217.64 8938.34 7357.81 9487.31 8828.85 8644.61 8324.79 8426.09 8813.30 9224.16 8475.49 7443.72 8781.85 10389.08 14446.58 13598.27 15464.66 14092.04 12744.50 16181.49 14467.64 14617.64 13012.86 10390.78 8687.77 13065.96 11468.72 12151.86 11518.76 10279.94 10170.41 12429.35 13815.82 11601.14 13117.37 12088.52 13017.79 11694.02 13818.83 12838.36 Oleanoic Acid 3172.22 3058.01 3109.02 3076.75 3319.53 3182.30 3877.42 2717.45 3057.14 3012.86 2957.94 3076.76 2843.98 2983.85 3363.98 2964.91 2526.51 2999.21 2497.21 2872.04 2528.35 2806.88 2890.27 2544.03 2840.00 2788.35 3029.69 2546.49 2892.48 3578.39 3892.62 4411.84 4314.64 3954.51 3736.19 4214.26 4269.27 3779.98 3924.94 3569.51 4971.86 4279.57 4413.80 4172.92 3592.70 3676.10 3813.75 3758.14 3896.74 3467.99 4135.78 3521.42 3981.44 3684.03 3513.25 3932.90 1-Oleoyl-rac-glycerol 2526.99 1846.94 1416.61 1562.99 2159.62 1991.74 1613.29 1563.41 1871.69 1486.73 1880.53 1907.20 1708.80 1534.78 1323.24 1457.25 1310.22 2014.49 1384.19 1880.44 2042.02 1635.03 1284.29 2192.90 1724.10 1986.74 2168.46 1715.44 1896.95 3515.69 4207.63 4876.99 2662.97 3748.57 3802.51 8915.83 8889.22 4154.47 4044.48 3260.33 4370.42 5750.68 4791.78 4018.89 3549.01 5155.02 3972.38 4387.35 5030.67 3712.37 3573.93 3322.21 4352.30 2989.41 5568.95 7117.18 PC 14:0_16:0 20644.33 18772.86 20630.38 19573.78 18245.79 17560.31 19539.05 16804.04 19277.16 18239.64 17115.25 17120.25 15792.13 17183.07 19790.28 15944.04 15842.48 20278.70 15486.59 18584.08 20901.86 16665.74 16779.17 15881.06 19679.44 18631.76 17434.20 15703.05 18480.48 14660.54 18885.68 20836.37 20041.07 18394.62 18007.12 21475.29 23386.67 16904.89 19536.63 15785.56 16007.36 18929.63 19867.65 17519.91 16962.68 14764.71 16866.40 16454.64 16660.51 15541.17 17362.36 20230.78 14989.35 14959.71 18213.92 19524.04 PC 16:0_16:0 74173.27 65276.85 79532.88 79886.24 75955.84 73462.28 85454.43 70491.20 76796.01 74246.45 80889.33 76505.09 67068.58 67985.23 68230.19 74503.71 66785.31 73943.61 64583.23 74525.05 62965.74 67639.55 78234.88 70213.35 86570.98 75090.36 70503.87 69487.51 75496.21 58347.38 81354.07 92834.81 89534.83 88175.25 74364.49 91016.34 86709.78 91803.84 84300.91 76829.56 60072.87 91989.26 94364.05 86118.83 81680.33 75060.47 78113.59 82256.53 83178.73 78393.47 81259.95 87670.12 77077.07 84213.82 89030.08 86277.95 PC 18:3_18:3 104583.66 91605.83 73562.36 94603.65 91316.30 80784.37 64722.71 84559.21 95217.69 86938.10 87540.76 89780.35 78442.26 78928.71 68147.38 76552.05 52218.59 62367.24 82975.18 83010.73 52798.71 78359.99 81491.19 67123.83 71347.35 74690.06 93132.15 52275.31 88264.59 54685.15 65877.08 70639.91 58802.90 72100.77 63866.64 65277.90 60661.78 66105.86 56759.26 49554.73 27635.20 70032.51 79895.45 64118.58 76873.96 65437.88 57344.70 78173.15 75788.58 61087.46 55745.84 67122.98 62348.74 71620.37 73777.67 63775.23 PC 30:1 21223.91 15624.65 16364.64 22862.48 17007.54 16080.07 14664.08 17213.96 14092.84 15729.16 17733.12 10012.01 12785.53 17716.26 13211.44 8865.13 15789.50 19419.82 11115.42 13725.58 16179.24 14653.51 14249.94 11638.44 19867.61 14306.82 15307.18 14563.78 18629.59 9221.68 11509.05 17415.53 12181.50 12133.77 18085.92 16191.53 15414.48 14231.34 12067.51 13834.27 13707.63 15982.38 15041.06 16836.01 12637.88 11983.61 15583.69 11225.96 12186.40 15710.98 17186.11 13478.10 12445.83 9856.85 13944.58 13176.68 PC 32:1 304624.49 255395.76 295485.44 336983.50 299068.15 281477.42 271062.19 308296.35 354734.68 245427.42 290365.31 217155.33 261060.25 278866.66 227439.05 144119.03 229051.66 229950.38 180641.18 201629.02 221966.73 227573.22 284364.56 185143.31 273667.29 283057.62 216983.67 193082.25 270799.35 122183.09 181803.46 245603.30 181892.79 187205.77 195907.15 195402.02 221279.19 186329.53 147250.37 183547.50 167136.13 256164.95 181644.75 178881.97 176703.17 187796.99 207208.29 176503.97 198668.49 188539.43 238814.90 192543.30 159287.68 187427.26 182854.47 156442.74 PC 32:2 85703.80 74845.73 92748.89 135759.84 80423.02 92567.02 84659.86 114447.97 119875.14 70482.32 115107.76 64656.94 78892.51 79644.51 43554.05 54018.57 110060.26 84314.51 48773.72 84242.70 123598.15 99029.37 148793.75 69715.45 97216.19 150891.41 78551.54 64418.94 102699.25 34223.04 30933.60 57348.02 48899.33 48102.08 41509.00 48296.46 41574.97 37025.70 36181.04 53607.40 40170.98 62182.67 40902.05 74888.71 37073.52 36350.06 45648.40 44387.43 46405.23 52537.98 84400.50 41832.46 49327.42 48477.65 36313.77 36776.22 PC 32:3 16957.67 15347.96 13568.40 16486.13 15206.80 12808.69 12231.67 15289.93 16147.82 14919.41 14425.01 12975.44 12543.70 13864.22 13892.32 13230.90 12850.44 14233.34 13032.17 15584.72 14679.33 13783.10 13665.92 11829.33 14647.99 16235.59 15396.52 10139.60 14418.93 9315.92 11259.58 11935.81 11654.20 11219.72 10833.27 12316.57 12043.71 11294.33 11421.69 9624.50 7779.60 11553.05 12601.34 12235.82 11416.66 10120.04 9671.83 11316.04 11068.61 9833.87 10738.86 11549.76 10355.61 10242.83 11915.71 11199.11 PC 34:2 55728.56 49080.53 52859.43 61145.26 53978.80 50788.39 38853.65 50065.29 66428.62 46971.19 58425.08 40848.29 48116.08 46016.15 45814.99 35450.76 46410.40 52945.00 33926.03 41869.91 51777.45 45459.94 52838.88 36138.52 50788.61 60981.71 40370.32 30647.43 51752.62 28833.36 33555.47 47349.71 40735.79 39760.52 36769.48 43711.97 43057.53 39571.04 33234.12 31197.49 22893.36 52196.26 38639.70 48815.68 36791.34 35309.04 37541.18 37212.14 39896.35 39412.58 54331.08 34851.74 37411.99 36191.50 34901.28 32936.28 PC 34:3 18718.25 18601.02 17814.12 20134.53 18969.23 16471.91 13251.17 16954.47 21858.76 18324.80 19665.92 18058.20 15794.79 15947.87 15135.69 18566.74 13561.63 16399.36 17482.06 17646.77 14373.35 16759.75 21531.97 14001.92 16422.90 18295.37 17910.90 13163.51 17399.99 13072.05 15811.88 16262.94 17300.20 17848.00 14095.30 18374.89 15811.52 14933.85 14879.86 11776.58 7044.37 19019.85 17967.11 18126.02 14392.08 14130.43 14101.85 18391.58 16852.05 13533.55 16027.55 15309.77 13753.88 16460.51 17256.94 15843.29 PC 34:4 30420.55 24436.21 24814.66 32946.11 26406.52 20000.00 13847.91 31542.93 28582.08 23486.66 32064.31 20668.67 22856.09 26036.22 22108.25 29945.38 21830.46 24813.31 21522.32 24665.15 21443.66 26248.50 41524.15 19086.15 23712.39 32589.92 28571.36 18543.77 29063.05 13476.95 15660.20 17677.23 17416.91 17538.56 14610.63 20944.75 17456.22 14562.12 16816.24 15859.82 12554.51 18757.81 16171.40 15297.98 15100.91 13283.20 14334.89 15012.45 14768.44 14696.92 17919.51 16075.96 14419.73 14630.11 15666.71 15640.45 PC 36:2 1665298.76 1775257.85 1568564.32 1558892.92 1684071.45 1597570.11 1249366.82 1463910.38 1727718.14 1721359.47 1563450.75 1584319.35 1568445.81 1435221.83 1822455.51 1509566.31 1363166.02 1709578.29 1491047.81 1559895.51 1480940.30 1596888.38 1381315.00 1413506.30 1542347.51 1498861.13 1510639.61 1392980.28 1547706.64 1861662.98 1896748.42 2067637.82 1999714.06 2010352.73 1854635.24 2096937.13 2018664.60 1708965.88 1934631.57 1714743.50 1328846.36 2155263.06 1999134.36 1767326.12 2033661.99 1832037.67 1897061.71 1877339.33 1965340.21 1860368.07 1919405.70 1914076.60 1901558.05 1903646.11 1943173.67 1936385.25 PC 36:4 292839.85 284639.03 252767.79 271758.04 301180.34 247243.10 154835.17 270537.96 333286.11 273307.64 276771.43 248749.05 259454.37 267669.34 279176.13 273442.78 189933.51 239594.90 273629.64 237450.15 169063.97 264996.20 270880.90 213821.63 210941.56 252892.21 272446.35 197800.84 280427.80 195194.09 211993.15 212683.01 212992.20 238337.72 200220.24 223469.81 219354.86 216463.05 202956.00 161130.35 99749.02 238398.16 244001.27 201873.66 219950.46 195309.48 184991.00 233316.40 225180.79 200395.73 195333.32 208411.80 205256.95 230557.27 219974.53 199446.18 PC 38:2 89142.13 92812.18 85190.75 89489.03 89925.95 74936.42 52568.66 75885.19 115100.57 90566.46 101889.86 83631.34 87214.07 75975.38 97778.76 79082.29 63635.83 87536.16 73697.93 83501.71 72463.89 86246.20 77649.66 81093.80 77076.69 69904.49 76835.61 62035.78 78250.26 69776.29 78142.33 88051.16 87613.93 79005.39 78626.81 88837.57 78906.50 101554.08 80551.04 60484.20 61096.92 111426.08 75559.41 79278.50 103675.22 71292.20 88893.98 65093.00 76629.43 77666.28 83691.44 84432.39 77767.84 71058.90 85803.58 73333.21 PC 40:6_40:11 6966.85 6870.34 5970.28 6431.10 6124.14 5464.92 4552.39 4795.27 7384.70 5611.83 5617.06 5624.45 5688.27 5060.65 6345.98 4947.98 5133.37 5785.26 5522.62 6205.90 6033.83 5205.39 6474.50 4500.72 6266.33 7003.23 5657.02 4311.13 5647.11 4286.03 6177.94 6618.63 5615.34 4923.82 5118.69 6520.66 5591.67 6133.43 5014.78 4465.26 1983.10 5609.73 6200.83 6127.71 5808.94 4479.93 5095.99 4607.74 5582.38 5357.50 6406.28 5577.93 5642.21 5424.14 4827.03 5785.93 PC 42:6_40:11 2120.90 1443.09 1431.17 1659.14 1491.37 1005.56 696.81 1089.55 1809.36 1167.99 1465.73 1209.18 1316.66 1060.86 1220.36 1208.27 995.47 1125.67 1220.68 1358.55 1097.13 959.42 1579.93 870.94 1274.65 1260.53 1522.36 888.12 1069.93 642.09 904.20 1235.76 855.21 776.19 733.51 1006.05 849.16 945.40 849.75 617.18 335.19 1020.17 928.05 889.72 891.29 669.38 734.50 758.32 766.62 798.82 898.20 772.94 828.12 748.37 722.66 786.97 PC O-30:0 3312.47 3971.32 3821.07 3336.07 3660.76 4221.13 3519.24 3407.70 3664.81 4031.18 3412.99 2887.70 2702.85 3343.52 3331.33 2700.15 3060.78 4372.18 2945.68 3785.35 3750.72 3349.02 2422.73 2992.41 3281.70 3372.94 3036.12 3419.32 3606.60 3623.10 4351.03 3545.28 4366.31 3522.55 3777.54 5078.07 5218.83 3847.27 4232.21 3075.72 3787.12 4192.29 3887.45 3651.33 4165.94 2479.17 2999.86 3231.59 3356.12 3772.45 3918.91 3632.73 3646.90 2726.75 3998.86 3884.73 PE 16:0_16:1 10603.50 8720.19 11982.68 16680.68 10448.44 11816.48 7710.25 11167.47 14664.42 8692.13 11440.05 8866.97 8684.79 9507.70 6016.89 7118.10 8893.63 8132.78 6985.18 7323.24 8689.89 8060.48 13037.54 6191.70 9969.84 12887.93 7315.20 5699.65 11336.31 3434.74 5029.16 6973.16 5168.53 4573.60 5262.53 5516.30 5765.76 4551.68 4243.61 4547.88 2714.76 7293.03 4928.59 4823.17 4618.90 4792.17 4750.35 5073.74 7107.41 5761.05 7968.44 4964.72 3808.43 4101.60 3620.25 3683.11 PE 16:0_18:1 63263.74 57828.98 64085.49 73587.10 61308.21 60827.60 34005.03 57710.81 74445.22 60375.90 60103.25 57973.70 53636.17 54973.83 48509.54 52420.85 54187.81 58410.43 45096.48 52637.68 57402.58 51091.19 70940.63 46183.29 62046.20 62565.25 49958.10 43895.39 61666.27 48343.45 60391.98 61857.74 64696.75 59526.24 58020.16 67358.76 62115.32 59232.37 52442.54 49215.88 28219.33 58626.33 54582.47 40780.12 50718.74 48374.09 50100.13 53070.37 58915.36 50552.85 65584.34 50858.99 47027.62 46509.55 50892.28 48218.09 PE 16:1_18:1 25900.06 22561.02 26618.05 28808.39 25081.47 24893.21 26107.13 21350.29 26871.66 21825.87 24751.25 19431.35 18478.15 19304.56 21096.26 20693.03 24182.68 24173.79 19120.65 23605.12 25899.43 20672.80 24156.09 17060.43 27094.30 27084.00 20600.71 18805.00 25719.37 17548.02 18718.90 23794.07 23645.94 18080.57 19889.82 25890.22 24242.68 20787.88 19126.66 17083.08 13696.95 29136.68 23087.39 26283.39 21697.95 18933.25 21278.47 21615.84 22043.35 20435.02 27887.82 19901.23 20069.81 18216.71 21568.47 20509.38 PE 17:2_17:2 217.05 139.13 155.65 201.41 155.11 93.59 68.14 198.43 224.43 129.22 236.93 128.11 121.15 100.09 122.00 218.17 145.26 129.86 85.01 155.34 119.79 134.98 278.89 84.99 139.50 184.57 146.89 110.51 173.98 72.64 76.68 105.52 121.31 85.45 61.65 110.23 97.72 53.31 89.77 90.34 30.06 75.90 86.17 88.64 59.11 77.73 71.46 90.63 90.23 85.37 93.96 84.68 46.99 63.42 101.05 84.14 PE 18:0_19:1 775233.98 669817.85 762785.00 755940.30 746175.12 702988.29 615227.76 689694.01 864308.49 716864.30 707404.71 703629.74 696296.89 644855.02 712639.22 530575.54 503638.94 699192.21 606403.56 571291.29 613732.08 650377.08 643747.15 549090.66 690568.38 673342.63 609265.39 538595.71 727547.54 493912.87 667186.24 801526.50 675556.71 751944.24 689376.71 771608.47 746335.03 721206.21 647352.22 551231.53 416722.70 824471.14 708019.44 610980.81 674945.32 621453.38 662976.07 666399.01 698933.80 631395.26 717647.14 678660.82 587592.98 646320.84 640985.49 619712.89 PE 18:1_18:1 251118.24 253909.47 231102.66 225002.13 244007.18 213425.92 119327.88 186327.03 253685.40 236671.68 211765.03 209445.74 188343.57 185434.17 248612.91 209272.82 176486.88 230603.11 199702.35 208593.22 197928.64 200094.70 189724.84 163953.03 235629.82 203148.52 191856.90 165064.66 226111.42 230111.43 250632.17 285312.10 263675.01 239682.74 250764.01 307569.47 268624.31 289443.53 239574.25 195439.06 89169.65 303441.34 261047.79 206213.74 245741.46 213452.87 246635.35 213451.28 279105.64 244630.68 271370.60 254066.86 229900.63 229072.27 233216.02 240238.25 PE 18:3_18:3 10572.51 11272.63 9713.57 11221.97 10900.18 6823.23 7235.25 8953.92 9483.37 11042.04 10679.39 10422.62 8237.57 8519.81 8637.59 10322.59 8085.78 9258.25 9739.91 9491.60 9567.42 8233.27 10481.31 7405.90 10948.06 9201.21 9816.40 7091.70 8846.00 8814.56 10296.38 11651.86 11203.53 9397.52 8923.56 12290.29 10120.03 10675.27 10674.80 7629.08 2060.12 10664.50 12440.63 11421.12 9558.54 10089.40 8780.28 11732.69 11667.60 8120.66 9969.10 10586.09 9008.38 10087.66 11568.91 10843.10 PE O-15:0_19:1 16666.71 17867.81 17983.26 17081.21 16235.91 18258.74 14112.58 13354.23 16614.24 16349.60 15081.16 13094.39 12439.15 12187.94 13765.18 14674.81 13654.28 16734.13 11900.38 15000.78 16760.31 14731.87 16277.82 13162.86 16722.17 14676.55 12911.09 14630.11 17208.08 18323.21 19397.00 19788.08 22365.54 14614.25 18354.25 22687.38 20844.33 21425.87 21102.06 16204.93 13168.85 21975.21 18377.00 18168.74 18874.78 14076.09 17133.91 17223.31 19897.52 22326.94 22885.24 17272.87 19503.74 15263.93 20098.00 19882.83 PE O-15:0_21:1 36857.00 45610.25 39698.34 37422.77 43904.51 42946.48 26641.88 29599.53 44240.06 41220.01 37941.61 34819.50 34220.36 30547.85 40217.72 44403.27 28437.17 46405.92 33922.33 37293.25 44752.88 36508.49 33926.76 36397.19 32259.39 37896.86 33517.50 37518.18 40694.21 49102.00 68140.00 58633.52 63907.38 56353.58 55137.37 61331.97 71479.35 68930.18 62875.53 49765.17 36074.26 63481.25 65264.82 55394.70 58675.69 47815.95 52170.28 61869.74 55511.59 54474.91 71305.60 49506.88 61726.55 46509.74 58209.19 54637.56 PE O-18:4_18:3 2515.10 2596.10 2326.66 2407.48 2660.73 2359.68 1122.33 1825.53 2767.24 2479.70 2769.53 1878.58 2369.70 2211.89 2058.75 2297.07 1775.24 2391.51 2070.98 1125.06 1306.89 2151.97 2345.29 1728.59 2494.80 2312.28 2450.42 1861.98 2574.83 2188.81 2183.91 2211.38 3506.32 2983.30 934.06 3824.76 3068.10 2901.74 2975.12 1759.64 982.94 2980.39 3292.23 1998.56 2250.21 2126.51 2194.56 2793.54 2670.76 2361.39 2621.58 2562.07 2754.21 2271.13 2506.26 3173.26 PE O-19:1_20:1 4658.83 7648.95 10648.83 7683.65 7780.79 8323.02 6926.51 5094.62 8550.77 8107.51 9335.61 6515.83 8646.76 6963.44 11317.14 7796.84 6592.89 12173.32 5903.59 9035.45 3730.56 6713.94 11249.56 5537.14 5907.66 7168.61 9206.39 7027.96 7184.13 5713.34 9456.81 8259.14 11975.02 8434.08 7935.89 7026.30 12029.47 9585.71 13539.94 7400.77 4257.75 12581.65 12955.57 11359.43 12535.73 10087.85 8767.52 12998.15 6979.00 7330.38 9744.20 11102.13 10981.07 9048.30 9961.57 10973.49 PE O-28:4_7:0 870.46 879.30 792.84 922.56 804.86 675.89 561.84 859.14 787.02 783.75 885.07 726.58 649.57 661.23 563.34 1169.14 577.63 860.28 813.35 763.38 501.96 859.27 741.15 637.89 718.69 841.48 817.53 694.09 899.04 506.36 364.14 387.07 497.86 440.89 406.71 581.26 506.70 411.12 575.71 415.37 221.72 461.92 667.80 532.27 456.95 374.83 433.54 594.18 464.57 442.27 385.50 502.32 412.63 436.64 446.70 556.98 PEtOH 16:1_16:1 1028.74 830.47 1264.97 1428.87 614.40 1403.57 5479.81 900.86 599.48 1116.04 1026.29 858.11 594.28 623.22 710.48 937.53 1038.34 2279.27 630.91 1643.45 2036.65 1140.41 589.84 835.16 1458.49 1324.94 761.79 1938.27 1421.34 745.12 301.87 906.59 392.45 488.47 822.08 784.52 727.35 525.84 1050.39 554.44 725.48 1227.67 813.43 1296.24 923.05 595.25 802.01 889.66 927.22 1112.02 1404.30 919.18 848.09 672.96 519.47 623.14 PI 32:1 1820.50 1773.19 2063.89 2670.66 1796.35 2419.38 1894.12 2008.76 2280.97 1719.34 1808.21 1984.04 1679.55 1782.06 1368.75 816.87 1473.12 1370.49 1220.26 1261.16 1946.26 1629.52 1702.37 1547.71 2370.87 1867.81 1218.36 1479.75 2478.94 1097.61 1582.64 2372.16 1849.87 1246.34 1890.57 1691.47 1764.08 1594.69 1646.82 2012.23 1492.46 1697.72 1420.60 1340.41 1331.69 1518.45 1623.51 1830.15 2202.54 1417.16 2316.89 1735.19 1308.69 1395.89 1234.36 1367.83 PI 34:1 520.52 630.68 561.40 519.99 620.53 671.89 512.92 556.34 631.07 611.83 648.90 546.52 592.80 620.18 565.39 499.63 412.49 595.98 541.38 458.17 592.73 624.64 583.61 543.34 545.79 437.08 539.06 417.63 573.28 3841.78 11942.50 5558.88 8077.19 1550.82 9347.39 22106.23 20591.32 4897.48 2779.21 1724.31 1222.13 2677.79 11756.29 20994.24 836.53 15579.23 1037.74 17753.20 14545.54 936.49 29049.77 861.40 16117.81 953.55 3512.39 15884.11 PI 34:2 1475.40 1812.91 1699.17 1782.87 1511.25 1938.53 2181.74 1566.80 1824.78 1761.84 1720.37 1886.24 1629.38 1209.89 1724.20 969.97 1916.63 1862.73 934.52 1836.76 2266.61 1804.80 1573.96 1918.74 2846.42 1669.22 1445.12 1587.50 1715.74 2024.34 1588.57 3373.88 3207.61 2397.82 2320.89 1893.17 1183.26 2948.30 3601.50 2843.47 2416.44 2790.03 1944.47 1959.52 2288.70 1166.97 2385.26 1518.50 1773.78 2344.61 2007.82 2768.45 1457.86 2492.27 2751.58 1377.83 PI 34:3 3032.09 2474.91 3245.22 3606.15 2798.32 2326.83 1820.32 2902.69 3064.68 2619.21 3013.95 2439.34 2468.58 2664.33 2612.05 2836.00 2073.30 2346.61 2077.16 2496.79 1612.11 2810.59 3404.18 2215.10 2429.10 2771.36 2742.83 2216.02 2675.25 1549.69 2737.25 2128.12 2151.48 1555.60 2131.57 2967.68 3777.64 1859.52 1746.82 1468.64 1009.34 1448.70 2338.71 2798.53 1544.01 2674.05 1312.76 2941.91 3132.16 1455.34 3304.56 1630.78 2771.84 1587.95 1643.71 2905.22 PI 36:2 4199.24 5699.12 4834.01 4512.02 5148.30 5152.56 4859.10 4627.86 5159.05 5331.40 4646.75 4429.90 4245.93 4151.19 4920.46 4391.37 4607.44 6012.67 4354.38 4816.62 4646.49 4993.72 3441.78 4865.87 6094.23 4517.82 4119.67 5045.79 4709.60 4776.82 3211.48 5931.78 4395.86 7042.18 3999.18 3109.01 2941.53 5948.25 7651.02 6890.20 7993.81 7822.72 3397.16 3130.07 9250.11 2654.79 8062.56 2939.82 2819.60 6100.70 3027.36 9058.74 2679.30 6267.41 4876.01 2409.15 PI 36:3 21383.83 20454.45 20449.47 23406.61 26245.53 19699.51 12434.37 21748.83 24517.76 20132.90 26572.98 20167.44 20946.60 19093.66 23661.16 24366.79 17791.02 18522.00 18825.76 21375.67 11404.36 20747.72 26088.78 16675.08 16000.70 22866.50 20784.84 16495.85 21294.81 35621.79 25723.09 37606.78 27734.98 29858.65 25747.13 26926.83 25947.05 41169.76 38570.07 21114.20 20871.41 34793.55 31675.36 24939.71 22541.45 21171.71 22529.27 27025.95 28110.52 30019.25 23471.67 28782.53 22443.01 26279.71 30252.39 21996.14 PI 36:4 4406.45 4989.75 4692.41 4759.17 4778.11 3959.86 3806.73 4137.58 3681.60 4722.37 5144.59 4552.61 4377.72 3929.13 5098.28 4275.96 3908.28 4571.55 4170.83 4778.49 3370.84 4783.68 4598.59 4236.51 5154.13 4561.26 4430.19 4355.94 4834.90 3713.34 4894.63 4426.78 4484.73 3591.20 4461.74 4702.56 5055.07 4622.02 4978.30 3704.81 2899.21 3739.16 5184.19 4578.84 3300.45 4171.99 3507.50 4762.02 5112.55 3865.53 3979.77 4241.32 4870.32 3876.66 3402.09 4669.37 PI 36:6 2859.84 2587.00 2686.69 2510.44 2627.29 2427.77 2871.03 2242.17 2783.01 2643.80 2641.02 2488.95 2781.22 2242.07 2187.44 2301.51 2146.41 1979.15 2464.79 2622.84 2142.31 2553.69 2805.50 2296.54 2725.39 2459.46 2370.47 2372.87 2696.12 2437.89 2705.62 2744.15 2513.30 2491.21 2574.16 2451.52 2481.16 2941.85 2802.96 2323.07 1862.63 2354.30 2873.53 2815.29 2086.80 2596.31 2232.55 3024.43 2876.42 2420.64 2566.99 2790.39 2580.76 2652.34 2868.01 2828.66 PS 18:1_18:1 6650.08 6534.57 5927.79 5513.37 7151.18 5569.18 3241.77 4337.97 6649.73 6248.35 5918.30 5314.28 5014.27 4769.55 5431.04 6975.70 5107.50 6723.39 4548.12 5460.09 5054.76 5004.97 4990.57 5369.86 6045.43 5249.70 4251.61 4998.39 5634.21 7271.15 4386.17 7617.50 7739.67 8555.22 5514.59 2935.96 3157.33 8157.86 9678.61 7166.07 5699.94 8633.31 5517.20 2547.44 9286.12 1588.00 7937.87 2908.24 3228.75 9004.84 2996.32 6758.05 3050.16 5886.05 7854.05 2356.23 PS 18:1_18:2 6130.15 5661.29 5223.51 5111.56 6396.09 4961.79 2932.65 4272.08 6249.44 5318.40 5824.57 4841.53 4586.24 4720.64 4368.75 6005.24 3949.67 5078.57 4633.10 4896.29 3772.66 4682.27 5443.05 4592.29 4992.68 4847.35 4494.87 4327.21 5407.69 7779.68 23136.78 11490.27 20671.28 6489.72 15530.35 21866.65 23107.12 10164.97 8141.90 5240.54 3755.29 7329.74 25578.28 22783.94 6255.51 14467.10 6064.63 25895.07 24349.24 6707.61 23093.06 5306.04 24014.45 4761.58 9059.40 17870.25 PS 18:2_18:2 2731.92 3051.38 2662.21 2632.57 2859.84 2378.11 1568.11 2308.01 3079.67 2854.73 2955.96 2474.33 2560.35 2230.99 1897.51 3104.80 2167.68 2641.97 2166.56 2583.42 2055.37 2464.30 2541.52 2253.42 2809.76 2491.59 2367.75 2413.49 2813.60 2647.01 3353.87 3114.25 3500.97 2582.20 2773.08 3134.63 3131.18 3066.99 3470.75 2539.95 1631.62 2762.60 3332.90 3034.29 2597.83 2212.87 2451.90 3172.76 3245.23 2950.92 2876.84 2535.55 3314.80 2277.33 2836.28 2797.28 SE 28:2/15:2 898.62 1298.25 971.86 702.92 2223.21 1199.85 6428.19 661.84 622.96 890.38 516.90 579.78 1111.80 1336.16 2848.56 6898.47 951.06 900.58 687.74 659.70 425.26 1840.60 1459.87 594.66 620.84 862.45 1006.08 909.66 1402.91 8783.80 2198.20 5646.02 7249.65 3660.84 1769.87 3610.89 3260.39 4162.83 5465.92 4380.99 6624.72 2491.87 6367.89 6050.82 4056.54 2528.88 4693.42 6831.83 4326.82 2302.03 4964.90 2573.15 3110.16 5135.24 2187.03 3442.32 SE 28:2/16:1 23268.77 29009.96 20419.81 11183.77 49009.75 20363.92 161378.12 11316.76 9454.96 14197.98 9489.69 10849.44 14237.98 17778.70 64680.41 64964.25 14037.23 30116.44 8469.29 9931.17 6700.82 19282.72 24238.03 10373.29 17199.49 17844.91 25814.56 12855.86 15254.45 93431.90 42913.73 70396.73 60924.36 80305.91 50142.20 47921.29 44527.82 72645.26 99838.69 83449.82 101566.93 77077.79 104551.18 88773.39 37153.40 42262.34 85885.02 68848.52 53361.30 30009.15 68973.60 50566.90 36816.62 107930.36 30478.78 38032.23 SE 28:2/18:1 99029.10 121199.28 66310.43 46281.26 159917.88 77593.33 319026.94 50042.48 31976.40 67139.04 42826.07 64428.89 53075.49 67128.09 209159.94 122180.45 58489.37 102738.72 30666.71 49123.06 26842.20 80327.22 68840.54 32720.12 66595.01 45910.84 85554.25 40810.40 54302.87 221269.88 167452.92 151450.21 187899.74 244180.68 187034.50 104841.36 81427.97 293307.18 211794.03 163318.16 253073.78 280666.11 291418.88 217843.86 193660.00 138789.73 250241.05 216466.82 176285.08 151515.35 166690.53 201976.52 155448.93 317662.96 107158.82 140853.54 SE 28:2/18:2 12407.49 12114.86 7138.08 8959.49 14858.98 8744.43 30885.36 6450.69 3546.10 9389.48 6471.25 10811.81 4702.16 7557.59 19231.58 15586.48 6273.86 11002.87 4280.82 6388.36 2793.89 10865.62 11873.14 5090.23 9012.61 5857.65 11215.75 6080.76 5412.51 32215.49 22011.23 24607.08 24131.35 28864.55 20642.63 17774.64 16583.16 39159.22 31411.52 19569.80 29667.32 35389.35 41395.17 43138.10 17580.75 25943.42 33499.35 31778.42 24140.59 13474.58 24641.14 23896.00 20970.46 41660.48 15582.36 19216.26 SE 28:2/18:3 12556.14 6516.20 6488.71 13496.44 5773.96 5909.13 8839.79 5546.84 3149.76 8536.74 6788.29 14021.75 3049.80 7637.05 7320.38 12872.02 5009.55 7299.77 2850.00 8021.19 1452.58 10522.12 19687.08 7358.59 9069.08 4829.94 11852.13 5946.15 3786.37 15579.03 4538.40 6775.86 6430.26 6924.59 6413.43 4905.30 4156.15 5394.02 7685.88 8378.74 6686.89 7240.90 11868.88 16673.29 8439.40 16273.17 10714.23 12503.38 7092.72 5463.83 9932.57 9631.05 6836.56 16961.45 7898.24 9182.19 SE 28:2/20:3 5393.30 8195.12 6427.98 3994.54 14194.10 7766.56 25244.45 4680.00 5385.71 5126.00 3779.44 4540.42 5764.49 6785.72 19771.64 23330.54 5479.19 6579.36 2969.41 4447.87 2278.24 12958.63 8774.89 4065.88 5249.57 4048.66 5222.24 4777.63 7155.06 37315.72 11110.39 24163.69 21884.95 27353.50 9045.51 13156.01 7516.52 25685.44 17344.18 16888.78 28001.17 19777.45 41000.77 27228.11 14383.91 10542.17 22875.85 24733.38 19557.82 10502.00 18580.28 15963.74 17132.26 29626.92 8286.99 14287.84 SE 29:2/16:1 31948.96 49896.89 26836.12 11767.28 82675.88 36033.35 126834.46 15664.18 13665.32 21757.29 9167.36 9463.90 26960.19 24744.52 92880.87 107325.29 21645.98 57642.86 15458.03 13109.58 6266.97 27994.02 36014.62 8502.31 26393.04 23838.26 31095.05 14940.21 24608.81 54368.36 38356.03 34187.31 47062.51 59875.41 42543.31 29810.25 24017.61 63796.90 48087.95 39550.06 52036.40 55813.61 56114.77 42309.38 34873.46 27963.33 48123.18 48095.05 32836.52 23785.96 33668.85 36853.39 27691.08 54695.39 20951.35 25943.49 SM 14:1;2O/17:0 4973.38 5290.42 5510.16 5161.50 5538.24 4940.66 3670.37 5004.79 5338.99 4664.52 5412.26 4565.27 4341.04 4386.96 5106.99 4930.26 3951.28 4155.14 4669.15 4875.47 4125.22 4915.28 4686.90 4620.13 4884.90 3840.59 4293.16 4802.63 5305.98 5002.36 6569.25 7055.28 7125.90 5558.91 6731.53 6872.59 7952.32 6816.20 6039.03 5305.42 4399.01 7326.68 5924.28 5960.98 4964.86 6250.41 4486.56 5557.77 6505.91 4901.89 5663.85 6213.02 4767.23 5183.82 5992.46 6570.32 SM 14:1;2O/18:0 3678.20 3557.87 3534.95 3628.23 3690.21 3054.68 7392.61 3640.11 3462.67 3258.99 3243.25 3672.68 3105.07 3074.83 3446.71 3716.42 3029.89 4446.94 3041.94 3540.61 4924.84 3104.43 3358.35 3275.93 3937.89 3551.70 3353.82 3384.15 3269.80 2898.42 3007.47 3248.56 3096.44 3494.41 2991.64 3808.69 3685.19 3472.86 3504.30 2838.83 4545.98 3552.73 4024.90 4153.68 4489.15 3285.99 4209.41 3364.28 3271.63 3221.40 4506.48 3385.56 3268.91 2810.31 3022.80 3294.09 SM 14:1;2O/20:0 136553.15 135197.26 127659.24 134266.01 130423.00 126955.21 144331.43 117981.49 144306.02 128730.93 130846.76 126571.91 117984.02 112732.97 132680.03 129813.10 100251.34 140120.72 119393.88 125241.84 133925.87 124054.79 137187.36 129274.76 131526.23 130816.47 128029.94 122139.66 131188.65 118915.74 126830.89 135566.75 134331.83 148651.48 129916.14 151528.09 140751.06 133185.74 136879.21 112316.26 142376.13 149670.35 139242.20 139329.31 143575.70 114876.48 135774.26 129170.14 130745.89 122417.80 137488.06 132599.50 127514.00 122744.72 131534.40 127704.37 SM 34:0;2O 10741.40 9964.23 11384.86 10974.07 9483.31 10095.06 20326.75 9762.68 11235.27 9046.61 10834.52 10690.40 8571.88 8969.27 9969.87 13067.49 9605.17 15131.36 6654.14 11812.34 15336.21 9144.20 11344.87 10721.19 12383.45 11679.74 8993.17 11969.56 11143.98 7855.89 8082.07 8748.17 9250.08 8503.44 8886.70 10356.00 10285.67 10124.01 9693.27 8884.47 10473.86 8107.26 10206.35 10439.32 9762.75 6819.85 7913.52 8826.47 8423.01 8075.55 9688.80 8280.85 8640.00 7261.45 7691.83 7449.17 SM 36:1;2O 219289.07 183809.14 208587.33 221967.54 225348.11 207618.81 252873.84 202043.93 239701.81 219945.13 213027.03 200014.96 197330.77 193483.92 224394.93 230864.26 182067.83 232617.98 199106.21 212520.76 176269.12 208151.19 231466.22 219804.47 230749.52 223666.75 206268.30 212762.09 221562.17 164285.87 221522.49 237536.08 243885.20 257709.45 205640.60 265757.52 236932.02 249314.47 245012.56 207683.44 272677.87 245090.14 250837.68 245531.20 246913.47 196701.50 220911.80 226357.38 216815.33 219429.01 242508.89 222439.18 232053.71 224796.22 230833.44 232187.12 SM 38:1;2O 57569.26 59190.99 57686.67 58471.62 59982.50 51002.42 80133.41 54595.84 68543.37 54102.58 54922.55 55031.42 54605.41 51408.99 59156.74 63432.82 49764.80 67648.97 47634.02 58063.92 55989.38 55745.83 68512.84 54487.32 63942.37 62158.15 50893.14 55370.97 57683.02 57929.53 65600.76 67891.70 71609.09 65286.22 59804.29 72055.51 65779.43 70998.67 71598.37 58700.35 62747.86 59905.06 65827.35 63672.80 65112.16 49434.95 56048.50 58420.04 57414.80 65016.14 70481.06 60284.66 63067.03 63683.80 62009.46 63282.88 SPB 14:0;2O 1818.37 1169.34 1592.75 998.09 1428.31 970.99 1672.68 1033.20 855.72 1000.89 1273.56 1816.82 873.04 1185.43 996.43 1441.71 1597.60 1345.50 712.85 1570.20 1431.26 881.59 1608.54 1566.59 1716.02 1184.69 1362.24 1240.21 962.33 2672.70 1606.45 1523.29 1912.08 2191.61 2031.40 3445.31 2680.42 2434.15 3757.72 2816.90 1882.69 698.88 1552.40 1669.77 1439.45 1047.58 1175.55 1520.01 1596.29 876.36 1586.00 1450.47 1121.79 955.62 1030.35 1573.49 SPB 14:1;2O 3899.41 2844.19 2971.53 2318.38 3497.04 2981.46 2898.16 3315.51 2687.25 2554.90 3054.27 3247.85 2392.80 3001.88 2283.43 3058.18 3145.62 2827.04 2000.83 3894.69 2746.19 2109.17 3539.31 3580.70 3055.84 3638.30 4056.50 2558.37 3212.43 5025.78 3362.81 4007.47 4913.37 5425.77 3611.57 6128.61 5136.17 5549.39 6334.07 4887.30 4385.25 2701.58 2898.49 4283.02 3117.19 4146.96 3147.06 3648.10 4286.95 2741.20 3699.96 4146.11 2212.27 2562.46 3401.28 4127.02 SPB 16:1;2O 829.40 722.70 723.34 538.12 840.63 820.03 724.75 667.90 664.72 610.41 715.31 769.27 708.97 682.03 607.91 855.69 739.03 671.51 647.43 686.08 627.93 563.07 1013.01 812.42 702.71 722.81 669.52 732.30 706.16 1502.67 1076.38 989.66 1628.56 1479.81 968.35 2273.55 1290.36 1450.67 1859.98 1931.54 1186.61 611.35 949.21 1141.25 805.89 863.82 821.51 979.83 802.23 932.33 908.36 924.37 548.21 593.04 699.17 958.30 Stearoyl-L-Carnitine 230.88 188.95 257.88 348.64 288.18 271.06 334.18 209.96 411.34 219.63 299.69 259.82 257.56 151.69 270.73 319.62 257.91 284.75 332.02 311.81 240.66 162.38 353.22 245.60 197.07 254.02 426.94 203.23 237.80 208.14 126.32 111.66 208.85 179.10 167.73 327.12 199.87 136.44 258.89 169.91 182.76 246.81 186.46 357.78 196.53 138.34 198.14 219.78 85.98 300.43 133.15 153.00 130.61 231.30 173.31 121.72 TG 14:0_14:1_16:1 3285.20 6153.63 2980.84 6223.84 7416.76 6044.36 1260.00 3291.41 3206.34 6876.25 2775.38 2388.26 3479.60 3375.58 3774.61 2145.62 1977.82 2035.45 1953.83 2772.97 2448.19 3883.68 1955.39 2426.17 2133.96 2354.52 5465.94 1928.12 4824.37 1253.85 7293.31 2569.36 1867.99 3025.68 4272.03 6076.82 3638.11 6260.22 1916.45 1723.22 5108.60 4591.95 3410.10 2994.47 4418.79 3301.21 2017.87 2203.88 3589.58 5031.48 1658.72 4525.04 4817.11 2693.99 3215.48 6787.69 TG 14:1_16:0_16:1 33154.90 51106.37 31052.22 61398.80 73615.23 65881.84 8445.33 35124.34 35361.45 63643.43 24161.47 22440.50 38992.17 38455.64 38010.60 15257.41 16816.51 17062.33 16798.27 20068.39 21613.06 34551.10 18810.34 21757.90 18312.07 25065.12 52112.52 15757.90 57874.47 6456.83 46048.29 19094.83 14384.65 17147.55 28597.98 43715.11 28722.35 25121.39 9604.30 12297.56 20218.66 36212.93 18039.71 12239.15 24376.07 22849.25 11827.38 14563.61 28604.88 28558.21 13638.55 28460.51 23769.32 20249.93 21852.80 25085.55 TG 14:1_16:1_16:1 6655.32 11641.40 6742.60 18394.47 17075.58 14474.57 1681.25 8263.00 7942.67 13158.39 8460.03 3908.37 9387.31 7334.60 6486.72 6110.04 6270.74 3919.30 3772.81 8213.49 9539.78 10121.83 6220.94 6615.46 5678.18 11706.17 16373.78 4950.52 12228.11 1813.42 5069.01 3265.46 2415.61 3675.40 4140.02 8220.66 3673.37 4459.39 1927.01 2775.96 4549.58 8452.46 2734.56 4920.40 4490.89 3316.93 2328.86 2819.66 4964.39 7158.50 3708.73 5902.06 6739.88 5191.49 3965.76 4973.29 TG 16:0_16:1_16:1 191748.52 275268.10 235494.82 375658.67 430143.49 438353.76 51452.85 262560.74 278564.14 343657.53 160420.96 185079.01 275742.49 261988.57 211621.42 77134.35 107735.43 103104.75 104721.13 124707.87 139621.82 240486.55 155245.28 163334.19 130174.59 193307.55 238517.86 104060.66 355590.62 38834.97 280942.78 139848.58 96630.47 136983.99 211560.12 263989.85 196461.78 165173.38 68307.41 86512.06 148713.70 265522.84 136835.09 72322.05 158210.97 156519.32 80338.82 91155.08 188114.54 185808.14 106869.59 187758.83 131129.40 155799.44 146795.78 154456.64 TG 16:0_16:1_18:1 443455.70 647861.02 432052.33 526054.70 964029.05 865971.92 106615.54 535479.69 515649.89 660732.71 353336.04 371401.28 561493.46 499775.06 498750.21 176120.45 177846.43 246897.50 305086.87 219432.16 260543.24 484615.24 216286.21 331126.44 272509.35 315589.64 470157.13 205277.49 682126.81 101147.25 738195.96 368946.33 301817.00 369491.53 558760.55 609259.65 457701.02 437452.38 170225.19 191177.73 359881.26 612832.04 340557.34 177786.59 452547.79 400447.19 225313.94 277134.28 515510.35 455623.05 251150.78 479527.69 371354.48 327844.82 442427.02 392929.60 TG 16:0_16:1_18:3 24549.49 28951.37 23348.44 44286.78 40121.29 30552.95 5118.22 28991.44 25739.24 30134.23 21069.96 15888.51 26173.82 23884.54 21884.21 14886.54 15052.05 16268.90 15292.03 21735.71 14476.56 29757.42 25105.44 18323.30 15274.82 25008.90 40339.15 13887.08 28181.60 5315.58 18978.78 9926.84 6474.76 12058.10 9385.24 20584.73 11905.70 14012.63 5400.59 6669.81 9844.35 22895.21 10678.74 10372.18 12438.83 11819.37 7086.60 9616.99 15325.16 16132.69 7735.68 16204.60 18595.58 14751.28 15144.48 14075.98 TG 16:0_18:0_18:0 2463.75 3056.86 2170.95 1496.67 2385.14 2205.51 2624.19 1875.40 3102.51 1788.65 1277.97 2645.90 2102.01 1515.93 2595.13 1765.17 1346.02 2518.14 2743.78 2009.76 2667.86 2845.01 955.78 3458.33 2558.46 3004.06 3831.38 6774.51 2738.75 5008.09 10267.83 10556.43 8559.62 6950.04 4029.90 23424.07 37857.74 6426.37 16615.30 6450.16 6048.11 4590.29 5870.09 5163.18 11259.40 9504.09 8257.16 7658.06 9108.17 4711.19 6191.17 5398.55 6125.45 5667.70 11025.13 6140.66 TG 16:0_18:2_18:4 11634.16 10966.24 10904.47 12550.25 12760.81 11942.19 5068.95 16579.40 13393.76 11130.22 12961.17 11046.77 12283.58 12682.96 11527.93 10620.59 6947.82 8873.76 7876.19 13638.36 7525.12 10489.00 10427.68 8629.16 8579.52 9685.16 12862.98 8112.20 11039.22 4045.32 8745.73 5755.64 4852.81 7261.85 6013.64 7329.66 6270.46 7047.81 6395.25 5434.71 6870.90 10019.22 7396.41 5414.69 9037.50 7661.17 6046.09 8209.39 8517.27 6594.18 5578.99 8346.87 7072.91 8441.85 7183.85 6718.90 TG 16:1_18:1_18:3 22729.05 25657.20 22752.09 26061.57 36440.38 26990.75 6242.21 28107.15 24613.26 26947.68 22388.86 16607.52 25808.54 25346.84 26880.73 17284.61 13613.78 16878.99 19762.59 20434.13 12230.70 29126.49 20193.75 17198.96 13715.90 20092.05 32727.52 14775.76 25213.70 8632.61 15563.23 11394.05 9115.38 12472.58 8101.42 19333.75 10670.46 13135.40 8000.43 7434.02 9701.97 17912.36 12422.16 9124.55 13368.75 11279.42 8680.88 14420.93 16756.77 15016.29 8045.01 13987.86 20534.67 13039.10 12510.76 14116.89 TG 18:0_18:0_18:1 93914.59 128331.51 70091.08 63666.46 150249.70 118652.42 35144.82 86473.02 92239.31 110868.40 54191.16 69146.72 98581.85 78737.40 108644.32 38907.09 37778.20 69756.78 57415.13 50958.65 53614.66 89430.93 43022.52 62253.87 56423.52 51243.69 76726.97 61670.78 106719.65 52660.59 133138.65 91786.73 98440.92 75441.14 95261.04 136751.88 154984.76 91182.21 89272.94 57253.19 84571.52 109340.58 72875.43 65484.10 110469.69 100800.52 79148.06 91177.17 107269.74 103924.85 79262.26 92370.18 114474.72 70474.25 114852.18 79805.16 TG 18:0_19:1_21:1 22745.78 30218.00 20785.07 19821.89 36298.81 29653.13 8880.43 26416.31 22594.62 29538.23 16414.69 21410.96 28225.91 24163.00 27270.84 11433.16 9190.81 20431.42 16964.91 13881.18 14010.83 23743.13 11914.20 20000.02 16548.32 15645.44 20871.00 15454.16 22802.23 14370.50 57376.96 33694.71 36404.32 27591.24 42710.40 50039.72 43357.39 38049.47 21332.93 13714.02 27850.25 38440.55 27336.18 18945.55 36657.48 38476.63 25441.30 29956.62 45092.10 28281.16 20115.95 32558.96 37064.49 25359.21 38602.49 28835.51 TG 18:1_18:1_18:3 31726.31 37996.05 50234.00 22487.83 49789.74 43090.20 15776.39 49264.15 43502.11 36911.89 41994.50 26343.11 46807.57 51724.99 63053.98 47161.35 18440.35 28954.92 55224.25 25342.58 17079.06 33189.95 23771.15 25250.64 22775.64 24245.84 35536.70 23188.22 29941.88 19500.02 28082.68 22897.54 21707.61 22735.22 18893.86 31843.95 21795.88 28775.30 18140.17 12619.01 20859.58 26816.10 28023.41 18723.74 26281.84 20545.50 18739.32 28331.34 28682.09 24576.54 15153.81 22725.05 35262.25 22969.16 24987.99 26690.99 TG 18:1_18:1_20:1 30820.99 41676.19 25759.55 22370.76 48664.29 31812.06 9453.00 33820.04 28769.04 39326.83 26170.80 23522.76 38133.27 32822.65 41037.14 17413.10 15217.31 21130.12 27068.44 21266.45 15196.76 36462.69 18626.15 23752.73 17749.13 17801.05 32209.53 18167.11 29349.80 17768.04 37822.47 26765.66 30728.29 25443.84 33223.42 39846.71 30072.10 34405.78 18284.22 12415.69 24778.32 39828.54 21083.46 15628.00 24566.14 30005.97 25193.36 25030.75 34187.28 31838.28 11917.03 34100.96 35655.68 24199.62 36260.95 32875.93 TG 18:1_18:1_32:1 2899.23 8766.86 2875.36 2868.34 7113.08 5160.57 864.49 3862.37 3143.80 5840.06 2050.73 2623.62 2989.17 4899.35 4785.73 1958.41 1881.45 2898.61 1951.52 2087.15 1289.76 5001.80 2157.94 2399.39 1130.97 1583.48 2872.42 1322.69 4002.15 2270.02 4024.48 2881.71 2194.52 3213.28 4200.70 5105.48 3314.63 4103.79 2076.98 1321.43 2365.84 7102.54 2633.92 1895.82 3325.27 3155.50 3430.68 4320.96 4879.81 4306.97 1602.02 4476.41 6892.80 2238.89 3825.79 2832.01 TG 18:1_18:1_34:1 1211.75 3024.70 1481.71 1154.60 2572.63 1591.99 392.96 1493.03 1411.51 2191.90 708.11 1017.96 1087.68 1750.62 2228.42 766.37 703.90 1002.35 826.53 765.07 595.23 1813.86 832.79 967.53 400.58 557.32 1246.98 474.55 1660.23 707.72 1222.95 890.81 930.64 1154.59 1316.14 1352.34 995.33 1316.12 838.01 492.72 740.81 2423.62 860.70 618.02 1352.96 993.53 1341.83 1329.41 1659.76 1327.66 563.76 1660.79 2181.87 781.21 1551.92 978.67 TG 18:1_18:2_19:0 10259.04 17931.87 11913.93 19084.46 22499.03 19205.20 2988.35 14711.05 14297.31 16833.27 8740.35 9223.87 16300.79 13366.45 11595.55 5315.92 7700.53 8307.15 8738.78 10343.90 9966.37 17003.65 8826.45 11585.75 9256.46 13750.84 16996.52 7921.24 16424.68 5421.38 19179.77 10694.96 8569.29 11382.53 13449.22 25159.53 15825.09 12818.17 6329.68 6294.05 11604.08 20726.12 9058.98 10819.61 13112.40 12944.19 7145.04 9944.25 18209.35 15917.23 9110.46 15517.98 19700.05 12817.49 14685.59 15476.89 TG 18:1_18:3_18:3 9810.44 10947.81 12327.21 9177.26 13778.60 12753.33 5555.72 14322.16 12554.16 10903.13 13924.30 8102.61 13592.50 15290.56 15162.25 9824.74 4842.60 7022.45 12268.95 8431.50 5536.85 8073.07 7226.81 6415.26 6189.50 6857.09 9761.25 6456.05 11252.43 3789.80 8006.15 6069.86 4484.95 5932.10 6333.11 7093.21 5953.16 6618.25 5337.53 3739.81 5407.76 6576.15 7097.51 4590.58 6468.56 6292.62 5381.73 7339.33 6859.07 5338.08 4827.73 6459.63 5691.09 6945.19 6064.03 5163.18 TG 18:1_25:0_26:2 946.09 2134.10 1023.08 592.92 1754.67 958.80 388.45 1063.92 1001.80 1261.15 536.03 845.26 930.68 1350.69 1272.90 400.52 423.41 644.32 571.49 421.14 350.83 992.04 515.60 533.54 300.84 407.98 997.64 328.35 1171.57 375.75 669.05 565.82 495.57 529.86 626.79 811.73 457.72 710.32 442.41 311.62 446.40 1676.76 397.39 406.99 861.32 640.63 703.25 970.03 1093.19 695.10 408.69 753.64 1204.04 423.37 701.62 478.24 TG 18:3_18:3_18:3 5498.79 6912.01 5673.53 6714.70 8500.95 7263.86 4853.04 9719.84 9343.14 5761.49 9054.89 4997.10 8270.34 8066.93 6890.57 5726.59 3330.65 4039.89 5643.05 6175.94 3395.72 5019.27 5750.82 4234.14 4890.87 5436.70 5579.01 4443.06 7473.87 2731.50 4907.02 4330.47 2555.21 4442.45 3641.36 4893.29 3425.17 4489.56 4095.71 2718.55 3693.02 3853.72 3740.89 3442.77 3873.38 3903.36 3220.01 4984.92 4045.62 3591.80 3599.82 4983.26 3730.36 4363.17 4022.47 3300.43 TG 22:6_23:0_26:7 7421.28 12061.70 7194.90 5237.13 18719.68 8988.44 4081.35 9042.23 6714.10 6793.39 4129.83 4433.47 16322.39 8099.07 23748.97 7384.94 5096.99 10875.41 5243.51 4866.70 2866.94 8503.19 5544.45 6715.93 4593.74 2769.79 6177.81 4003.52 7572.19 6133.52 13787.72 7790.51 8176.14 7944.94 11119.62 17206.64 16807.08 16756.93 8717.82 7827.77 10004.85 15237.85 7116.15 8535.82 14084.35 11814.54 9264.61 10742.60 13574.04 18831.20 6526.20 15815.84 23391.66 8203.95 23775.58 15888.94 TG O-14:0_16:0_18:1 66126.52 53182.07 43388.57 38825.89 30685.72 39532.55 40411.53 25830.86 39991.69 40117.26 32222.79 43202.64 31096.29 18047.73 29575.07 22927.16 15110.71 23952.66 42857.00 52918.44 31359.27 33386.14 14122.51 36170.26 31561.10 29006.41 58191.72 43736.88 46446.03 50916.70 60227.65 78725.42 97493.28 42820.97 42679.95 117550.23 184488.91 34972.28 73187.28 78713.14 76827.80 48987.89 54634.64 64305.35 62907.20 68781.01 48272.42 55127.80 71391.62 56011.17 90853.99 45299.52 88526.17 44994.20 81464.80 72382.84 TG O-16:0_16:1_18:1 271829.02 207791.05 155176.78 190331.80 169671.61 178139.42 171822.25 124464.74 180417.05 165349.87 136460.41 200894.55 134848.68 95048.77 150114.59 103513.29 73029.26 104601.61 199729.51 177614.31 154290.16 176979.06 78589.48 156097.78 126435.20 157990.17 306015.88 213339.25 208445.09 282645.04 323664.23 364115.44 460482.93 233562.00 255122.93 653549.30 765183.76 187214.10 394431.55 313903.86 365465.87 258621.87 222814.25 261533.38 310685.56 333245.43 230214.46 232657.32 336973.46 304040.64 317790.01 230335.63 334680.31 211591.90 394225.57 386709.20 TG O-18:0_16:1_18:1 492112.70 430887.56 280189.69 356847.16 369290.13 379417.51 359897.72 271610.86 448172.61 323504.03 286944.60 443787.72 299660.90 218485.98 337293.59 241056.96 203299.32 254867.46 417515.44 318776.15 360799.45 404630.71 182478.31 403073.61 283744.87 398872.38 612133.89 552297.67 443356.78 660921.03 856687.66 810970.97 971957.28 634510.34 554610.94 1544994.27 1552993.49 552751.28 1072805.19 693088.77 757885.65 592697.14 558068.60 552831.45 879358.01 940151.18 651563.05 625203.25 810114.79 656159.50 697859.57 585640.77 724295.00 536438.43 1007319.69 873830.88 TG O-18:0_18:1_18:1 637102.88 586796.67 402811.53 472257.11 495220.80 602305.92 588366.01 430172.44 644441.04 409981.68 444904.55 630515.75 420252.55 403352.40 493154.73 418554.81 487716.40 599993.95 587718.90 470879.26 596465.21 642284.33 335830.90 924063.78 646499.80 717189.19 1123184.93 1099849.06 699278.64 1390137.02 1913426.03 1738058.07 1590873.48 1338688.17 1105235.40 2038697.32 2102074.26 1306969.90 2106495.43 1234072.93 1252206.32 1014142.27 1324117.12 1422870.87 1920871.84 1900811.97 1809810.56 1632845.20 1890084.98 764717.04 1508884.37 1106229.10 1255985.49 1115926.39 1838945.16 1264198.13 TG O-20:0_18:1_18:4 61935.00 52163.41 57090.95 64427.93 44692.18 63641.75 35769.25 58307.63 67347.32 54301.28 67787.92 68645.14 56901.58 58808.85 40477.28 47360.74 68207.28 59940.84 67563.79 61792.19 79179.63 66422.59 51666.51 78449.16 68672.67 74742.88 64216.92 73867.83 70014.77 54168.21 49506.23 47649.76 54438.87 56113.71 49404.57 43549.01 49160.43 50129.84 45932.50 57846.34 59271.56 54410.37 48331.67 43924.21 56414.48 48893.65 49471.63 48517.08 44049.84 60680.28 51984.38 58575.39 53367.75 49946.15 57087.41 51500.12 TG O-20:0_18:1_20:1 68709.85 48537.26 49843.43 48848.37 42131.38 66347.71 37519.08 50811.00 43896.88 38252.43 34396.72 53061.64 37382.33 59372.81 43398.67 43045.30 50550.62 68739.37 36107.40 45267.18 38214.53 62427.08 31880.37 84618.14 59488.15 61330.58 76092.51 92878.93 62785.52 120213.69 145618.35 141781.12 129741.84 72304.49 71075.96 139567.83 151031.03 66014.71 113471.30 56747.98 61425.35 59671.11 65014.80 73902.11 112493.95 84613.10 83010.02 89450.20 115716.23 52946.00 69044.80 61948.78 80175.02 60365.15 106165.57 50436.24 TG O-22:0_18:1_18:1 49639.04 49307.78 31236.49 33661.58 51295.63 47185.72 33724.98 28195.98 34508.65 41592.87 27919.50 40867.10 29573.43 30216.90 42978.64 25594.06 21982.94 24399.84 41111.55 28334.94 30933.64 40666.35 18819.16 34380.45 30646.44 34929.48 52916.14 44773.08 45209.97 54131.92 91621.08 68149.57 79614.31 51353.27 54882.00 113433.73 113753.08 54311.34 68978.56 48623.91 63334.48 70999.19 55871.17 58371.25 59795.16 78252.08 52392.00 66180.37 69075.15 58383.34 66204.04 53152.19 77376.06 46074.96 74260.48 78020.49 Triacylglycerol 18:2-18:2-18:2 10189.78 11922.45 19095.20 9191.13 16579.74 17246.69 6188.77 19088.34 17039.99 11876.46 20039.17 8653.67 17612.13 22466.79 21796.48 15535.53 5638.40 8707.47 20518.78 9255.02 6473.61 9442.72 8393.58 7896.17 7796.38 8399.75 10679.12 7661.83 11375.39 4708.11 7540.91 6449.39 5496.48 6606.35 5999.72 7787.23 5540.94 7428.32 6829.80 4431.64 5908.99 7396.61 7789.38 5718.92 6748.14 6896.65 5661.36 9212.00 7075.93 5771.51 5007.97 6107.69 6717.76 7519.66 6722.85 5939.62 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name m/z Retention time (min) Adducts Formula Isotope Distribution 9-HDA_9(R)-hydroxydec-2(E)-enoic acid 209.11 2.24 M+H-H2O, M+H, M+NH4, M+Na C10H18O3 100 - 13 - 0.0114 9-ODA_E-9-oxodec-2-enoic acid 207.10 1.69 M+H-H2O, M+H, M+NH4, M+Na C10H16O3 100 - 12.3 - 0.0513 HOB_methyl p-hydroxybenzoate 153.05 1.63 M+H C8H8O3 100 - 10.9 HVA_4-hydroxy-3-methoxyphenylethanol 191.07 0.82 M+H-H2O, M+H, M+Na C9H12O3 100 - 14.5 LEA_linolenic acid 296.26 9.56 M+NH4 C18H30O2 100 - 23 MO_methyl oleate 319.26 11.23 M+H, M+NH4, M+Na C19H36O2 100 - 23.9 - 3.13 CA_E-3-(4-hydroxy-3-methoxyphenyl)-prop-2-en-1-ol 163.08 0.95 M+H-H2O C10H12O3 100 - 11.4 10-HAD_10-Hydroxy-2-Decenoic Acid 209.11 2.67 M+H-H2O, M+H, M+NH4, M+Na C10H18O3 100 - 11.8 - 0.275 ISTD_Chol Ester (18:1-d7)_700185 675.68 12.94 M+NH4 C45H71D7O2 100 - 63.2 - 24.8 - 4.53 - 0.182 ISTD_TG (15:0-18:1-d7-15:0)_791648 829.80 12.78 M+NH4 C51H89D7O6 100 - 69.8 - 27.6 - 99.1 - 65.5 ISTD_SM (18:1-d9)_791649 738.65 11.86 M+H, M+Na C41H72D9N2O6P 100 - 57 - 14.1 - 4.63 - 1.28 - 1.14 ISTD_PC (15:0-18:1-d7)_791637 753.61 12.07 M+H C41H73D7NO8P 100 - 46.1 - 13.1 - 3.02 - 0.583 ISTD_MG (18:1-d7)_791646 346.33 8.37 M+H-H2O C21H33D7O4 100 - 22.2 - 2.8 ISTD_Cholesterol-d7_700041 411.43 10.82 M+NH4 C27H39D7O 100 - 30.6 (Z)-9,12,13-trihydroxyoctadec-15-enoic acid 353.23 4.37 M+H-H2O, M+H, M+NH4, M+Na C18H34O5 100 - 18.8 - 2.76 10-HYDROXYDECANOATE 211.13 3.41 M+H-H2O, M+H, M+NH4, M+Na C10H20O3 100 - 11.8 - 0.25 PGB2 335.22 5.57 M+H C20H30O4 100 - 9.56 PGG2 391.21 4.39 M+H-H2O, M+H, M+Na C20H32O6 100 - 21.5 - 3.91 - 0.165 19(R)-hydroxy-PGE2 391.21 5.74 M+Na C20H32O6 100 - 21.3 12-Hydroxydodecanoic acid 199.17 5.26 M+H-H2O, M+H, M+Na C12H24O3 100 - 12.5 - 0.32 3-Hydroxycapric acid 171.14 2.86 M+H-H2O, M+H, M+NH4, M+Na C10H20O3 100 - 11 - 0.549 DL-b-Hydroxycaprylic acid 183.10 1.21 M+H-H2O, M+H, M+NH4, M+Na C8H16O3 100 - 9.8 - 0.671 13,14-dihydro-PGE1 357.26 7.00 M+H C20H36O5 100 - 20.1 - 2.73 - 0.307 - 0.0172 13,14-dihydro-19(R)-hydroxyPGE1 373.26 7.11 M+H C20H36O6 100 - 33 - 5.84 7-Oxo-11-dodecenoic acid 235.13 4.44 M+H-H2O, M+H, M+NH4, M+Na C12H20O3 100 - 15.5 - 0.00805 Oleic Acid ethyl ester 311.29 11.51 M+H, M+NH4, M+Na C20H38O2 100 - 23.5 - 3.87 - 0.175 - 0.107 13,14-dihydro-15-keto Prostaglandin D1 377.23 6.84 M+H, M+Na C20H34O5 100 - 21.6 2,3-dinor Prostaglandin E1 327.22 5.87 M+H-H2O, M+H, M+NH4, M+Na C18H30O5 100 - 22.2 - 1.95 - 0.0515 13,14-dihydro Prostaglandin F1α 359.28 7.22 M+H C20H38O5 100 - 23.8 - 4.52 - 0.275 13,14-dihydro-15-keto-tetranor PGF1β 323.18 4.91 M+H-H2O, M+H, M+NH4, M+Na C16H28O5 100 - 17.5 - 4.73 - 0.465 LysoPE(16:1(9Z)/0:0) 452.28 8.01 M+H C21H42NO7P 100 - 19.8 12-OPDA 293.21 6.09 M+H C18H28O3 100 - 27.5 9S,10S,11R-trihydroxy-12Z-octadecenoic acid 313.24 6.29 M+H-H2O C18H34O5 100 - 18.9 - 2.88 14,15-DEHYDRO-LEUKOTRIENE B4 335.22 5.31 M+H C20H30O4 100 - 13.6 Cer 8:0;2O/6:0 260.22 1.45 M+H, M+Na C14H29NO3 100 - 16 - 1.03 Cer 8:0;2O/8:0 288.25 3.97 M+H C16H33NO3 100 - 21.9 CL 32:2_32:2 1362.95 12.57 M+NH4 C73H134O17P2 100 - 61.9 - 62.7 - 39.3 CL 34:2_32:2 1390.98 12.59 M+NH4, M+Na C75H138O17P2 100 - 75.6 - 62.6 - 34.5 - 19.2 CL 34:2_34:2 1419.01 12.62 M+H, M+NH4, M+Na C77H142O17P2 100 - 80.1 - 46.8 - 21.9 - 10.4 - 2.33 CL 34:2_34:4 1414.98 12.58 M+NH4 C77H138O17P2 100 - 73.1 - 93.4 - 67.3 CL 34:2_36:2 1447.04 12.63 M+H, M+NH4, M+Na C79H146O17P2 100 - 82.9 - 43.5 - 21.4 - 9.72 - 2.45 - 0.457 CL 34:4_36:4 1438.98 12.57 M+NH4 C79H138O17P2 100 - 69 CL 36:2_36:2 1475.07 12.66 M+H, M+NH4, M+Na C81H150O17P2 100 - 85.9 - 39.9 - 16 - 6.03 - 0.221 cuminyl alcohol 151.11 2.24 M+H-H2O, M+H C10H14O 100 - 12.5 DG 16:0_16:1 584.53 12.42 M+NH4 C35H66O5 100 - 42.7 - 27.5 - 16 DG 18:1_18:1 638.57 12.50 M+NH4, M+Na C39H72O5 100 - 48.9 - 33.5 - 12.8 - 20.4 DG 18:1_18:2 636.56 12.46 M+NH4 C39H70O5 100 - 73.4 DG 18:1_18:3 634.54 12.39 M+NH4, M+Na C39H68O5 100 - 47.6 DG 19:0_19:0 675.59 12.47 M+H, M+NH4, M+Na C41H80O5 100 - 63.5 - 31.6 - 34.3 - 1.21 - 0.983 - 0.413 DG O-16:0_18:1 581.55 12.57 M+H, M+NH4, M+Na C37H72O4 100 - 49.3 - 14.2 - 4.44 - 0.779 DG O-20:0_18:1 637.61 12.66 M+H, M+NH4, M+Na C41H80O4 100 - 50.6 - 15.6 - 4.57 - 0.32 DG O-20:0_21:1 696.69 12.62 M+NH4 C44H86O4 100 - 42.8 - 37.1 - 2.8 Glyceryl trioleate 902.82 12.82 M+NH4, M+Na C57H104O6 100 - 68.9 - 85 - 46.7 hexadecanedioic acid 309.20 4.65 M+H-H2O, M+H, M+Na C16H30O4 100 - 18 - 0.428 - 0.0481 Prostaglandin D2 370.26 6.51 M+NH4 C20H32O5 100 - 24.8 - 4.48 - 0.79 Prostaglandin E1 372.27 6.85 M+NH4 C20H34O5 100 - 24.1 Prostaglandin F3a 353.23 6.60 M+H-H2O, M+H, M+NH4, M+Na C20H32O5 100 - 23 - 2.43 13,14-Dihydro PGE1 374.29 7.02 M+NH4 C20H36O5 100 - 18.4 - 2.78 - 0.133 6-Keto-prostaglandin F1a 371.24 4.82 M+H, M+NH4 C20H34O6 100 - 21.6 - 2.96 11-Dehydro-thromboxane B2 386.25 6.18 M+NH4 C20H32O6 100 - 17.7 - 6.56 9,10,13-TriHOME 331.25 6.41 M+H-H2O, M+H, M+NH4 C18H34O5 100 - 21.5 - 4.02 Thromboxane B3_Isomer 369.23 6.66 M+H C20H32O6 100 - 25.1 - 7.03 - 1.81 - 0.873 Thromboxane B3 369.23 6.20 M+H, M+Na C20H32O6 100 - 23.6 - 3.79 Prostaglandin D1 337.24 6.84 M+H-H2O C20H34O5 100 - 17 Arachidyl carnitine 456.41 9.82 M+H C27H53NO4 100 - 27.9 DG(16:0/22:1(13Z)/0:0) 673.57 12.43 M+Na C41H78O5 100 - 48.4 DG(18:0/18:1(11Z)/0:0) 645.54 12.57 M+Na C39H74O5 100 - 47.9 PC(18:0/16:0) 762.60 12.34 M+H C42H84NO8P 100 - 51.5 - 15.9 - 4.58 PC(18:0/18:1(11Z)) 788.62 12.36 M+H C44H86NO8P 100 - 41.3 - 17.3 - 5.35 - 2.71 - 1.01 - 0.612 - 0.349 PC(18:3(9Z,12Z,15Z)/P-16:0) 762.54 11.52 M+Na C42H78NO7P 100 - 48 - 35.6 - 13.8 - 5.2 PE(16:1(9Z)/P-18:1(11Z)) 700.53 12.12 M+H, M+Na C39H74NO7P 100 - 43.8 PE(20:0/16:1(9Z)) 728.56 12.32 M+H-H2O, M+H C41H80NO8P 100 - 53.1 - 25.4 - 9.3 - 6.16 - 2.83 - 1.21 - 0.456 PE(20:1(11Z)/24:0) 858.70 12.54 M+H C49H96NO8P 100 - 46.2 PE(20:3(5Z,8Z,11Z)/P-16:0) 726.54 12.31 M+H C41H76NO7P 100 - 48.8 PE(22:4(7Z,10Z,13Z,16Z)/22:4(7Z,10Z,13Z,16Z)) 826.57 12.36 M+H-H2O, M+H, M+Na C49H82NO8P 100 - 57.2 - 25.7 - 11.9 PE(22:4(7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)) 824.56 12.26 M+H-H2O, M+H C49H80NO8P 100 - 51.1 - 20.9 - 7.73 - 5.47 - 3.39 - 2.98 PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/20:2(11Z,14Z)) 798.54 12.21 M+H-H2O C47H78NO8P 100 - 53.7 - 17.3 - 6.38 PE(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/P-16:0) 770.51 11.89 M+Na C43H74NO7P 100 - 53.6 - 28 - 7.84 - 1.47 - 0.119 CL(18:2(9Z,12Z)/18:2(9Z,12Z)/18:2(9Z,12Z)/18:3(9Z,12Z,15Z)) 1464.99 12.57 M+NH4 C81H140O17P2 100 - 61.4 3-Oxododecanoic acid 237.15 4.91 M+H-H2O, M+H, M+NH4, M+Na C12H22O3 100 - 14.7 - 0.995 PC(P-16:0/18:1(11Z)) 744.59 12.17 M+H C42H82NO7P 100 - 33.3 - 43.5 - 6.51 - 1.52 PC(P-18:1(9Z)/14:1(9Z)) 714.54 11.61 M+H C40H76NO7P 100 - 45.3 PE(P-18:0/16:1(9Z)) 719.57 11.63 M+H-H2O, M+NH4 C39H76NO7P 100 - 42.3 - 10.4 - 1.87 SM(d18:1/22:0) 787.67 12.43 M+H, M+Na C45H91N2O6P 100 - 70.9 - 42.7 5,6-Dihydroxyprostaglandin F1a 371.24 6.88 M+H-H2O C20H36O7 100 - 8.26 - 3.18 20-dihydroxyleukotriene B4 391.21 4.65 M+H-H2O, M+Na C20H32O6 100 - 21.7 - 2.79 Prostaglandin E2 ethanolamide 396.27 6.28 M+H C22H37NO5 100 - 33.4 - 4.48 - 1.71 PC(O-16:0/18:0) 748.62 12.40 M+H, M+Na C42H86NO7P 100 - 43.6 - 1.07 - 0.0191 PC(O-16:1(9Z)/18:2(9Z,12Z)) 742.57 12.03 M+H, M+Na C42H80NO7P 100 - 48.4 - 13.2 - 6.33 Dihydrotachysterol 381.35 12.90 M+H-H2O C28H46O 100 - 34.8 - 9.34 xi-7-Hydroxyhexadecanedioic acid 325.20 5.37 M+H-H2O, M+H, M+NH4, M+Na C16H30O5 100 - 19.8 - 1.47 - 0.144 Dehydrophytosphingosine 298.27 7.13 M+H-H2O C18H37NO3 100 - 22.6 - 2.94 - 0.278 (E)-4-Octenoic acid 125.10 1.21 M+H-H2O C8H14O2 100 - 13.4 TG(14:0/20:2n6/20:5(5Z,8Z,11Z,14Z,17Z)) 877.73 12.76 M+H C57H96O6 100 - 47.9 TG(15:0/16:1(9Z)/18:3(9Z,12Z,15Z)) 830.72 12.69 M+NH4 C52H92O6 100 - 69.6 TG(15:0/18:2(9Z,12Z)/14:1(9Z)) 804.70 12.69 M+NH4, M+Na C50H90O6 100 - 57.4 - 16.1 TG(15:0/22:5(4Z,7Z,10Z,13Z,16Z)/20:5(5Z,8Z,11Z,14Z,17Z)) 895.72 12.78 M+H-H2O C60H96O6 61.2 - 100 TG(18:0/20:0/18:2(9Z,12Z)) 932.86 12.82 M+H-H2O, M+NH4 C59H110O6 100 - 83.1 - 71.7 - 28.4 - 22.9 TG(18:0/20:0/20:3n6) 923.84 13.00 M+H-H2O C61H112O6 100 - 65.5 - 34.8 - 12.9 - 4.18 - 1.26 - 0.203 - 0.21 TG(18:0/20:1(11Z)/20:2n6) 958.88 12.78 M+NH4 C61H112O6 100 - 65.4 TG(16:1(9Z)/16:1(9Z)/18:4(6Z,9Z,12Z,15Z)) 823.68 12.71 M+H C53H90O6 100 - 59.2 TG(18:1(11Z)/18:0/20:3n6) 893.80 12.89 M+H-H2O C59H106O6 41.7 - 100 TG(20:1(11Z)/14:0/20:3n6) 865.77 12.61 M+H-H2O C57H102O6 52.5 - 100 - 41.1 TG(22:1(13Z)/15:0/20:4(8Z,11Z,14Z,17Z)) 940.84 12.72 M+NH4 C60H106O6 100 - 63.1 TG(22:2(13Z,16Z)/20:1(11Z)/O-18:0) 937.90 12.77 M+H-H2O C63H118O5 100 - 37 - 7.03 - 0.717 CL(18:0/16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/16:1(9Z)) 1471.96 12.59 M+H-H2O, M+Na C81H142O17P2 100 - 42.5 - 45.1 - 7.7 CL(16:1(9Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/18:1(11Z)/16:1(9Z)) 1447.96 12.61 M+H C81H140O17P2 100 - 59.5 13-HDoHE 297.26 12.90 M+H-H2O C22H34O 100 - 24.2 3-hydroxypentadecanoyl carnitine 402.32 7.79 M+H C22H43NO5 100 - 26.1 - 12.5 - 2.39 10-Hydroxy-E4-neuroprostane 394.26 6.04 M+NH4 C22H32O5 100 - 31.6 - 5.03 17-phenyl-18,19,20-trinor-prostaglandin D2 369.20 6.41 M+H-H2O C23H30O5 100 - 11.4 - 6.57 CL(i-12:0/i-24:0/i-24:0/18:2(9Z,11Z)) 1546.17 12.23 M+H C87H166O17P2 100 - 97.3 - 29.7 - 16.4 - 15.6 - 10.9 - 7.12 - 4.65 - 4.67 - 4.96 TG(i-15:0/a-21:0/i-18:0)[rac] 908.86 12.73 M+NH4 C57H110O6 100 - 53.1 - 21.5 - 4.93 CL(16:1(9Z)/18:2(9Z,11Z)/20:4(5Z,8Z,11Z,14Z)/16:0) 1440.99 12.59 M+NH4 C79H140O17P2 100 - 71.7 CL(18:1(9Z)/16:1(9Z)/16:0/20:4(5Z,8Z,11Z,14Z)) 1443.01 12.61 M+NH4 C79H142O17P2 100 - 79.9 - 97.8 - 71.9 CL(18:1(8Z)/18:1(8Z)/20:4(5Z,8Z,11Z,14Z)/16:0) 1471.04 12.63 M+NH4 C81H146O17P2 100 - 82.5 - 77.2 - 53.9 CL(20:4(5Z,8Z,11Z,14Z)/16:0/18:2(9Z,11Z)/18:2(9Z,12Z)) 1467.01 12.59 M+NH4 C81H142O17P2 100 - 84.6 - 92 - 69.4 PE-NMe2(18:0/18:2(9Z,12Z)) 772.58 12.13 M+H C43H82NO8P 100 - 53.6 - 17.6 - 12.1 PA(24:0/22:2(13Z,16Z)) 841.67 12.75 M+H C49H93O8P 100 - 46.4 - 25.4 - 5.42 - 1.67 CL(8:0/8:0/18:2(9Z,11Z)/23:0) 1268.87 12.26 M+NH4 C66H124O17P2 95.3 - 100 - 35.6 - 19.6 LysoPE(P-18:0/0:0) 466.33 9.74 M+H C23H48NO6P 100 - 28.7 Eicosanedioic acid 343.29 11.81 M+H C20H38O4 100 - 12.8 1-O-Hexadecyl-sn-glycero-3-phosphocholine 482.36 8.85 M+H C24H52NO6P 100 - 21.2 19-Hydroxyprostaglandin E2 391.21 5.83 M+Na C20H32O6 100 - 22.9 Cer(d16:1/23:0) 608.60 12.51 M+H C39H77NO3 100 - 54 - 14.3 - 5.33 PS(19:1(9Z)/22:4(7Z,10Z,13Z,16Z)) 874.56 12.15 M+Na C47H82NO10P 100 - 55.2 MG(18:1(9Z)-O(12,13)/0:0/0:0) 393.26 9.34 M+H, M+NH4, M+Na C21H38O5 100 - 21.1 - 3.98 MG(0:0/18:3(9,11,15)-OH(13)/0:0) 386.29 5.87 M+NH4 C21H36O5 100 - 21.2 - 1.14 PE(20:1(11Z)/PGJ2) 846.52 11.79 M+Na C45H78NO10P 100 - 47.5 - 14.2 - 3.43 PA(22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)/22:2(13Z,16Z)) 839.52 11.91 M+Na C47H77O9P 85.7 - 50.7 - 17.2 - 100 PA(PGE2/8:0) 655.32 6.36 M+Na C31H53O11P 100 - 43.8 - 16.2 - 3.43 PA(PGD1/8:0) 657.34 6.48 M+NH4, M+Na C31H55O11P 100 - 41.7 - 19 PE(PGJ2/22:0) 876.57 12.26 M+Na C47H84NO10P 100 - 56.1 - 19.1 - 7.39 - 7.02 - 6.69 - 2.42 PE(22:4(7Z,10Z,13Z,16Z)/PGJ2) 868.51 11.32 M+Na C47H76NO10P 100 - 51.7 - 13.6 - 3.59 PE(20:4(6E,8Z,11Z,14Z)-OH(5S)/P-16:0) 740.53 11.97 M+H, M+Na C41H74NO8P 100 - 50 - 3.61 PE(PGJ2/P-18:0) 764.52 12.21 M+H-H2O C43H76NO9P 100 - 54.8 PE(20:5(5Z,8Z,11Z,14Z,16E)-OH(18)/P-18:0) 748.53 12.01 M+H-H2O C43H76NO8P 100 - 16.2 PE(18:3(9,11,15)-OH(13)/P-18:0) 724.53 12.15 M+H-H2O C41H76NO8P 100 - 49.4 PC(20:4(5Z,8Z,11Z,14Z)-OH(16R)/16:0) 780.55 11.58 M+H-H2O C44H80NO9P 100 - 51.3 - 17.3 - 1.96 PC(17:0/PGJ2) 848.54 11.98 M+H, M+Na C45H80NO10P 100 - 51.2 - 17.3 - 7 - 0.681 PC(18:3(6Z,9Z,12Z)/22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17)) 866.53 11.86 M+Na C48H78NO9P 100 - 49.2 - 37.1 - 22.6 - 13.7 PC(20:0/18:3(10,12,15)-OH(9)) 810.60 12.10 M+H-H2O C46H86NO9P 100 - 53.6 - 20.4 - 6.11 - 3.81 - 1.16 - 1.07 PC(PGJ2/P-18:0) 806.57 11.71 M+H-H2O C46H82NO9P 100 - 47.9 - 24.3 - 5.21 - 0.325 PC(P-18:1(11Z)/20:5(5Z,8Z,11Z,14Z,16E)-OH(18R)) 806.57 12.15 M+H, M+Na C46H80NO8P 100 - 54.9 DG(20:5(5Z,8Z,11Z,14Z,16E)-OH(18)/0:0/21:0) 723.55 11.51 M+Na C44H76O6 100 - 48.7 - 11.8 - 1.37 DG(i-20:0/PGF1alpha/0:0) 747.57 12.39 M+Na C43H80O8 100 - 55.2 - 18.7 LPC 16:0 496.34 8.51 M+H, M+Na C24H50NO7P 100 - 33.7 - 7.34 - 0.98 LPC 17:0-SN1 510.36 8.92 M+H, M+Na C25H52NO7P 100 - 32.5 - 5.05 LPC 18:0 524.37 9.31 M+H, M+Na C26H54NO7P 100 - 32.3 - 6.53 - 1.05 - 0.505 LPC 18:1 522.35 8.56 M+H, M+Na C26H52NO7P 100 - 41.4 - 10.5 - 2.08 LPC 18:1-SN1 522.36 8.72 M+H, M+Na C26H52NO7P 100 - 31.5 - 6.93 - 0.998 - 0.036 LPC 18:3 518.32 7.77 M+H, M+Na C26H48NO7P 100 - 30.4 - 5.06 - 1.8 LPC 20:0-SN1 552.40 10.04 M+H C28H58NO7P 100 - 31.3 - 13.3 - 1.35 LPC 38:6 792.59 11.93 M+H, M+Na C46H82NO7P 100 - 53.2 - 16.9 - 5.71 LPE 18:0 482.32 9.41 M+H C23H48NO7P 100 - 24.5 - 4.56 - 8.74 LPE 38:6 750.55 12.04 M+H C43H76NO7P 100 - 64.1 - 29.2 - 1.15 Oleanoic Acid 439.36 11.74 M+H-H2O C30H48O3 100 - 36.1 - 4.84 - 0.249 1-Oleoyl-rac-glycerol 339.29 12.50 M+H-H2O C21H40O4 100 - 24.8 PC 14:0_16:0 706.54 11.80 M+H, M+Na C38H76NO8P 100 - 42.1 - 9.51 - 1.95 - 0.324 - 0.18 - 0.337 PC 16:0_16:0 734.57 12.16 M+H C40H80NO8P 100 - 49.2 - 14.8 - 3.2 - 0.679 - 0.559 - 1.31 - 0.669 PC 18:3_18:3 778.54 11.31 M+H, M+Na C44H76NO8P 100 - 53.9 - 16.6 - 3.37 - 0.616 PC 30:1 704.52 11.45 M+H, M+Na C38H74NO8P 100 - 44.5 - 11 - 2.06 - 0.301 - 0.0567 PC 32:1 732.55 11.89 M+H-H2O, M+H, M+Na C40H78NO8P 100 - 48.3 - 13.6 - 2.71 - 0.478 - 0.0781 - 0.0389 - 0.00792 PC 32:2 730.54 11.56 M+H, M+Na C40H76NO8P 100 - 48.4 PC 32:3 728.52 11.33 M+H, M+Na C40H74NO8P 100 - 47.6 - 1.51 - 0.0749 PC 34:2 780.55 11.98 M+Na C42H80NO8P 100 - 51 PC 34:3 778.54 11.79 M+Na C42H78NO8P 100 - 50.8 - 37.5 - 16.4 PC 34:4 754.54 11.44 M+H, M+Na C42H76NO8P 100 - 48.6 PC 36:2 786.60 12.26 M+H, M+Na C44H84NO8P 100 - 51.1 - 13.8 - 2.53 - 0.402 - 0.123 PC 36:4 782.57 11.86 M+H, M+Na C44H80NO8P 100 - 54.7 - 17.7 - 4.22 PC 38:2 814.63 12.38 M+H, M+Na C46H88NO8P 100 - 55.2 - 68 - 34.7 PC 40:6_40:11 1373.06 12.38 M+H C88H142NO8P 100 - 94.9 - 67.1 - 36 - 18.2 - 7.48 PC 42:6_40:11 1401.09 12.38 M+H C90H146NO8P 100 - 75.7 - 40.4 - 11.5 PC O-30:0 692.56 12.05 M+H, M+Na C38H78NO7P 100 - 42.1 - 13.2 - 3.1 - 1.59 PE 16:0_16:1 690.51 12.00 M+H, M+Na C37H72NO8P 100 - 42.8 - 19.4 - 3.71 - 0.383 PE 16:0_18:1 718.54 12.27 M+H, M+Na C39H76NO8P 100 - 49 - 49.3 - 16.3 - 4.99 - 0.51 PE 16:1_18:1 716.53 12.07 M+H, M+Na C39H74NO8P 100 - 65.4 - 39.3 - 12.7 PE 17:2_17:2 712.49 11.56 M+H C39H70NO8P 100 - 34.9 PE 18:0_19:1 760.58 12.21 M+H-H2O, M+H C42H82NO8P 100 - 38.7 - 10.2 - 2.47 - 0.814 - 0.271 - 0.216 - 0.0898 PE 18:1_18:1 744.55 12.30 M+H, M+Na C41H78NO8P 100 - 51.7 - 51.5 - 5.25 - 0.347 PE 18:3_18:3 736.49 11.43 M+H, M+Na C41H70NO8P 100 - 47.3 - 12.8 - 2.73 PE O-15:0_19:1 704.56 12.36 M+H C39H78NO7P 100 - 47.6 - 15 - 2.36 - 0.228 PE O-15:0_21:1 732.59 12.45 M+H C41H82NO7P 100 - 50.2 - 16.2 - 4.06 PE O-18:4_18:3 720.50 11.65 M+H C41H70NO7P 100 - 51.5 - 28.6 PE O-19:1_20:1 772.62 12.42 M+H C44H86NO7P 100 - 76.5 PE O-28:4_7:0 712.53 11.55 M+H C40H74NO7P 100 - 41.9 PEtOH 16:1_16:1 690.50 11.67 M+NH4 C37H69O8P 100 - 6.47 PI 32:1 826.54 11.48 M+H, M+NH4 C41H77O13P 100 - 46.7 - 13 - 1.88 PI 34:1 854.58 11.76 M+H, M+NH4, M+Na C43H81O13P 100 - 48.7 - 17.8 - 7.74 - 0.591 PI 34:2 852.56 11.56 M+H, M+NH4, M+Na C43H79O13P 100 - 49.9 - 11.5 - 3.05 PI 34:3 850.55 11.36 M+H, M+NH4, M+Na C43H77O13P 100 - 46.7 - 28.6 - 8.11 PI 36:2 880.59 11.95 M+H, M+NH4, M+Na C45H83O13P 100 - 68.5 - 3.99 - 0.403 PI 36:3 878.58 11.74 M+H, M+NH4, M+Na C45H81O13P 100 - 54.8 - 32.4 - 15.7 - 3.39 PI 36:4 876.56 11.45 M+H, M+NH4, M+Na C45H79O13P 100 - 52.2 - 1.84 - 0.133 PI 36:6 872.53 10.87 M+H, M+NH4, M+Na C45H75O13P 100 - 56.2 - 16.6 - 3.53 PS 18:1_18:1 788.55 12.03 M+H C42H78NO10P 100 - 56.3 PS 18:1_18:2 786.53 11.74 M+H C42H76NO10P 100 - 53.5 - 36.2 - 11.5 PS 18:2_18:2 784.51 11.51 M+H, M+Na C42H74NO10P 100 - 49.3 - 15.3 - 2.07 SE 28:2/15:2 636.57 12.77 M+NH4, M+Na C43H70O2 100 - 54.4 - 2.87 SE 28:2/16:1 652.60 12.85 M+NH4, M+Na C44H74O2 100 - 59.8 - 21.8 - 6.54 - 1.8 - 0.823 SE 28:2/18:1 680.63 12.90 M+H, M+NH4, M+Na C46H78O2 100 - 56.3 - 27.4 - 8.86 SE 28:2/18:2 678.62 12.85 M+NH4 C46H76O2 100 - 59.5 SE 28:2/18:3 676.60 12.81 M+NH4, M+Na C46H74O2 100 - 58.9 SE 28:2/20:3 704.63 12.84 M+NH4 C48H78O2 100 - 60.1 - 26.5 - 31.6 SE 29:2/16:1 666.62 12.88 M+NH4, M+Na C45H76O2 100 - 54.6 - 56.1 - 25.1 - 8.97 - 2.59 SM 14:1;2O/17:0 661.53 11.88 M+H, M+Na C36H73N2O6P 100 - 42.7 - 10.4 - 2.55 SM 14:1;2O/18:0 675.54 11.33 M+H, M+Na C37H75N2O6P 100 - 41.7 - 9.03 - 1.25 SM 14:1;2O/20:0 703.57 11.81 M+H, M+Na C39H79N2O6P 100 - 49.7 - 13.9 - 1.47 - 0.0572 SM 34:0;2O 705.59 11.94 M+H, M+Na C39H81N2O6P 100 - 45.4 - 10.6 - 2.73 - 0.33 SM 36:1;2O 731.61 12.17 M+H, M+Na C41H83N2O6P 100 - 52 - 21.4 - 1.27 SM 38:1;2O 759.64 12.34 M+H, M+Na C43H87N2O6P 100 - 54.7 - 27.9 SPB 14:0;2O 268.23 6.42 M+H, M+Na C14H31NO2 100 - 19 - 1.86 SPB 14:1;2O 266.21 6.13 M+H-H2O, M+H, M+Na C14H29NO2 100 - 18 - 1.29 SPB 16:1;2O 294.24 7.18 M+H-H2O, M+H, M+Na C16H33NO2 100 - 23.3 Stearoyl-L-Carnitine 428.37 9.09 M+H C25H49NO4 100 - 25.9 - 10.6 TG 14:0_14:1_16:1 764.68 12.67 M+NH4 C47H86O6 100 - 55.5 TG 14:1_16:0_16:1 792.71 12.71 M+NH4 C49H90O6 100 - 56.6 - 66.3 - 32.5 TG 14:1_16:1_16:1 790.69 12.67 M+NH4 C49H88O6 100 - 59 TG 16:0_16:1_16:1 820.74 12.75 M+NH4, M+Na C51H94O6 100 - 58.6 - 49 - 22.2 TG 16:0_16:1_18:1 848.77 12.78 M+NH4, M+Na C53H98O6 100 - 56.6 - 50.5 - 25.4 - 10.2 TG 16:0_16:1_18:3 844.74 12.72 M+NH4, M+Na C53H94O6 100 - 75.9 TG 16:0_18:0_18:0 880.83 12.68 M+NH4 C55H106O6 100 - 59.5 - 31.3 - 11.4 TG 16:0_18:2_18:4 868.74 12.69 M+NH4, M+Na C55H94O6 100 - 59.2 TG 16:1_18:1_18:3 870.75 12.72 M+NH4, M+Na C55H96O6 100 - 60.3 TG 18:0_18:0_18:1 906.85 12.86 M+NH4 C57H108O6 100 - 54.1 - 18.7 - 7.18 TG 18:0_19:1_21:1 960.90 12.82 M+NH4 C61H114O6 100 - 62.7 - 41.5 - 20 - 11.6 TG 18:1_18:1_18:3 898.78 12.76 M+NH4, M+Na C57H100O6 100 - 63 - 9.07 - 3.13 TG 18:1_18:1_20:1 930.85 12.86 M+NH4, M+Na C59H108O6 100 - 72.7 - 5.9 TG 18:1_18:1_32:1 1099.04 13.16 M+NH4 C71H132O6 100 - 68.2 - 49.8 - 25.9 - 17.5 - 8.83 - 5.2 TG 18:1_18:1_34:1 1127.07 13.22 M+NH4 C73H136O6 100 - 64.4 - 41.4 TG 18:1_18:2_19:0 916.83 12.75 M+NH4 C58H106O6 100 - 70.1 TG 18:1_18:3_18:3 894.75 12.69 M+NH4 C57H96O6 100 - 67.6 TG 18:1_25:0_26:2 1113.05 13.20 M+NH4 C72H134O6 100 - 56.7 - 29.8 - 14.3 TG 18:3_18:3_18:3 890.73 12.63 M+NH4, M+Na C57H92O6 100 - 58.6 - 84.8 - 63.3 TG 22:6_23:0_26:7 1120.93 12.78 M+NH4 C74H118O6 100 - 81.7 - 53.2 - 27 - 14 TG O-14:0_16:0_18:1 808.77 12.85 M+NH4, M+Na C51H98O5 100 - 56.7 - 30.3 - 12.2 - 2.55 TG O-16:0_16:1_18:1 834.79 12.85 M+H, M+NH4, M+Na C53H100O5 100 - 61.2 - 93.2 - 52.2 - 19.7 TG O-18:0_16:1_18:1 862.82 12.90 M+H, M+NH4, M+Na C55H104O5 100 - 58.4 - 71.9 - 38.6 - 14.5 - 3.38 TG O-18:0_18:1_18:1 890.85 12.94 M+NH4 C57H108O5 100 - 57.5 - 43 - 22.2 - 7.17 - 1.81 TG O-20:0_18:1_18:4 895.81 12.95 M+H, M+NH4 C59H106O5 100 - 58.2 - 58 - 13.9 - 3.09 TG O-20:0_18:1_20:1 946.91 13.04 M+H, M+NH4, M+Na C61H116O5 100 - 63.4 - 53.7 - 27.3 - 11.7 - 0.285 - 0.256 - 0.0934 TG O-22:0_18:1_18:1 946.91 12.90 M+NH4 C61H116O5 100 - 69.6 - 78.1 - 43.7 - 16.8 - 5 - 1.51 - 0.457 Triacylglycerol 18:2-18:2-18:2 896.77 12.72 M+NH4 C57H98O6 100 - 68.1 METABOLITES_END #END