#METABOLOMICS WORKBENCH Lxu_20240905_024222 DATATRACK_ID:5168 STUDY_ID:ST003464 ANALYSIS_ID:AN005693 PROJECT_ID:PR002122 VERSION 1 CREATED_ON September 5, 2024, 6:55 pm #PROJECT PR:PROJECT_TITLE Early Metabolic Shifts in the Sepsis: Insights from Presymptomatic Patients and PR:PROJECT_TITLE In Vivo Models. PR:PROJECT_SUMMARY Metabolomics of human serum to support understanding of early metabolic shift in PR:PROJECT_SUMMARY presymptomatic sepsis patients and further confirmed in in vivo model. PR:INSTITUTE Leibniz Institute for Natural Product Research and Infection Biology Hans Knöll PR:INSTITUTE Institute PR:DEPARTMENT Microbiome Dynamics PR:LAST_NAME XU PR:FIRST_NAME LINLIN PR:ADDRESS Beutenbergstraße 11a, Jena, Thuringia, 07745, Germany PR:EMAIL Lin-Lin.Xu@hki-jena.de PR:PHONE +4936415321265 #STUDY ST:STUDY_TITLE Lipidomics of mice heart to support understanding of early metabolic shift in ST:STUDY_TITLE presymptomatic sepsis patients. (Part9 mice heart lipid) ST:STUDY_SUMMARY Sepsis, a life-threatening organ dysfunction caused by a dysregulated response ST:STUDY_SUMMARY to infection, is a critical medical condition with significant global impact, ST:STUDY_SUMMARY responsible for 48.9 million cases and 11 million deaths annually. Metabolic ST:STUDY_SUMMARY dysregulation in sepsis is a critical determinant of disease outcome, yet most ST:STUDY_SUMMARY studies focus on patients after severe illness onset, comparing septic versus ST:STUDY_SUMMARY non-septic groups or survivors versus non-survivors. To truly understand this ST:STUDY_SUMMARY complex disease, it is essential to investigate early metabolic shifts, ST:STUDY_SUMMARY capturing the transition from simple infection to sepsis. Our untargeted ST:STUDY_SUMMARY lipidome analysis of heart from mice model revealed early septic biomarkers in ST:STUDY_SUMMARY heart. ST:INSTITUTE Leibniz Institute for Natural Product Research and Infection Biology Hans Knöll ST:INSTITUTE Institute ST:DEPARTMENT Microbiome Dynamics ST:LAST_NAME XU ST:FIRST_NAME LINLIN ST:ADDRESS Beutenbergstraße 11a, Jena, Thuringia, 07745, Germany ST:EMAIL Lin-Lin.Xu@hki-jena.de ST:PHONE +4936415321265 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENDER Not applicable #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 Bl6J_23_0194 SA020913 Sample source:Heart | Group:Sham / 13C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-027-SA020913_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-027-SA020913_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0269 SA020994 Sample source:Heart | Group:Sham / 12C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-022-SA020994_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-022-SA020994_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0203 SA020966 Sample source:Heart | Group:Sham / 13C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-025-SA020966_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-025-SA020966_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0267 SA020980 Sample source:Heart | Group:CLP (24h) / 12C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-029-SA020980_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-029-SA020980_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0201 SA020952 Sample source:Heart | Group:Sham / Vehicle RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-021-SA020952_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-021-SA020952_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0271 SA021008 Sample source:Heart | Group:Sham / 12C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-019-SA021008_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-019-SA021008_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0199 SA020938 Sample source:Heart | Group:CLP (24h) / 13C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-020-SA020938_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-020-SA020938_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0273 SA021022 Sample source:Heart | Group:CLP (24h) / 12C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-017-SA021022_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-017-SA021022_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0274 SA021029 Sample source:Heart | Group:CLP (24h) / 12C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-013-SA021029_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-013-SA021029_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0268 SA020987 Sample source:Heart | Group:CLP (24h) / 12C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-031-SA020987_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-031-SA020987_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0197 SA020927 Sample source:Heart | Group:CLP (24h) / Vehicle RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-018-SA020927_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-018-SA020927_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0204 SA020973 Sample source:Heart | Group:CLP (24h) / Vehicle RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-024-SA020973_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-024-SA020973_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0202 SA020959 Sample source:Heart | Group:Sham / 13C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-026-SA020959_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-026-SA020959_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0198 SA020932 Sample source:Heart | Group:Sham / Vehicle RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-033-SA020932_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-033-SA020932_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0200 SA020945 Sample source:Heart | Group:CLP (24h) / 13C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-028-SA020945_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-028-SA020945_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0190 SA020892 Sample source:Heart | Group:CLP (24h) / 13C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-032-SA020892_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-032-SA020892_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0272 SA021015 Sample source:Heart | Group:Sham / 12C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-015-SA021015_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-015-SA021015_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0192 SA020899 Sample source:Heart | Group:CLP (24h) / Vehicle RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-010-SA020899_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-010-SA020899_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0189 SA020885 Sample source:Heart | Group:CLP (24h) / 13C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-034-SA020885_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-034-SA020885_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0193 SA020906 Sample source:Heart | Group:Sham / 13C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-012-SA020906_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-012-SA020906_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0270 SA021001 Sample source:Heart | Group:Sham / 12C-Serin RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-011-SA021001_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-011-SA021001_pos.mzML SUBJECT_SAMPLE_FACTORS Bl6J_23_0196 SA020920 Sample source:Heart | Group:Sham / Vehicle RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-014-SA020920_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-014-SA020920_pos.mzML SUBJECT_SAMPLE_FACTORS NA Blank_PB Sample source:blank | Group:Blank RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-045-Blank_PB_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-045-Blank_PB_pos.mzML SUBJECT_SAMPLE_FACTORS NA Blank_004 Sample source:blank | Group:Blank RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-044-Blank_004_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-044-Blank_004_pos.mzML SUBJECT_SAMPLE_FACTORS NA QC_001 Sample source:Heart | Group:QC RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-006-QC_001_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-006-QC_001_pos.mzML SUBJECT_SAMPLE_FACTORS NA QC_005 Sample source:Heart | Group:QC RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-016-QC_005_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-016-QC_005_pos.mzML SUBJECT_SAMPLE_FACTORS NA Blank_001 Sample source:blank | Group:Blank RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-003-Blank_001_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-003-Blank_001_pos.mzML SUBJECT_SAMPLE_FACTORS NA QC_007 Sample source:Heart | Group:QC RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-030-QC_007_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-030-QC_007_pos.mzML SUBJECT_SAMPLE_FACTORS NA Blank_002 Sample source:blank | Group:Blank RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-005-Blank_002_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-005-Blank_002_pos.mzML SUBJECT_SAMPLE_FACTORS NA Blank_003 Sample source:blank | Group:Blank RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-039-Blank_003_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-039-Blank_003_pos.mzML SUBJECT_SAMPLE_FACTORS NA QC_006 Sample source:Heart | Group:QC RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-023-QC_006_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-023-QC_006_pos.mzML SUBJECT_SAMPLE_FACTORS NA QC_008 Sample source:Heart | Group:QC RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-035-QC_008_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-035-QC_008_pos.mzML SUBJECT_SAMPLE_FACTORS NA QC_004 Sample source:Heart | Group:QC RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-009-QC_004_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-009-QC_004_pos.mzML SUBJECT_SAMPLE_FACTORS NA QC_009 Sample source:Heart | Group:QC RAW_FILE_NAME(Raw file name negative ion)=230704-EXP-PAN-1-041-QC_009_neg.mzML; RAW_FILE_NAME(Raw file name positive ion)=230704-EXP-PAN-1-041-QC_009_pos.mzML #COLLECTION CO:COLLECTION_SUMMARY Mice tissue samples were collected from our in vivo mice model and frozen at -80 CO:COLLECTION_SUMMARY °C. Samples were shipped to MS-OMICS for metabolomic analysis. CO:SAMPLE_TYPE Heart #TREATMENT TR:TREATMENT_SUMMARY Approximately 30% of the cecum was ligated and punctured twice with a 23 Gauge TR:TREATMENT_SUMMARY (G) needle. A small amount of faeces was extruded and the cecum was placed back TR:TREATMENT_SUMMARY into the abdominal cavity. All animals received 40 mL/kg saline s.c. directly TR:TREATMENT_SUMMARY after the procedure and once 25mg/kg s.c. Imipenem/Cilastatin after 6 hours. TR:TREATMENT_SUMMARY This model is associated with a 14-day mortality of 30%, closely mimicking the TR:TREATMENT_SUMMARY clinical situation. Animals were orally gavaged with 500mg/kg 12C-Serin (Sigma) TR:TREATMENT_SUMMARY or 13C-Serin (CLM-1574-H-0.25 Serine-L (13C3 99%13C), Euroisotope, Germany) in TR:TREATMENT_SUMMARY 10mL/kg drinking water or drinking water only (vehicle) 6 and 18 hours after TR:TREATMENT_SUMMARY CLP98,99. After 24 hours, the animals are then perfused with ice cold PBS and TR:TREATMENT_SUMMARY organs were harvested, snap frozen and stored at -80° until further analysis. TR:TREATMENT_SUMMARY Sham animals underwent exactly to the same procedures except for the CLP. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY In the different tissue samples, the pellet from the semipolar extraction were SP:SAMPLEPREP_SUMMARY used to extract lipids as follows. DCM:MeOH (3:1) were added to the pellets, and SP:SAMPLEPREP_SUMMARY the samples were homogenized using a pre-cooled Bead-beater (4 x 60 sec at 30 SP:SAMPLEPREP_SUMMARY Hz), with colling of the blocks between the beading cycles. Subsequently, the SP:SAMPLEPREP_SUMMARY samples were ultrasonicate for 5 mins and centrifuged (5 mins, 1800 RCF, 4 °C). SP:SAMPLEPREP_SUMMARY The supernatant were collected and dried under nitrogen gas. Samples were then SP:SAMPLEPREP_SUMMARY reconstitute with 6x (spleen and WAT) or 3x (heart, liver and kidney) the sample SP:SAMPLEPREP_SUMMARY weight with the reconstitution solvent eluent mix and vortex mixed for 30 sec. SP:SAMPLEPREP_SUMMARY The reconstituted samples were filtrated using SpinX filters by centrifugation SP:SAMPLEPREP_SUMMARY (5 mins, 1800 RCF, 4 °C). All samples were mixed 1: 50 in eluent mix. For serum SP:SAMPLEPREP_SUMMARY samples, an alliqoute of the serum samples are mixed with extraction solvent SP:SAMPLEPREP_SUMMARY (0.1 M BHT in isopropanol with stable isotope labelled internal standard) in a SP:SAMPLEPREP_SUMMARY Spin-X® filter. The filters were vortex-mixed for 60 sec and left at room SP:SAMPLEPREP_SUMMARY temperature for 10 mins before placing in -20 °C Freezer overnight. The SP:SAMPLEPREP_SUMMARY following day samples were left at room temperature for 30 mins before SP:SAMPLEPREP_SUMMARY centrifuging (1800g /4°C/2 min). The filtrate were mixed with eluent mix 1:3. #CHROMATOGRAPHY 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 60% Acetonitrile/40% water; 10 mM ammonium formate; 0.1% formic acid CH:SOLVENT_B 90% Isopropanol/10% acetonitrile; 10 mM ammonium formate; 0.1% formic acid CH:FLOW_GRADIENT 0-2 min: 40 % B, 2.1 min 50% B, 12 min 54% B, 12.1 min 70% B, 18-20 min 99 % B, CH:FLOW_GRADIENT 20.1-22 min 40% B CH:FLOW_RATE 0.4mL/min CH:COLUMN_TEMPERATURE 55 CH:METHODS_FILENAME Doneanu_etal.pdf #ANALYSIS AN:ANALYSIS_TYPE MS AN:LABORATORY_NAME MS-Omics, Denmark AN:ANALYSIS_PROTOCOL_FILE Doneanu_etal.pdf #MS MS:INSTRUMENT_NAME Orbitrap Exploris 240 MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:MS_COMMENTS Peak areas were extracted using Compound Discoverer 3.2 (Thermo Scientific) and MS:MS_COMMENTS Skyline 21 (MacCoss Lab Software) . Compound annotations were performed against MS:MS_COMMENTS the mzCloud (Thermo Scientific) MSMS library, the Human Metabolome Database 4.0 MS:MS_COMMENTS , and the MS-Omics lipid library covering 17 classes (CerP, DG, DGDG, Fatty MS:MS_COMMENTS acids, LysoPC, LysoPE, MG, PA, PC, PE, PG, PI, Plasmenyl-PC, Plasmenyl-PE, PS, MS:MS_COMMENTS SM and TG). Identification of compounds were performed at four levels; Level 1: MS:MS_COMMENTS identification by retention times (compared against in-house authentic MS:MS_COMMENTS standards), accurate mass (with an accepted deviation of 3 ppm), and MS/MS MS:MS_COMMENTS spectra, Level 2a: identification by retention times (compared against in-house MS:MS_COMMENTS authentic standards and lipid class behaviour), accurate mass (with an accepted MS:MS_COMMENTS deviation of 3ppm). Level 2b: identification by accurate mass (with an accepted MS:MS_COMMENTS deviation of 3 ppm), and MS/MS spectra, Level 3: identification by accurate mass MS:MS_COMMENTS alone (with an accepted deviation of 3 ppm). Lipid annotations were curated MS:MS_COMMENTS manually by comparing retention time behaviour over the number of tail chain MS:MS_COMMENTS carbons and double bonds as annotated. The data have been normalized to the QC MS:MS_COMMENTS samples to remove systematic drift over the analysis sequence. The normalization MS:MS_COMMENTS is performed using linear regression for the QC’s within each analytical batch MS:MS_COMMENTS with signal = a*injection number – b. Each value is then normalized with: MS:MS_COMMENTS normSignal = average(all QC samples)*(signal – injection number*a)/b. This is MS:MS_COMMENTS done independently for each compound. MS:MS_RESULTS_FILE ST003464_AN005693_Results.txt UNITS:Normalized peak area Has m/z:Neutral masses Has RT:Yes RT units:Minutes #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Normalized peak area MS_METABOLITE_DATA_START Samples SA020885 SA020892 SA020899 SA020906 SA020913 SA020920 SA020927 SA020932 SA020938 SA020945 SA020952 SA020959 SA020966 SA020973 SA020980 SA020987 SA020994 SA021001 SA021008 SA021015 SA021022 SA021029 Factors Sample source:Heart | Group:CLP (24h) / 13C-Serin Sample source:Heart | Group:CLP (24h) / 13C-Serin Sample source:Heart | Group:CLP (24h) / Vehicle Sample source:Heart | Group:Sham / 13C-Serin Sample source:Heart | Group:Sham / 13C-Serin Sample source:Heart | Group:Sham / Vehicle Sample source:Heart | Group:CLP (24h) / Vehicle Sample source:Heart | Group:Sham / Vehicle Sample source:Heart | Group:CLP (24h) / 13C-Serin Sample source:Heart | Group:CLP (24h) / 13C-Serin Sample source:Heart | Group:Sham / Vehicle Sample source:Heart | Group:Sham / 13C-Serin Sample source:Heart | Group:Sham / 13C-Serin Sample source:Heart | Group:CLP (24h) / Vehicle Sample source:Heart | Group:CLP (24h) / 12C-Serin Sample source:Heart | Group:CLP (24h) / 12C-Serin Sample source:Heart | Group:Sham / 12C-Serin Sample source:Heart | Group:Sham / 12C-Serin Sample source:Heart | Group:Sham / 12C-Serin Sample source:Heart | Group:Sham / 12C-Serin Sample source:Heart | Group:CLP (24h) / 12C-Serin Sample source:Heart | Group:CLP (24h) / 12C-Serin DG 41:0 479302.620934974 880091.423525353 581102.521959115 512984.716946416 627223.445293157 361998.649066945 827088.585578262 521815.55406263 420202.645800905 647397.513156947 459618.365617503 476074.750282051 561995.971062229 495101.321547939 535283.538087872 662118.368270815 658340.753856246 1073774.1682701 838450.77425852 556338.969584193 837831.989048071 497322.155094232 DG 34:1_1 6194618.86333332 1974657.4100966 4059644.56030722 14540774.558912 18754103.0661753 5398559.45097006 9469081.24100884 36812554.4603577 2514286.98922063 7115469.85780389 10068953.5729144 21706528.2732386 4601074.73192427 11748361.7113753 54480671.0952833 73527369.3444681 29815411.61967 8755487.97201898 28877150.3836061 11441501.7002668 49829497.7530733 31394494.7025705 DG 34:1_2 79951812.9980598 45868338.4862246 49779060.4738353 91392900.6012518 114567931.89366 44369799.2386289 82479642.1075037 165410795.685678 49848124.8690026 69391314.9208552 85420484.9730528 137929641.20602 75323791.8914338 88228616.7704422 216802264.893755 273974224.236643 168180564.110215 67228748.9212248 148541033.496979 72087276.4978454 190476623.835659 147485451.983625 DG 36:1 3751796.98305975 1625737.84037626 2342572.64988635 7297973.42079662 5698199.03164463 2153055.19068233 3402673.88555909 8871785.37982991 2087177.53721779 3179768.96154674 4071762.32280419 4851663.51798554 1866840.04445459 4445533.67898399 8703380.8361904 10740912.4381435 6074579.30377871 3245591.34954443 7055286.254897 3419976.1933063 10021309.8333148 7717834.76246667 DG 36:2 107508304.212951 79625213.9129424 61891162.6133941 138156050.221669 185600715.731613 57078038.3917191 100565039.832736 276433114.811454 86378529.2793356 87835015.9212091 102870735.847553 175439929.530706 103475805.691067 121901173.300635 356947445.11428 432036375.027297 188133465.767907 77409217.7797075 168051825.450175 84437354.3974322 319409272.612432 184852770.076678 LPC 15:0 1100344.91086127 933654.179941277 1077394.19376558 1002571.70116476 1188455.62751899 849484.526475138 1310838.10641514 1508281.82583441 932929.139775498 1139712.79521744 1395276.71717344 1120427.26820492 1040541.17942516 733177.781277 1271164.40766118 1552323.29424359 1615500.78432232 1261778.72777229 2322847.71809602 933358.956764836 1676958.97680029 1248144.29671959 PC 42:1 614366.448094257 321655.811003593 286949.020877027 484562.879866585 275680.716391531 70502.8430600944 424350.234559787 508795.543375428 693454.706645681 178835.913262039 730214.570924297 514449.726580913 190113.444805062 180095.213973657 288024.328323786 4990672.85449628 3129547.49231926 863722.980232648 3487475.72263411 770287.941684304 2467182.42690536 203563.081289515 PC O 38:3 12106436.0524352 9854191.19516948 6631289.70997042 5218717.33766222 8063024.08405318 3192889.0025554 10373382.8331335 9254906.21639114 6558823.09063378 7812841.01004406 2840087.94711711 5402827.27070846 8821343.13173776 7558471.55283045 6334755.064682 3403134.7100598402 8098446.17362841 7088559.38195304 6350096.20338279 3209815.07282306 6278716.21026425 8468036.63160617 PC O 38:5 37147227.8712143 42579446.5992762 32850520.2018706 21012962.5344184 41431729.2567461 14249231.0087809 26671460.5500741 21283762.9150098 4520913.86148431 31446609.1740604 15550567.413616 22201872.392751 21981019.4311912 17090501.5097345 30185446.7589338 24331828.18464 21084772.8063768 28592333.2127938 25883650.8728393 6047500.58566233 26675437.746022 20913015.5775757 DG 38:2 2836201.88714853 204161.862166951 1225515.96212874 9334088.74785061 4568573.89031974 2072579.41624098 2260498.46733881 8107412.10032945 423012.449873705 1842714.11041713 3512450.15338713 2774788.63258063 2396059.71719709 3434261.97288267 6813333.15774128 7981474.80545716 4696957.36291807 2136922.34191462 5585325.93178176 2579680.71024451 9076792.20563144 6236867.55035068 DG 38:3 3890094.15377026 374235.49285726 2179102.10457048 10597550.3276541 6949053.14538705 3718484.55430956 5013976.74053184 13198240.2924923 761068.937492327 3075788.49122521 4951732.97912288 4096125.43915606 4719854.47234986 4233334.62706912 12020953.7716508 16279942.9276974 8309686.0683154 3799121.56195957 9969695.1666843 3721985.67320573 14142560.9334778 8435201.87310545 DG 40:3 391503.705061896 3335.2869291031448 108532.769797389 1684727.35924521 650751.872219594 538245.19591393 466330.26225095 1570307.35801191 1141.1469418778547 290217.273494779 724301.471688543 324280.136829593 403918.188803889 309023.659945643 709169.068192874 1066933.26557876 858172.237085895 353879.832886476 1311072.89343253 454911.744197203 723023.711150403 697506.094380187 DG 40:4 20913551.4715616 11062977.0947356 12341767.5283576 16311403.5901475 17303794.2442036 8607894.42503849 15949222.7163772 19564252.8657852 13711353.1394895 15959725.3210116 17548141.2562154 23798874.3886151 15136343.0555918 18290085.6185084 17929324.8490594 23996420.0641637 30571915.6784822 12079749.3402138 20859696.7959457 12216738.1770622 14619029.7691442 14635659.4809149 DG 42:6 16794098.2950356 59759928.2782756 29595938.4115237 2530451.12853584 34606917.7666096 16288625.5113988 45249663.5477337 28501138.7657598 17236643.5550163 15973792.7794344 4717323.42171115 22746746.371434 36301108.7740725 16426848.5748238 5246804.68209653 4957534.373959 10438187.5703152 12170424.1674959 4735877.31690872 3409706.23367418 2906608.23411981 2649963.06738758 DG 42:7 1686981.97744721 608636.068149662 1423200.34939851 4821689.80304196 8311659.44808976 300197.126571113 3139659.22557587 11887031.1447726 540604.870235996 4886071.72220905 3964772.66450542 1958803.80181877 1529835.02083693 1883444.08978279 7020455.72380471 8533855.46938347 2341574.42146766 3582330.90239454 4984923.39634077 1524446.57268522 6895042.00678746 2217683.82935952 PE 23:5 676743.181764803 476717.562618034 812844.807809234 497060.060059435 254475.28900741 515599.047454423 725512.784635245 455493.450321599 370968.212790949 444758.922581916 588924.390959294 905487.879852669 775479.631242605 438634.825949794 480900.540653181 843201.187899054 549364.953546054 764316.375346455 471869.367168327 772589.395675189 475445.915519084 798532.076547702 PE 26:6 16472583.1444488 16650274.4559278 19867207.524867 14281271.5471073 16637465.8090171 11677737.3683994 22036527.6812139 20752197.6371998 14176637.2760556 18571376.0245475 14719650.20421 19038890.0438491 20365782.1731915 13431997.1953688 13589169.9772691 19719232.0407898 15572402.055709 13912203.2897152 16708343.1042848 10026946.0476859 15511462.8736411 13899294.085666 LPC 18:1 109397806.491458 65503328.8749545 60381093.516106 88294675.6729891 96612170.4904483 59535453.2701224 117060288.998619 140926517.174648 52374354.8801565 94844130.8477719 112122209.493734 160002604.855901 73725716.2788119 89440449.8340965 146555653.312171 158957403.950054 227570082.130088 69131304.8438461 158425510.279051 79497582.7841003 183290045.102541 252469409.562113 LPC 20:1 2091004.91841057 1465973.68106395 1581989.27822943 1372143.98442932 1515264.94614293 1209254.53607183 2039507.97789727 2076762.16636643 1113709.87322973 1685069.26053121 1556919.03116503 2236776.09610863 2204060.2914712 1293519.0688536 2538329.46628143 3182213.71552638 3354323.37393371 2048938.64018595 2942517.5734184 1499116.19340888 3417146.50262378 3905696.20812671 LPC 20:4 458576050.002426 272970167.314595 335415923.715341 351181884.513235 735795093.676903 200880924.913761 635896342.792102 802498255.717239 227700041.787243 559103559.415079 493588662.369401 667659173.291537 406198683.265012 437629992.099313 727918452.464435 843231590.4372 832582557.343262 380169455.074934 747819239.694197 310121516.483572 1038465176.89328 1082006432.70545 PE O 36:2 5150953.68671078 9168192.29131063 4583531.19777642 8452432.4369042 9183398.51210733 5323131.27721676 7130575.4199193 7543460.49592505 3860252.43631359 3537622.32951488 2914374.44917161 6811369.25777169 10158291.3513107 4039378.56647295 1487659.3485425 1663508.79096906 2206286.063653 5491620.36525742 3955268.68274541 3121659.47314333 1771947.26642158 801965.720016058 PE O 38:4_2 627807.522709057 3051940.31067459 1679774.53811786 2980044.61240532 3265714.64436215 2063323.49159284 2649728.07029379 3236989.41382983 1851668.37374751 1960566.29570568 2216757.40794105 2941700.27337273 3257641.39930016 2563501.75955925 1631123.2139768 1906070.56214704 2703908.46082337 2972879.82747376 2605823.97751385 1780422.46712947 1663272.7211951 1506280.94728635 PE O 40:6 41809202.1759164 36388266.6358201 22141420.4516143 36305799.8141444 36082838.0556165 19568360.7153364 29488359.7799923 25150956.1598464 25275196.5096368 13765789.8645751 22987365.4010941 27694723.5635343 29142976.0210935 21644207.128813 20616570.7304842 21013628.0429813 35316201.0954169 31431594.7398651 30007814.7993649 22194013.8308823 14689193.7572164 25431676.2314741 Cer 17:1;2O/16:0 18277612.5556637 11978993.2451147 12886757.1517198 14629359.6415221 13895329.3812952 5110599.90935635 14274005.6143256 16946299.8029927 10403808.1897202 18122421.6032536 11937800.4515436 16108739.3500406 11641799.3466526 15256139.7044287 13317239.137434 14685653.444918 13135280.4966457 9063774.99314206 14474902.2025094 8465719.93078297 17460271.6271816 16232214.6231417 Cer 17:1;2O/18:0 8080973.6652499 6351884.30451179 6380379.70661475 4781105.35055519 7003973.5208552 1591343.33408924 9630665.80911861 7950521.77824716 4384771.28004976 7603078.14976707 4260899.03692556 7986982.17289916 6284487.81449193 5297841.48513419 5902750.09819946 7443022.89508405 7239937.32431276 4221232.79664715 8020797.93774956 4099772.45071193 8130298.93861004 9661700.93071798 Cer 18:0;2O/16:0 7437076.03203233 5612934.4751184 6160013.92060664 4765483.31023846 5590111.90649919 2689379.53389324 7789860.00735106 8179579.01890706 5135406.28744407 8120169.31300789 4546204.97182508 6816282.68504272 5558642.19547623 6149634.56584766 5666334.40084381 7291514.55273293 7539399.26861677 5126616.96852782 7120959.70404612 3414111.63125125 6899847.72794359 7873660.86599879 Cer 18:0;2O/24:1 3683005.97726678 3260198.98755242 2710926.67617232 2541410.34895786 1807639.08600526 1241991.87734511 3605717.76367932 2770269.17589764 3045850.12978937 3997972.07063194 1950008.43568957 2461474.65333605 2623244.39194089 3677975.31129549 2213721.60527397 3085288.10290226 2887156.3998663 3314220.69663059 2952845.29328137 2326136.35300609 2867339.27465225 3776993.55829599 Cer 18:1;2O/16:0 256654505.19029 238684369.972624 279054272.303815 205752754.931631 200159443.56377 129781659.933753 278462755.718869 278921529.525379 235342866.936661 305216491.915886 221965396.822122 285212671.766245 228018264.228562 233357792.492973 238711990.621293 291674085.71837 271419964.288317 192817254.473715 273984647.156657 195146110.816586 267347565.721496 291255742.081763 Cer 18:1;2O/18:0 50499256.9748865 37843799.1872162 45663324.9474207 36520916.3660901 47165043.1344892 19380031.4720306 55212409.7345435 50611317.1907972 39578861.8043048 53498476.6302098 36843456.8502619 57409642.639091 46801176.8859379 46485641.0053244 47505049.7643873 50324448.959365 49800648.5740299 33043428.3996259 51093259.0539213 29360148.5037304 51598696.3660552 73689883.5673456 Cer 18:1;2O/20:0 147045235.070626 108587744.325041 128860648.639267 122765042.563554 106001027.048551 76163721.013796 134503993.316742 148223422.454431 112386333.565767 146476326.633002 117806925.668693 134933864.70844 126748762.197852 122616573.133041 151380135.051053 145838468.366861 184023470.790808 155015905.599882 206510251.602389 111459874.090725 178265192.678632 186233699.114506 Cer 18:1;2O/21:0 28916085.4862362 21613520.5708913 20006525.7422072 23562242.969911 19657667.0896651 12926180.5479929 19374497.0772358 25288843.5588519 18569533.0398288 24014349.7709177 24406325.1117248 24593960.781716 21004387.5787872 21795674.1129677 28066487.7107383 27993776.8448042 36541238.3759846 30351117.2189142 41852597.4593189 23309519.1060211 34973003.7959079 31148112.0340131 Cer 18:1;2O/22:0 80347076.2745796 63013045.46328 68245956.875525 71344863.2810996 63313260.7396433 48619342.3647704 73427177.287129 85057878.8611918 74205796.3178091 74313231.6662812 71635331.6704816 76064551.9173364 84278713.3352388 70883723.283514 86192043.0886853 81749784.0524812 111548868.364155 106908939.799682 142794268.393497 84676138.2148217 97508896.8324863 112061592.429391 Cer 18:1;2O/23:0 22768921.7667851 19177292.5296656 19413960.4759449 22411749.4495901 23374674.5017264 14710743.6484519 19380250.2624332 26721959.753154 22158332.9673461 23681446.8810217 25211744.8403587 22882203.5536092 26742528.7578884 22030233.04189 25030695.0707396 18648060.1414836 30957785.8230693 34523320.9995337 48624384.0670306 27519165.1810268 28240009.0040405 29977169.0512268 Cer 18:1;2O/24:0 18047297.7867537 18744522.0133297 17151392.3635767 16106652.1238234 17899758.3448365 12210088.5859484 19148032.5823676 19413007.5204708 24281458.504095 19384691.8419493 20207659.5793351 22169899.5895872 22985355.5201896 20116208.7035867 19393313.5364789 20981708.3750431 32659681.911741 31712261.349025 38531238.2328719 28361919.936573 20825716.8103068 23925959.2313543 Cer 18:1;2O/24:1 155583181.518635 151478395.807217 136029521.381542 133727883.441571 127408012.790763 67992265.4909438 173232279.526071 146885803.789413 136407938.46562 163275332.660692 106485667.928395 160205899.744999 139091776.147193 141782164.006679 133872369.784111 151237084.373738 155867042.035284 122985391.77145 171556868.132548 116580645.652993 158752828.230194 182980979.375045 Cer 18:2;2O/16:0 15012539.4541728 23980172.5527543 21885078.2346699 13535154.1573421 12841902.6373603 10950554.0662647 18835478.7431535 18098683.024888 19498353.5687817 22226545.6052814 11952686.5953393 16477052.4584013 19220366.343919 22174304.9470668 14451847.2733738 15122620.3345139 12596495.0856392 10975921.6159712 12799275.8640672 12406497.1024082 19125863.9459969 19338991.7670761 Cer 18:2;2O/18:0 22580717.2238224 26666404.2519706 35140823.7548279 21511779.864368 22542649.7542234 11885473.9731457 38037253.758164 30631116.1900667 26523160.0512086 42508737.206916 26059770.5232942 35304708.7863305 27449717.3116755 27521694.5972267 27425492.6186002 30053064.2502969 32055751.6594949 20273480.8720676 27782517.3695452 16454225.2300602 38545979.682793 40307949.7552489 Cer 18:2;2O/19:0 5907383.98980411 3538936.62390613 4046445.12026013 4176581.80619536 3226659.07290072 1578599.36276232 4037078.1144542 4201608.18178309 2388743.92309655 4598116.36091871 3787130.54609324 4086629.52566775 3431477.38143814 3543261.37003565 4051271.33870089 4896284.64793376 4231151.44603249 2929129.17972785 5250594.7202296 2065074.48647036 5928865.51516663 5874139.51364489 Cer 18:2;2O/20:0 96047156.8739294 50878235.1985396 71080029.7272421 69328428.2201635 35975948.0385436 33429747.5400158 76975940.1204705 84220826.1246096 55383424.3768354 83312653.5388288 68457714.3118332 89692392.8499545 35109313.9026916 63466360.7057645 74193297.5376817 93125290.3178174 105582849.843664 74804903.6719879 98570360.5576276 54075098.7995366 89691186.5995199 72423566.808189 Cer 18:2;2O/24:1 91370048.6755887 67278649.3392686 64846675.6378974 65609755.2404009 51581240.6520307 29878414.7097948 83325246.1944968 75029476.5521865 60071260.0281872 75985050.1764609 55758871.6202645 87573634.0529839 53055798.4484375 71372451.9054416 66278361.0178715 77085077.4238727 65720912.6794047 46970836.9332548 71468236.5628476 44580444.8274557 82157986.2698787 88208877.8043487 CL 18:1/18:2/18:2/18:2 22398329.1090557 71342348.1021672 45470621.6373767 47588190.4477273 48957687.1834695 22157337.5708513 42279094.4451813 35972313.7202038 70093148.1209658 39912484.5525757 43846074.5380287 33652021.4275646 37553434.6497557 42642991.3309699 37069196.6324243 38854963.9085196 46892098.5268208 74935721.4907244 52946855.0207675 64388150.8416097 38648190.3809664 39378875.476765 CL 18:2/18:2/18:2/18:2 191365763.885953 504779754.573671 330781857.659026 419622112.305397 317078693.870734 144431643.710292 417092612.238515 298612608.308419 643147884.784759 265302732.844641 299155706.238162 248771655.635184 322648731.944188 309005948.76998 262690995.39314 313403781.442607 283322406.953682 617386689.260919 385383277.590535 622479636.952984 288048004.453524 279027136.614396 DG 16:0/18:2 14565492.3528941 4887695.79771591 12192597.5861706 34239967.6724559 50437744.3933528 24383068.2166153 36784503.0797885 97607507.6269441 6631036.03626357 20934748.2077531 30458916.6290913 59400772.3232167 16226492.911829 28359729.6378353 145881452.943211 231983981.323065 109242857.961819 27294666.6414704 88971927.9799972 37459657.261826 131805240.990719 69010875.737011 DG 18:1/18:2 56152125.2752921 7489091.12363961 29644840.5379443 142738007.284637 198824681.160028 44475717.3304347 72235727.4766951 344784948.114441 16126422.2425358 42109732.6229968 77483090.431591 147131400.726436 14418132.1082009 100222461.189801 483931068.513823 702200173.956806 227764627.332267 64038017.2038155 185643118.940117 78801185.4614944 463695022.506154 128544953.080245 DG 18:2/18:2 34601399.1860878 10191558.6056614 37255315.7990097 107445609.775031 175367875.983046 50493758.2684001 106547883.135527 301133975.14871 11788372.5251738 43996547.2137938 66346154.5314604 93971295.4314827 38099917.1708927 62398888.0587648 374513501.24692 539010549.132313 197698711.080575 61711874.0812018 153248778.164277 55299304.9209199 371406625.028777 131194353.955876 DG 18:0/20:4 247591378.527753 160306316.291753 150282969.413454 181664362.865716 216337712.073796 109638248.425009 214280012.950854 218873066.687877 177089722.115182 192832786.728123 209612644.331616 271591144.94273 234980712.532102 199390845.076337 218107301.91876 247132725.980764 302900923.161637 155153754.168915 248357010.863268 136316611.663726 165806836.590823 213717416.816814 LPC 16:0-SN1 330257700.696444 216580940.539744 265495469.945795 232820676.980646 284683009.89637 178247923.464177 323715552.150232 419020003.917504 197368564.846801 309463498.669194 314392373.114733 336754171.933721 244170510.483503 232458573.776343 432149563.636969 445625479.479963 416077396.96449703 262906717.826886 477724211.201265 200176231.359193 417360994.226474 439181941.151391 LPC 18:0-SN1 444733066.780494 242939585.974928 253013448.685512 317906878.979793 291731714.542981 153670580.583565 353357059.658168 430941506.067403 233242174.415377 312358841.035538 257766015.005203 352703014.753942 272234011.545254 334426751.315163 414257541.627526 445260431.289964 327435197.240093 207696589.182237 345406381.499807 173965259.430303 413898130.80537 435659858.906637 LPC 19:0-SN1 8347405.5194760105 5016746.17991569 4521283.02893422 7586648.41854723 6268926.50568441 3309241.855423 5567328.13679441 7843042.52116126 3923147.99701911 5100708.39277096 5796956.03436769 5253670.57139977 5093092.64991661 5116149.96603044 8122066.15270212 7926010.1350672 6834621.07200811 4791681.69084115 8627160.48845178 3892791.86768647 9064704.34494727 6977985.88310804 LPC 16:1-SN1 7917460.43269052 6123023.98110042 7052778.15129341 5131252.68250955 7090162.78108522 5077357.31185832 10514671.1606428 10531018.9224364 5235613.72804884 10438399.8680825 10011218.1318253 11493497.9617167 3852126.2054878 6333837.51671063 17651848.5756191 22266155.8930691 17268681.9155983 7713415.50827766 19251956.0462866 6452299.90095357 18686816.9723598 22523400.272809 LPC 17:1-SN1 1040478.3010309 733341.853941319 761836.854993506 723682.882423261 919202.435368583 585773.57217652 867825.534296939 1001118.63085082 471792.46497414 722803.274040609 906800.514681366 790259.887973743 619721.65067075 642019.461218189 1073777.38673955 1497502.05325118 963963.025025141 677293.493826482 1833314.37143112 663252.936909487 1739733.16385785 1125826.97456507 LPC 18:2-SN2 400403771.632395 119448666.327509 156037836.612081 277717549.454924 242662628.543514 173397966.094239 299502077.281704 438650039.311909 118855762.983747 207917794.908711 276188700.254527 441841890.411854 179465609.397869 280382490.044359 528456498.445681 646807543.736502 371985459.37759 192472706.47816 455355042.828704 171423612.327885 643588895.184106 648831885.403005 LPC 18:3-SN1 1247397.45093659 924224.45891815 2370788.95295188 1451808.43112947 1434106.90623139 1488333.30349214 3172752.4123305 2349496.57049352 1272951.98035946 1723956.36449634 2283656.82859641 2324138.21453194 1120169.38336887 1323918.80202932 3223511.29085331 3546123.78268853 2458032.34470217 1899230.53998046 4064004.33824745 1296006.91919107 3585469.55546021 3543524.96220219 LPC 20:3-SN1 15299796.2030647 8188984.93738061 11009878.9832981 10586080.3583968 12311569.4990372 7416585.25117704 17793128.4802415 20404227.2562367 9223912.10882743 14627886.7220118 14235565.2452783 20316431.7544291 10694300.8031937 11352612.683567 24309311.7084978 25871455.430785 23556616.0638413 12925026.9974756 21403869.7788184 11079843.2134005 27927651.7705951 37815539.8029946 LPC 22:4-SN1 10324483.0844204 7154028.92459221 8546877.9668123 6594433.64180302 10962582.9496749 4792135.67106923 8446189.97687952 10697450.6379536 4478644.06337637 10654661.7807472 7644306.9370981 10133809.5729696 6377572.42497772 7528157.76445182 12890461.7129746 13711832.3226049 13584671.9779153 7923624.86009327 11651727.370067 5122957.5650189 15016267.0824584 16689222.3742798 LPC 22:5-SN2 57745329.8699713 38653266.9140858 44801899.7374655 38278833.6934849 38927205.3506768 35154373.5336976 55552395.9226379 73783553.9358807 26613490.2999904 52410909.4019336 48741284.0015654 84112114.3951593 40095775.3237201 46197056.9423069 88088004.4090589 97447717.9346351 106966763.449607 53693129.6015878 77989813.6623682 36204818.4381099 100184102.903402 110449426.907536 LPC 22:6-SN1 1053906563.09536 1186033852.69383 1397637766.21952 770554235.47279 1697542729.28098 531516746.859632 1710186175.80055 1902540486.30928 860871488.533349 1656656902.22241 1571351290.23463 1372132159.77147 1274524009.74844 908440861.96528 1593960483.12815 1622675863.73954 2111152890.43273 1179511419.33593 1842921233.9059 717111391.728649 2236079816.43113 1979461937.83619 LPC 24:6-SN2 2339039.05258313 2103505.90909092 1785739.6878783 1946232.37487706 2369411.2380228 1243624.13923488 1932066.55255413 2572718.1079414 922063.701247709 2983624.65553647 1976575.1283338 3475386.14419737 1639650.22344276 1848070.85051458 5168634.49266141 5262672.61059598 4809810.18284431 2556527.26435061 3671808.70554389 1635202.71685051 5162109.14885127 6121634.3931124 LPC O-18:2 1158185.75269496 830463.0755915 716931.163317557 672934.680325363 821762.981150545 438750.276885189 969305.200625684 943461.87090155 596509.674441803 1050985.1717034 573699.201174535 843024.281707011 740189.917156642 787277.619949875 1206704.38859796 1352137.76817963 880812.55106367 795388.579961012 1020581.34059754 469983.647029553 1300792.90334291 1331307.51668793 LPE 19:0 973042.046850266 829566.039760655 1040590.69476324 932503.180466346 742589.66445908 783876.230953412 1185876.78990779 982592.521132286 692216.685398906 1216009.63622508 767667.821313243 816967.529976005 877026.856646653 671849.735497993 1303668.97186875 1208693.45448108 1489474.30887379 917530.740968517 1280484.46693612 624862.740478998 1609564.59465654 1172027.40646343 LPE 18:2 390537864.086451 114877694.386255 148461866.672653 259477951.059306 212557087.397656 172104527.759224 265553786.853117 373870478.708603 120854626.73016 189812073.820045 242600077.367457 400650836.486699 179322523.626706 263672276.570569 496631030.145275 584015372.47204 329970376.079401 176365308.819547 393692202.421403 161300133.914138 591224121.110121 598169933.670128 LPE 20:3 1187365.11470539 596374.976820311 957351.671842276 906480.627175142 1037359.63801349 514622.553834887 1359098.32068528 1598749.49341005 776906.669601934 1159223.13782185 1094777.20631701 1422090.96043929 1051705.96757796 969872.663101015 1685540.62195347 1926327.15795288 1759070.80947309 924780.592260688 1532022.55979808 797256.98089904 1877180.44106068 1980036.52646997 LPE 20:4 440118137.350561 254647879.664198 301070734.195208 349137540.121264 667540804.525768 207533655.698811 583275049.019103 726985485.00096 219053512.885045 503786259.071045 446392312.143007 626547996.917878 377790578.546473 421657586.554593 681209706.346648 767075438.274348 750628146.205905 355921100.663594 683435867.365066 306491463.676744 963050983.034292 1018043409.75428 LPE 22:5 44262219.3027857 41298274.243163 47385221.680445 33363276.7606521 89873029.7812776 20837536.265863 42030525.8320684 48852711.5008461 22711925.5030027 52959371.014253 36673190.8178514 39996132.2784878 36148183.2862098 29138019.6195326 44626559.6931664 47517040.8422153 47333780.1023968 34746531.3287828 46652782.0400455 23242012.3142723 59281515.5275273 52487052.2757479 LPE 22:6 1322174782.2486 1427418881.42174 1709424435.37491 1057598143.92643 2106971986.15408 713799425.82638 2153797117.26189 2380729877.11962 1089749563.45795 1999023490.94405 1902045658.96256 1762864341.58567 1601151978.70942 1183914471.6352 1942737811.25582 2004935284.94744 2511988368.31761 1445501944.54578 2216448222.42413 941476362.466583 2648840420.64376 2369027046.38293 PC 15:0/15:0 77620331.934367 66550117.9260166 74826435.7763194 47935118.8506948 93181823.8824572 41866222.0898431 102560159.523845 93575990.1825647 72057112.1969473 103675070.366285 96673077.7761695 106621079.414587 73110496.1170172 68806407.0405656 89701870.8800319 105430711.191937 129248973.999768 82754054.6905861 131005789.974231 61997745.5256427 96390635.8711634 136389442.136306 PC 15:0/16:0 50251877.9935192 20736946.6709849 32221504.2926388 27955257.4699352 39164472.5722057 18910622.2246052 45346507.9745394 52488198.5456104 30752768.5299949 38705733.7789205 52097626.8773277 39686509.2935912 33127675.9142942 29698081.7499073 46571608.7262349 54653736.4052432 65476282.6029035 45735034.6011571 80712796.8567284 29786777.2069435 53375137.6065082 46112458.4098486 PC 16:0/16:0 2655593824.76525 1912292989.68893 2015233172.41666 1678962638.62255 2308742118.85913 1293401753.99133 2547224448.28612 2957077861.66793 1733288401.89815 2773708268.0055 2847433827.08988 3146116444.36254 2267825726.28335 2043124574.76646 2674531210.25414 3064357647.91084 4148367034.65176 3061679102.33122 4441440785.05357 1955341957.81401 2695553804.8745 2925111176.33152 PC 16:0/17:0 21329484.3498049 14708105.1155134 15475132.80015 13634274.1734624 15924028.9922998 7814308.19114175 19568343.4608861 20152679.8599145 13141169.8946241 17816003.2510141 22805627.2756747 16780360.1788469 9735684.08448667 13056037.3444689 18736970.0516779 22389999.4361934 27158983.3273353 21837192.494066 36066930.6361255 13962274.7711607 20646044.7156229 11818135.6554887 PC 17:0/17:0 148686744.175415 117510405.683118 121720932.743882 113689355.785419 125238496.845574 80393881.0834639 155053642.654022 176027987.949542 115597928.326958 163514971.353793 157697312.733874 174038701.324442 135431406.486689 122939800.30718 159769786.058196 169194623.079706 224428281.484604 181314941.997201 266496499.253365 138605982.987207 165418328.675643 170422944.020562 PC 16:0/16:1 463558115.072651 316255862.150451 326447897.871605 279108673.525871 308814124.792458 198782298.211816 424056917.388268 415420612.693602 307805483.907048 430982221.87622 430152722.080698 498466813.297231 285745323.358885 342392021.692816 518398293.84353 607849009.196157 603741008.695454 350559029.957556 661254942.488617 275952274.83344 501010152.937329 743201738.144883 PC 16:0/17:1 104984720.333282 57270275.9037359 59203131.1243548 62166502.7348559 66570578.6762001 36350162.5470941 75739250.8803841 96625981.0118021 52826753.3450098 73511296.4839428 85023546.1284971 81540232.8303589 59394698.139725 62709070.3099366 89229261.4649006 108627072.245427 134245491.240484 70730487.478899 144704435.769858 49883309.8616808 103611840.656551 108971631.336152 PC 17:0/17:1 11117677399.5525 5872035179.4401 6456350876.84924 6707713862.38605 7535678291.95991 4079478032.25198 8267101593.21803 10573050926.1254 5747275905.99266 8089658147.65979 8009902773.10043 11310572714.6713 6710521303.00861 7459836546.76559 9799616673.4606 11654271677.5046 15201620751.0147 6493514346.16838 12825661603.7612 5394539557.94895 9179311195.00974 13594108358.7048 PC 17:0/18:1 147055377.079545 90518853.2068492 92549684.2828197 107452907.403914 107522300.412572 51441380.8414018 104064061.909608 122966267.894439 73526881.6889861 93121096.7466466 103306486.977736 103659638.229865 83254961.8036537 87754603.861314 115291550.545272 128732837.793958 160052714.467044 80372321.1856246 153850213.059287 71366072.7766115 126363147.075289 134063100.195166 PC 18:0/18:1 2506336195.74792 1446826441.36367 1380671418.07923 1680215083.83959 1939401110.73141 919992240.211942 1979219700.64556 2183631255.88467 1559610323.56347 1699158273.16381 1632058180.16467 2237132284.61835 1632013896.04607 1952734161.24558 2160798527.44394 2427623250.56812 3074135752.37302 1183214499.49427 2355247433.48724 1257114486.34476 2084323661.74588 3006255475.13053 PC 18:0/19:1 69840774.2852903 41386869.8496694 34052213.7553458 55296185.5000407 50165234.0714663 25726987.9212342 39998702.6146553 49622324.8324224 37182595.8104451 41778976.0817993 46764196.1893887 42596655.3726599 39482278.2295176 44935725.1617109 54471497.7129205 53717354.3392574 72964492.3858724 36411711.6802729 74004551.4819916 35738847.5848989 57483373.4622685 54518228.8194144 PC 19:0/19:1 107048083.087922 74028792.9731862 63843524.0599767 74788961.2909491 70135885.4785634 41475037.1130369 80429741.236348 86449678.0929657 73687276.2319594 67374443.8560181 70111122.6597558 64545157.9129056 72617667.1530214 67954133.8086004 89051833.8867176 109942240.36051 120730854.263861 100179179.378306 130419439.88629 65281925.0570001 98328582.5362344 81918562.6629263 PC 16:1/16:1 38001712.6474188 36267650.7975674 35759326.6016657 23378343.6104062 26934413.22931 25920109.7666122 51363874.2334422 30942742.8560364 41352417.0600381 40675212.1064299 37528255.0904425 43371167.3298549 25027645.4018836 27684625.2202925 40572381.9708415 46008186.4642073 45237615.5094467 24526795.4661683 49903858.2109088 19342400.8542069 39394847.8822528 60890597.7483118 PC 16:0/17:2 104637128.230275 49034136.7847812 57399681.9437132 66713632.3851581 58223341.2577822 43668377.1580666 82958133.0498126 96949000.7656429 47384628.4233729 52118638.4852464 92557951.9803453 68305843.7163987 61205828.612305 56713281.8541542 78796183.131981 93170730.621833 86359209.8862833 57616597.8938824 124108720.084086 39193892.2542376 89588118.9241855 93319532.8085625 PC 17:1/17:1 18866453401.0597 6769964136.17364 8315144794.35626 12975028399.6323 8462370572.39967 7645563096.5887 12096855003.3468 14775460476.0037 8235312006.24281 8734578826.70078 11582030621.7085 16086778788.9005 8948094677.40223 12308324773.0879 16086040493.7211 17840864231.9722 12716648428.3577 9018160169.68866 16506171442.6709 7070651489.94064 13774912398.5933 18738234789.3043 PC 18:1/18:1 14362997179.1193 3006556871.85467 3189538605.15427 8439704128.75319 4131980896.58776 3120760252.42133 6590078512.37731 8442802129.00072 4035004880.17746 3822356277.33777 4143246242.22799 8699618309.443 4334677752.92214 9977298959.54262 9204747308.48718 10911289757.6552 4708929349.13734 3059004154.16102 6539038753.46704 2757322221.44207 7909748888.00817 11519084472.4263 PC 18:0/19:2 142584817.266533 43648274.6099909 40762130.5961201 116919173.459097 55536715.3531635 40938305.7910642 57166063.6277356 81735785.5565167 44547861.0743191 45292384.5883457 58815615.8262654 67957062.3495453 51652112.4431113 79761324.6765385 91376148.6620926 102883135.308339 67310668.404723 50642055.3894918 94983676.0518313 43607473.1201562 95369799.9221333 91966631.3948297 PC 20:1/20:1 8585936.33641437 7052937.04483876 5552112.25138785 4511530.36892405 4690252.90672331 2769573.19585314 5803533.66825285 6100615.40089296 5577127.81158403 5029993.90884982 6661707.8204153 5483447.92521814 6025673.32349429 5142058.90273102 7527550.74001219 8896013.75012592 10210013.771693 7966824.04514342 10492790.0945527 4370570.45855204 7669297.48019009 6413195.49618361 PC 21:1/21:1 3092709.38499898 1351796.97487952 2222206.74079825 2172726.88635888 1826579.36511495 995325.903242606 2588286.52275797 2747663.56559329 2290704.65697411 996303.034069817 3222713.22288597 1657187.31469733 2315716.44512492 1206448.88549857 2244192.66458002 2670071.61066597 3795186.36893638 3669133.50345429 3999876.98141078 2384885.77968217 2512104.76073266 1892864.72034561 PC 17:1/17:2 90294176.9469216 46947640.2639003 52986196.7286391 59322035.5085179 46358091.3746351 37815867.1137679 70518615.6765731 77568195.4902206 43137606.1184558 48570410.1703961 46224935.1921142 79317307.8766449 52444810.9874561 57370161.6966205 51738378.5484587 69589256.8073179 70280437.4743112 47802076.619159 86277604.8291972 30627927.9180104 60496332.9143405 83129741.3645007 PC 17:0/18:3 67135885.0468037 26225664.4908332 22952782.0099819 44310780.8537895 23272348.3266652 25993517.5466268 36297797.4745401 40919915.066917 25099800.6094136 24514657.0756674 37273576.40444 45852773.8561308 29905049.3303233 40478335.4268325 46496317.1877967 57440932.7487313 34616655.3274234 27986515.6295017 62092959.0527702 18270902.472977 60282705.5906557 60803466.7281064 PC 18:1/18:2 8378251113.06118 1885970147.87908 1894364002.18597 4703697987.91797 2505437305.90631 1962025206.48818 3531124509.23909 4612354489.59795 2185077263.74816 2458833289.31777 2701646696.93652 5759984054.36994 2466627970.33095 4580551877.34281 5543269184.81996 6658842903.71062 4264271140.13179 2114026178.90019 4738256250.40721 1856123624.36014 4922467037.4912 7579873627.20515 PC 18:1/19:2 63912324.1791392 20523516.3460309 17076851.9365794 39186753.6908535 16409474.6732137 14037515.0402644 27088586.6038571 27394953.2940548 19416955.2106075 22649057.836261 14074410.4569306 32632739.8463738 22615161.870749 35169008.9101047 34208816.2478557 41004139.4022199 29962228.557796 19088516.9264101 34923752.8666736 16322567.6728793 39630074.732315 42924857.7220018 PC 19:1/19:2 1005292805.05936 535488289.646058 645700198.081556 553364218.001393 624772673.862209 278050802.753394 853512526.43281 854764751.319991 657162708.037434 647351608.631886 512023534.826746 721942557.665398 622687401.088986 656068447.173511 830271502.309531 893303711.181428 866006305.700809 582419705.65441 791908953.846382 404965054.01856 714332158.839704 1175312309.13311 PC 17:2/17:2 5292712.78874626 6363797.95137689 6401671.28250256 3255788.06040716 6827839.00147667 2600826.01487205 6557208.80174189 6240239.75454811 5534492.98841407 7804593.30110119 6497979.88243531 5285052.66409899 5402221.23733343 4090146.74003305 5291697.93519017 5771591.91139611 8775929.72840342 5246716.23617732 8541170.43193457 4006876.73814345 5515315.35120563 7154543.25180985 PC 17:0/18:4 25869119.7896984 15886893.7190702 16685387.2703073 17796664.4072359 26689156.5929639 11153253.4481368 24858960.1791357 33598205.0017636 13319144.3626077 20140993.169097 23289129.8520796 17992018.5446581 24276904.3282434 17023633.9605086 23858670.3176723 25484701.1637808 26281038.4002183 20011462.1030782 30118968.008351 14789557.6271392 28535118.817635 28441197.2543497 PC 18:2/18:2 2222739524.26708 448634602.073194 544485817.085861 1377375283.00171 638180453.248949 751591053.091937 1028278035.92603 1302711397.02967 649252893.015193 583941877.556962 865830762.139044 1507967583.91466 787966318.513743 1328861917.86274 1747834256.22331 2107949836.19887 806141684.586766 585589160.148779 1367197005.85218 537095033.892246 1550705045.62045 2130716085.6331 PC 18:2/19:2 333579520.967395 163959516.765446 159947589.601086 223658118.379019 304303110.704994 95375221.8502292 269048686.123122 312033820.408255 142212837.91773 226170523.748255 193973769.159273 230730918.526171 229099669.714574 239427655.916896 264471885.327034 290498643.598783 311206913.459478 177963377.339997 280088730.012355 120910170.377272 300672464.816612 313111443.213683 PC 19:2/19:2 28798643102.5982 17951352240.7215 18349949820.1977 20752046465.5923 30170691247.01 10801278201.4844 28135982645.7683 31794258535.421 18292663753.2347 24460750682.0743 20865610471.1964 23730278739.0447 24142147958.6625 26070703364.2972 23523704033.9493 25680288837.2866 26535788992.1143 17620867226.8342 23723138973.2472 14771469831.7531 24231474407.8286 30492054687.6622 PC 19:0/20:4 164971948.875188 103023879.088027 86883475.4228417 143338023.482443 170067390.857959 65919733.8228218 149054855.728183 169697524.581739 81728473.0061576 119939385.904656 114313947.142814 96053173.8158778 120928753.170256 136705174.354411 139908083.927779 133521832.76576 151878326.195034 103457956.915137 154814460.58779 88047829.1800951 141223443.719843 152050949.105477 PC 20:2/20:2 257683714.258215 218358388.405332 198822349.212336 167072334.491186 242399177.763871 88519090.546541 182800270.771421 215491979.831712 130706278.660336 227689249.501818 157158111.261692 180707799.181781 164649106.117688 179096198.856496 197755129.911939 187007574.232353 222692366.907556 164244488.813764 173093158.269167 92235269.7199778 175474189.829061 197069238.201856 PC 18:2/18:3 63091744.1197155 49594526.1894587 63004081.9330067 50933941.8203527 32369293.7886297 25835150.0346504 85453594.5175424 67095592.4577457 53778611.4934379 69699598.3190007 48472826.6571074 66069970.1431556 36854130.377962 59076581.4591445 60976897.0667366 69818715.2524748 87298549.6257976 44043201.672877 74030761.4906908 32985765.9567364 53373010.3671029 97436209.658738 PC 19:2/18:3 88879459.4746908 62061373.6614082 62835396.0964059 55357535.3472289 76386896.608705 29465511.6512407 84971597.6003196 92144061.1832597 51715869.7807861 72015898.0605171 58830502.3980093 56986033.8817711 73233072.4181393 63272865.9675648 69105597.668764 71945469.2997184 81585813.8140881 54483567.4435245 81620232.6992756 33736806.558105 74297392.2986926 94287553.6269378 PC 18:0/20:5 6814087236.45624 4628094964.51871 4500588770.29181 4373682232.19439 4877273773.19576 3117050606.87106 5673612431.11631 6697184467.0022 3688883774.54278 5836232002.34116 4297050682.40359 6805004011.19017 4803698582.79989 5085570327.44861 6699452032.85759 6865465281.9565 8129566385.98618 5470948833.27155 6460108209.83276 3382711798.00004 5703272563.84814 8345747382.51402 PC 19:0/20:5 26389751.5700261 15219647.7529457 16454410.1853934 13343685.7808047 28047758.1332475 4830685.93324988 10328524.6562516 14812901.2836778 7075862.62271506 14981113.4914328 10100506.8720931 4896747.07012889 13045368.4661171 11564387.7895193 12734306.7754912 16152193.3130849 14108797.6117631 11389174.744665 13061975.5585672 5079076.70699932 15995849.9310585 11708591.4024457 PC 20:2/20:3 3293253882.31393 2133990165.52879 2223691475.1813 2024533816.79167 1941613647.38274 1186810198.5914 2637257357.92201 2978117287.61093 1819230202.37319 2450482479.45329 1993862519.01616 2656507119.4513 2134072913.43344 2441466656.51388 2900264661.85375 2917867853.92223 3334842698.92954 2044130897.11658 2653983063.56034 1290275986.83447 2363354207.08169 3136689499.53294 PC 21:2/20:3 23179898.7158714 17025862.0558179 14004628.1357832 17805921.7648513 13257521.4103614 10448635.1272746 15419726.2563857 19096382.6067156 11001467.6103015 15482183.5501823 16548417.1104196 15067356.775441 15702197.6281042 15188801.9054817 20630868.4278862 17575225.8538048 24754181.9408518 16462604.846043 22619576.34946 9990296.10030541 18296258.146678 18346075.4493482 PC 20:0/22:5 17551735.775443 11660348.037531 9594694.48088184 8519692.8688146 11990026.8472691 5008655.09172599 10525056.2834755 15989800.1280082 8020244.78646044 12402053.6844943 12013613.456875 9747259.74856881 4065115.29557734 9128882.66436649 11189609.3342214 12210767.4927654 19704476.801025 9729955.7370061 13055876.283083 6723328.87362118 3316972.6110994 3764504.40154035 PC 18:3/18:3 17489922.0398184 59235965.1100945 52430851.4316426 8777865.28966379 24878825.0404759 17372216.3336092 52416956.4080156 24623285.9657527 55245600.3749802 55420329.0531182 35015915.4363327 21197969.2430729 41780778.3306399 10034110.6970907 15005967.1689877 13718703.7413464 38953468.2154403 32351251.8891242 32085179.3275933 16317747.2594711 16101212.3917558 26247281.4196028 PC 19:2/18:4 54572071.0862315 81953866.7918179 96776170.9036657 42410903.0122099 74125140.4722881 33482618.9151029 85957304.0161487 82523876.4526397 70160446.5991306 83902846.9534956 84604720.4166207 42905739.0415176 105312557.435728 29103947.6435432 52823259.249726 56261727.8006123 111035418.841718 86261812.5222748 94728213.3818536 43946742.5739811 62002289.4722117 56408895.5862732 PC 18:1/20:5 1931284289.11755 941271233.349588 889667803.815867 1292535385.64835 1604149712.44285 675667806.494232 1864742850.30271 2059935433.78109 999325604.713053 1324739895.58663 1001039435.74254 1626049087.03713 1224719538.31877 1598469794.91418 1810001290.04712 1982027094.11708 1834578152.18202 1006187516.88694 1605019585.40346 818948300.088006 1765111710.0734 2784188838.90751 PC 19:1/20:5 83625324.5924967 111467282.152871 111060902.412415 68933100.4852115 106948907.615475 39157379.1730148 98632265.4162518 95510552.8628955 72754661.5254636 101053131.518297 93167647.736158 64254804.0023748 86725154.8594231 59916470.4400845 81538887.8980409 88766469.6606546 119948548.639042 95358811.4455145 114120658.045747 44179002.7807259 90977784.2768973 74916265.1669008 PC 20:3/20:3 40297180332.0396 33173363067.4742 38238821388.41 26899247456.0187 42355252547.1383 15974167245.4155 42220243741.8948 45936271609.9662 32784923998.8272 38452199481.4421 35566547140.1473 29712805855.9722 40666594469.7717 32430259988.9352 31552830415.301 33835233632.1428 38961937012.9774 28911095845.7901 36957762066.3073 17465197854.368 33026175475.3997 35135859719.3347 PC 21:2/20:4 636009313.899129 416667451.623013 451379408.347957 445124605.775069 534516418.6928 186120179.829195 451486193.010273 562450725.405086 364570397.680069 435417525.466645 521984516.342332 314471809.055864 420920479.705927 361431200.747785 415689099.175372 480393746.779397 574971627.392832 407064741.269876 659248619.823272 243722436.539966 468229161.781318 361177156.181726 PC 20:0/22:6 60833826.562613 50191577.0695521 48903924.5346112 46894561.6366256 45998904.6319789 28647305.6432865 58036103.6689356 67029222.5356267 48840002.98699 47882679.8830467 60877300.8218101 41889739.4098238 53585767.9103892 38627526.7243884 54223466.1307064 55671450.8125234 74718230.035192 63209864.0548505 70662416.4675955 30033713.1896469 49579245.8242162 47856137.9869014 PC 18:2/20:5 4846820.29742854 11587183.4964863 17235145.7529639 13100369.5668318 19567990.5708859 7072148.20197222 21357825.9409597 22812590.0336149 12236999.7026002 17140569.0337782 16292948.9061535 5637758.35735271 15051554.6863254 13874636.1579323 24569916.3521841 21071818.0020734 25292701.1159622 17417518.0756214 23589745.7162779 5520615.49719411 18834562.4981482 35732467.8259464 PC 19:2/20:5 48871447.2035182 73345426.593392 63077604.045445 29804623.509322 46401428.0443671 15277872.6456669 68862710.2884928 57136011.8176054 51221589.0139725 70645879.5369184 43435198.7175768 38684918.6394412 46105748.2821274 33516578.6422066 43348013.0445799 44869942.238113 63911822.5076902 47386735.5679304 55003001.067618 29483115.6947428 48859821.9676184 46521498.2738225 PC 20:3/20:4 3523482612.9411 3015593911.16846 2939728648.07471 1847586759.15234 2820583416.91242 1087703353.60615 3020023357.42167 3222327647.61537 2235526779.97072 3200246807.00948 2121905039.60346 3021474776.65548 2627129342.94888 2647410797.03921 3410473310.67062 3690292286.22671 3771629238.58997 2645664371.74806 2904524811.9919 1468162097.0679 3356867205.27169 4215651460.57379 PC 20:1/22:6 325609873.529207 282950330.906672 305624985.10966903 210407602.730594 276689370.758801 132303286.889533 304858280.911707 349884966.401786 236626572.903355 273212525.875028 260064022.378589 225584865.755989 315465499.564482 223353386.255843 291136529.334251 323563953.563645 417874683.299383 296752845.04952 372820356.161533 159862986.166801 312327512.817916 284828450.516137 PC 20:4/20:4 9033641288.67288 6899783360.55717 6537095889.60762 6140663477.74486 7348719021.26137 3477561039.83839 9489876204.40993 9653365153.18798 7207202165.96546 7521206836.03505 6967582834.44941 7056218012.14054 7580826255.7541 6802787950.15766 8106011558.69331 8848559570.4405 8800422656.1225 6431787823.03536 8500460924.89449 3889746582.76584 7961709376.09318 9781157481.71388 PC 20:2/22:6 151008417.569845 166245167.324858 199138242.885641 81100934.194894 183329509.427808 48900488.0892064 178626864.694206 149994468.521803 153032803.501037 157295211.664337 131729866.865485 91021935.6019942 142786811.789629 108490735.169441 136893410.86344 149941112.540814 171871416.47664 143400689.294067 145639226.466104 63353582.0765405 144338548.613267 140122762.96796 PC 20:3/22:6 82154652.6299037 70146020.2530265 81752766.8585469 42695522.3060053 63721887.789671 21231465.4027737 93046253.640638 77432240.8604872 75033016.1927791 83428627.9343769 62971222.4175417 53464850.3073717 59178254.6589753 56357518.3793655 71991333.0911827 82692713.4789756 108000233.047854 64363862.70044 80181203.5475149 36436021.3751793 71250136.568403 82449588.4298204 PC 20:4/22:6 82854628.5126067 99179133.2105666 94374152.4332937 57688254.0251254 124004220.492225 36750468.0777489 118101543.98928 99089831.6716473 87324950.978493 104097395.083118 60874201.5213978 58183023.8016129 101934929.456147 72170839.8866854 60913044.3555314 58165680.9268522 73467325.7500733 54528746.5259973 66486840.5610599 35633121.4099463 58311842.4402339 89746813.5710388 PC 22:5/22:5 25500697.3759178 35296698.8785585 43702391.1837829 11411707.8827807 28332638.3476737 6845595.06265402 30720573.8046482 21694456.5444496 31302208.8309744 35482543.9617342 16970584.6328649 12834389.8463313 24078886.6278632 14086042.2328465 17403480.3610827 18977210.3783697 25402244.776852 17637500.4075144 19716013.8441783 9365698.53420742 22308252.1711763 28321524.9613914 PC 22:6/22:6 37292926.5968235 62509026.7332818 52148361.2797354 25204688.7439877 51052654.439218 17164703.9121323 57491450.3123903 39246638.4600128 59276673.1725281 57951661.341442 40240204.4762724 22749697.4057103 52638993.1650092 27338855.7060874 27181853.9785581 27325473.986085 38992996.6718171 29081729.9117138 35659783.0037548 18408776.6534374 26571308.2890332 35406224.2074061 PC O-32:0 103125143.485154 141555623.822604 66477396.5939116 98600602.5840649 143890117.068815 68942075.1875649 149240523.861771 171076642.647896 69213371.1011353 80237802.4741349 51866654.2224141 148420966.939811 166600484.748987 93141439.4884396 65482256.8179844 71915933.8934046 104577343.971451 98009303.8080352 100276141.004903 48084016.9569152 56038738.3742628 62367277.5515708 PC O-34:0 81934508.4580974 81395898.840668 53926873.9713323 74435541.2428564 75923610.8804488 37534349.8619289 65776350.8858125 70468980.6406094 51316164.4366779 56274942.0589545 50682728.4969078 65211839.1292611 69096578.9675614 61746010.0458196 58997663.1427836 63598607.5652435 81790120.2399478 52275424.8821231 82581310.8964096 42768330.8035506 63475517.8154377 57694785.9599281 PC O-36:0 2346921.74922623 7752884.42802342 4348147.84042509 3401303.13389208 5933506.47171428 1982629.23344463 4576049.40945659 4662824.20314016 3924046.73560147 3106283.98162631 1814006.17578574 3666508.69683699 5274022.07270075 3039097.64344695 1262516.94217366 1348788.30742097 2337001.9977616402 2517690.96082905 2238063.54408701 1447412.47374134 1158300.49098105 496109.714339976 PC O-32:1 60063535.2532109 42655663.7678548 42758228.1055977 39743193.5242417 48227880.8034189 23070697.5330699 64910077.9295141 60335401.8645137 46001939.7509268 53982363.3083785 51973548.8067394 61128031.160578 49273646.0800841 48413071.5778733 50810768.2870684 58834715.3248092 66704943.7521798 43197393.9662599 78024073.8071216 32387929.9409032 48754599.9769368 58116318.7986422 PC O-34:1 119747757.089217 151522077.197338 102920175.265768 101744350.251176 134780506.006251 69950045.8437898 166494849.204213 163444573.114041 71687914.7946728 97518385.5738548 73488053.1064212 136273960.895905 150303789.191619 86227239.2107578 73718176.7122689 91715479.4745501 112727148.165943 82009678.2814898 118327088.574072 52177096.2244683 79711505.6668312 105449514.143159 PC O-36:1 12225724.2935048 62047625.4469053 30096080.2050648 25337482.3203606 35503294.6315853 15320491.9648859 48959813.9054717 26683948.9151542 10744599.1756388 17666545.2385261 2912956.26052467 23391463.3414976 36134366.9402753 14104364.2353064 4489878.04659921 4123671.6084885 6390414.37233206 9572705.16278938 5652285.07034293 3658565.78818014 3888592.85974548 401198.12497327 PC O-34:2 351133286.855062 751205552.901838 408325033.510213 463831627.673396 605065417.821514 321038832.540656 844261654.633658 641983637.652565 294299684.840853 342865524.956828 144355656.024058 594306053.97781 738744232.761207 286033577.345502 173563658.183756 200749771.073616 300042712.403835 274561320.523377 245882272.270606 133249419.058753 176386524.472285 222258842.576745 PC O-36:2 34456141.4297496 98590995.9912486 51910060.6003444 49903238.1525189 73033772.3722315 33770700.7379669 75928431.4639154 52419772.9298211 30261190.4130214 39035009.8595417 13817148.3963464 43399263.0012871 80648917.8888769 25697335.4366335 13343874.6912972 16233671.9964208 22981877.0333476 24169517.5229785 20949900.9587467 12607899.8790086 13383204.2121589 18699730.2409503 PC O-34:3 20928733.2839879 64067663.5435759 32954448.2073353 19611383.470174 65347646.7798533 16814024.8608852 71978547.4059541 53579275.1727926 16088348.9433449 26085288.7049518 5407768.98990381 32351091.3805609 75185674.65846 10508706.186477 4635918.57335152 6306676.30463368 17977833.404291 20064950.173537 15410774.7400969 5101113.4392341 4422202.77929622 6242843.14868621 PC O-36:3 19755871.9498392 15490035.9567523 12247941.2154054 16542505.9071838 12737009.3948238 7489416.15147934 17065764.5623079 16371161.5564704 11529106.1407085 11034099.609412 9469907.60447953 12825867.6193729 14890996.2648649 12147934.4408267 14609255.7413153 15569948.0306089 11830535.6037728 11427549.0965079 13392499.4496276 6752614.54064107 11684063.1243915 17231163.4024134 PC O-36:4 143989413.496859 136899030.421874 95739328.6041759 125206864.988359 120432245.116001 64045790.965904 165535596.38219 234782478.038652 75720828.2754982 94002315.1003364 64012584.5937469 134461175.192151 207856909.451804 97854989.8090951 82271685.3870797 101734645.013462 103431005.435828 81213053.0931362 89291458.91582 43950753.1724322 82282918.2892352 107319757.814759 PC O-38:4 18477736.0267652 29483300.1835314 19737401.7103552 25390489.3466128 31832598.8370487 14858822.636447 28878587.165726 29023470.0075993 12934378.4332188 13246688.902356 8978891.2298277 20453760.1680034 34126207.1556898 18425593.2584815 9585050.27245959 9840925.63511222 12293209.9012666 12042269.6971099 10135208.1196014 6518466.9580138 8797619.62303273 11092436.7692637 PC O-36:5 1162562721.69005 849212038.238618 740213557.472168 727073883.234277 900597270.206908 342521083.995282 1322016596.1524 1071631264.54726 681229108.081105 904704579.792015 824866588.483968 891248321.136419 1035736699.45874 815780728.597123 919873842.419088 1050858818.39202 996607181.017088 725335987.601993 942129019.019413 393107099.984675 1137057749.36059 1118655189.37546 PC O-38:5 86447731.8956211 49060767.0695644 47783298.3767003 49139813.1736194 50442932.7829834 23039917.4646212 51934951.6364395 56696579.8741242 32535215.0608638 55465353.9546538 33763368.8366132 57849835.0474265 44127658.2250063 58465234.6001898 61296353.014098 65202631.9932704 53255690.2328337 38215664.2357744 47735533.3747053 19097827.8731155 52148414.4444961 73680982.6466411 PC O-40:5 5148342.45256352 5719400.8252722 4752540.78211912 3053279.04545981 3736708.91087677 2238967.99113168 4386879.1082524 4460106.30537683 2747471.8331919 3916092.63736316 2262934.01017947 4391296.76902481 1611769.38246788 3535388.43683506 3310716.03611042 3182040.68489682 5041312.05876691 4251789.95765806 3943802.06647978 1506924.49069552 1599189.07201739 3961486.82706909 PC O-36:6 5124708.7299552 4894793.94321265 7438268.75350558 2567943.0998608 7754614.72346843 1880920.06646401 6743311.91212811 3363446.3717134 4101040.5376845 4244297.96695776 3532240.90538679 3892186.86021792 7732630.10964292 3627697.80196161 2748623.75538976 2852221.3333753 3817814.2489606 3062433.65146998 4079652.33111097 1331806.76699631 3646957.81831341 5526022.74157913 PC O-38:6 112167116.673294 80165938.4191559 72021932.8454249 58579607.4647052 102711582.254084 31561370.2489724 55887268.3071755 71947423.140584 43817672.3329704 81654548.854835 42337246.3769779 64654776.1976968 57188286.4018206 59569120.8873956 67173846.51026 72331337.552336 68204284.8460304 61703575.6195736 65469449.4376052 27604015.3369046 61630094.1295658 81373201.461197 PC O-40:6 56197964.3951993 71709186.7598905 62211569.4044956 46042726.0291883 54926808.735743 26849492.0582115 67017730.3713446 50842928.0902339 37826548.1391422 47962102.2403224 32213597.8884199 42923662.4541858 66224344.3724781 36985782.9386601 35750295.7501011 42359162.8387746 52372527.2784475 40490272.3009195 53895192.6738354 22119132.7531085 45327416.5738914 52735007.1368502 PC O-38:7 4815057175.57826 4269774435.52732 4597386435.75288 3491150085.2068 4113849398.27473 1953123533.36724 5185449376.44416 4920779345.46975 3943270127.53802 4602222954.95451 3891620672.66584 3981155327.25163 4547378572.2156 3572008823.97174 4241818451.54559 4571715269.15921 4400409571.39232 3841883508.90959 4287231424.29849 1965065110.41919 4007955973.42289 4625017973.43786 PC O-39:7 31601999.340225 21567141.5087443 22141120.1152659 22214738.8788184 22938983.5366499 8624787.07211741 24751988.4392801 25031223.3301424 18895391.576433 26599319.9134749 20686609.8773829 19793086.0754833 20538355.6059634 22267505.2540493 23339147.9109107 26387205.8103207 26036957.6605586 21117815.7849117 27710819.2280093 8464003.52822 27761154.5519952 25982530.1708924 PC O-40:7 425140890.529308 328477210.867783 343724009.175045 280294101.340024 272875978.77153 126504455.545329 335670690.402952 339942726.375275 236105168.751869 262985378.821727 238677382.179901 233507709.06522 291167387.545549 276217021.525514 291755716.254987 342141543.388065 276732981.030052 242759453.060377 336017908.120193 122911309.074666 278348007.748866 317929984.709674 PC O-40:8 478652706.71308 341856701.177549 317234586.517183 266823739.233422 303431910.533238 142862412.57721 345714707.117894 388863217.226233 252565255.821 356267394.948404 277773964.352252 341111184.852369 291375537.115825 303472397.375402 359371207.977077 434370762.22285 347646906.062977 286236793.180483 369191597.028935 123274556.245644 348156728.316556 355046208.401315 PC O-40:9 54327155.5486042 41548067.3184209 44742297.1550009 33416714.7526525 39330854.0217692 20558759.0759799 44377836.5071878 43765258.2887429 33059697.9360011 40876379.5993096 33297200.7820804 36488598.5173498 44070078.2895012 32959044.1390652 42113210.0959666 51134006.9802711 38844429.9419884 36881703.7642921 43555120.1424569 17543839.4629925 44448392.7775846 48646597.5041752 PE 18:1/18:1 565980212.582531 260740889.836886 263450627.21812 408717419.313733 317350545.595597 220860131.893925 420528314.185217 372060692.752498 364907078.171008 268146050.938686 322871136.520442 367151096.924714 284065858.341898 414231734.364222 402789437.589318 447769343.872901 336854399.266683 295273411.709992 398460492.549897 243775522.762204 422405253.396265 518600678.127072 PE 18:1/18:2 248182286.430854 75208431.2100785 82677280.2119357 163094046.898314 90009048.4068663 83454347.5418175 137175646.625987 145083610.587016 108370069.176222 96567745.20508 109422533.0857 187437417.291268 104068339.789387 149657693.33155 190842139.183169 228590832.048593 147318713.434433 97810826.146651 161765087.288233 91042211.1551765 164821838.614007 236823300.795266 PE 19:1/19:2 32893571.0576847 36763049.016133 41541627.8060248 38564445.2416641 46116269.9181143 20138739.3627804 48698661.5677583 50520589.2823371 45916313.1541199 41546172.278546 41213825.0042137 44533818.285764 38511194.8910984 40923745.1290497 50147223.8112478 55133041.9547599 57073240.9086578 41896348.3401922 55967160.7239931 35143742.4266543 42320222.2726622 69164687.0915536 PE 18:2/18:2 138124722.306108 40218809.8333638 43080963.4802388 92621431.1658354 50117849.4739252 49456276.9883087 87271426.7969 89758509.9366953 68987107.8046265 48055900.4764664 65133341.7908869 102373446.169752 64830478.3985983 81334988.8602735 120102779.766604 142577286.305221 75639346.0544272 54463456.9080463 100894585.286018 46719431.0810122 106081620.41347 148072004.408402 PE 19:2/19:2 2952372216.93105 2173625046.06023 2167923580.46992 1994585245.79808 2432722530.86083 1189726595.14234 2840218028.4033 2686555397.45516 2097777636.84597 2266286462.71454 2232469693.00076 2009499803.80461 2143263477.53178 2164963212.55723 2260235712.53085 2308272483.59715 2317079844.11825 2132168665.13376 2680984275.02685 1661671148.52296 2145874659.25654 2802343266.30568 PE 19:0/20:4 39114420.6532583 31873682.6100376 26306011.6380041 31639578.4439893 29239857.6545426 15414745.2373112 28753815.2810055 29184538.4947728 27528599.1184673 27862069.2932152 30515062.0751896 21631911.242675 27785638.3904101 23159480.0369351 28724172.6835371 27949661.4215927 31539842.9439149 31102954.9203002 39917252.3670975 23936624.7372679 34494602.3481762 29410330.8882716 PE 18:0/20:5 2260419092.74265 1712860490.81309 1930359463.13735 1275988318.44977 2501344278.1834 774851816.720075 1657649967.57249 1799633231.66719 1196512143.64083 1902558530.18189 1259795188.72424 1365356875.10567 1514102016.68713 1287330609.66476 1641546953.64755 1732873943.73776 1910162944.189 1489082763.38073 1894346948.41447 858010019.068612 1623325624.13865 1942213170.21412 PE 20:2/20:3 316148325.760973 262880712.736196 275806126.509214 195469482.985357 470116901.715673 114183081.903225 206911457.415322 227979475.839117 205015062.878243 253137506.701509 193596126.926429 147951272.006048 216236751.110799 188592981.559927 170860588.816766 195755389.497553 198490027.376567 224723450.260227 228404602.621946 149061927.534091 208431834.116597 220508858.337847 PE 19:2/18:4 3780928.83331031 3725170.51231784 4482214.8442233 2537655.47712866 4397715.61068819 1670059.2054933 4402504.06234379 4252560.32184482 3532828.67319931 4126291.95967448 5040679.00287371 2073197.11498942 4238265.67511115 2118561.60016101 2803223.75703209 3650082.10923784 5584663.18074556 4278076.41623881 5625676.94613009 2788075.43231391 3801149.70296639 2223829.22322748 PE 18:1/20:5 4403498257.52632 3967279912.62758 4336897274.85206 2777952947.8147 4877385446.79731 2140094613.78335 5151190187.35431 5529925996.55438 4144677553.89455 5136604258.16977 4650064606.77949 3666626210.02726 4685871625.9218 3168143390.10212 3783201749.03324 4301530988.39434 5817200775.35462 4342259615.78213 5407728178.05166 2833831007.60868 4051002416.51136 4735347587.53717 PE 19:1/20:5 153006987.511323 126272074.447693 117844360.676017 132485143.583341 145299877.19866 60460442.1172674 161608577.84165 135995309.022319 139222034.812347 131825877.144051 142397641.04919899 89262592.8685571 151423952.115446 125333771.292996 151916225.339425 163783707.137813 172903070.001605 148847140.643063 186680711.170396 99139117.5007306 153951181.461466 126129772.118508 PE 20:3/20:3 10905963714.9747 8920322814.69788 9897176740.4533 8156468595.97662 10769370601.9651 4696930229.97914 11229779596.6869 11798698429.6421 10307100658.0799 10105572988.1777 9966291477.45967 8632996913.19026 9648962736.82364 8813050638.82736 8983812375.8139 9819832257.08072 10397578043.5713 9301350116.13849 11232074114.1287 6999299935.81705 9055968820.70672 10990473235.0445 PE 21:2/20:4 110203414.551935 85107045.2976466 77561270.4329631 94463339.0087036 93015610.1495148 46744067.4582182 81335460.0497764 86916257.8409509 84212863.4322691 79732848.5270711 94867556.9034374 60331937.4531346 78033816.3170471 72042129.4448965 87105741.3940326 88770566.4754984 92823406.4534063 92084844.650553 118618394.544776 69393639.5251999 93483725.423163 82815003.4107502 PE 20:0/22:6 14190745.1095419 8821440.9787451 10563070.8750813 9996471.80005509 8400332.149328 6649332.77274598 12220443.0723337 12541334.6741347 11534482.7654057 9182796.61839729 12508530.9553999 7422288.62151231 9966646.44260514 8811627.52339436 12769700.8101193 11597096.0148631 15129741.4010422 14520994.1045993 17282234.3611682 9963174.49733923 11515792.141402 12867226.5831328 PE 19:2/20:5 70318832.6430958 64588972.9931589 65570433.7994949 46272183.7880045 64031289.6352853 23944480.275288 75966279.5872656 70589761.6453203 57506755.5406088 71980661.6766966 63950322.2048324 49032971.321275 57881482.2536279 52462317.1124056 53113243.3962348 52345417.6538278 75315895.8252347 50764660.2836883 73053992.0935485 32120422.9216422 56428323.5871193 65066620.9538304 PE 20:3/20:4 3087203574.87167 2187534987.54403 2494430126.66183 2027152402.04112 2160788664.8109 1222372088.23346 2706219187.6292 2772508205.52291 2236273214.79237 2672402859.20751 2278455959.28678 2709034516.49085 2382998315.77809 2310834227.34564 2698700402.87152 3003383259.53611 3059671293.06497 2169151913.4129 2767565540.80623 1487868876.33596 2462880850.72226 3418051202.35912 PE 20:4/20:4 1038214486.51629 729601706.952855 847827347.043945 733807290.795375 881948106.564134 439595067.172975 1151369269.35407 1053377775.76364 900051134.234906 854665642.779302 704788780.196561 851739637.186544 895572742.190271 739535818.422791 985473828.638214 954479233.688923 1046598953.35459 699730787.581323 947097245.953805 492749754.666094 922857774.860665 1184551197.47874 PE 20:4/20:5 9117322.41908585 8404794.50954911 16245575.4225571 5278171.95371681 13335946.0418264 6479163.51760735 15858479.2910636 13005350.2144387 12743221.1000171 12240939.7486076 12900325.5040426 7480184.85731526 14862801.7974792 6742361.05547389 10935016.2453981 12405315.1885789 17478114.9091615 11174105.1265125 14260102.8794615 7436406.64181103 10127651.0751821 15385122.2073833 PE 20:4/22:6 12849393.9182433 18430580.381118 22695788.0536127 9553631.38763188 25158556.9526003 7831593.24178107 26174136.3976373 19260875.8149636 23273185.8422853 22568035.5467717 12549797.4879334 10283896.7765427 20266537.1485824 11176987.6990985 11664979.9849436 11349223.3201443 18427415.9865137 12091314.584865 16704223.3463608 8748073.05947534 12222652.3961694 16051456.3479766 PC O-36:7_2 13712366.2277329 13714341.7280615 8627615.16919462 10794526.7515862 14887573.9413395 5568900.23413924 7258578.75398038 9040133.15197269 12424774.5220192 16305019.2359383 13312110.1106768 10156307.4789493 12866616.9093621 8263102.74931591 12686446.2406134 9962609.32251878 9774628.73043364 12298211.320071 8701563.69371465 8423883.33510544 16965494.8368161 13912451.7035375 PE O-16:1/18:2 109470394.948537 70555871.4092245 60936562.5274934 84646118.9491002 73705355.8861301 45968350.1540805 98597266.582317 96324358.9835922 73402799.481219 64981828.417839 70908653.5769851 97920848.932395 80335857.5313919 76764986.9054418 91999256.8382763 96644846.1517296 100272044.851356 82930937.5887549 100437304.613946 63388037.3517379 84727604.5668859 111919548.542732 PE O-18:1/18:2 91184650.7420041 71308618.3266374 52564365.9754916 76863976.7341664 66950991.7865629 37343616.9703686 75771392.9309359 69838373.813858 68092521.4713584 52792898.5412386 56182780.5915223 60470134.2217361 63410320.1570549 63234318.1482219 73990485.8469907 76824910.8779889 77437913.525762 77550547.4111316 80452077.2789457 58771899.2640279 63388389.3694382 82999267.7335751 PE O-18:2/18:2 123030651.771321 79503405.6059612 72757137.4778091 84826226.4610079 81849094.74541 62676745.2697965 107272983.194048 127400802.733767 78319056.7080732 87414107.6740987 66810758.2422051 93481491.4005631 95541008.3195946 91910804.4712423 101274312.485067 82531458.6500684 133424158.095074 132184333.2656 136860801.054127 64739380.7255457 106169473.914128 93710367.0700516 PE O-16:1/20:4 397843545.82814 297909148.522432 292357696.213496 274161175.997565 317597787.452182 140628535.857267 369037002.87247 384719034.75875 279169811.313349 317805402.207408 298706048.737369 344771664.916605 295103482.041662 325639753.412788 318186322.831846 369983861.117979 376764028.897478 272228907.897459 355117804.628797 222974483.272278 316864736.013813 396584453.666776 PE O-16:1/22:4 154482505.056227 128529484.957555 111603546.898621 99917524.3626696 116431251.930099 53765211.6304206 126373254.470845 133702791.988023 90299425.9803126 116568683.701063 94535026.841594 110454887.397664 119826365.5528 113883523.049525 107862923.308041 127110015.671922 134352655.8857 99722550.881844 133744358.942396 69369050.6840697 97157853.3144428 151021672.805614 PE O-16:1/22:6 3110995969.04659 2395471710.45258 2226225914.07564 2174341372.92224 2575859663.32237 1259787945.88058 3002143657.67581 2978858529.00068 2415745609.36566 2595043250.73276 2361576060.39797 2622065050.34415 2618876899.48732 2395332299.11041 2643359294.97524 2969601269.03765 3224669870.87185 2356404633.37989 3052443251.73152 1608770968.01482 2630904191.56621 3162095797.17871 PE O-18:1/22:6 1610365927.1872 1515821867.76848 1352567746.40231 1266395382.00092 1329495322.40355 690386131.347744 1463583611.53745 1371466711.7248 1247032980.47742 1178003568.55946 1145486611.76593 1023295914.0361 1300525713.18754 1131218974.60021 1195053656.18828 1279238890.40852 1432826795.8312 1403996228.79237 1477352725.75439 938310021.564916 1158889581.86184 1463273848.49818 PE O-16:2/22:6 11093608.6212868 6497296.27879626 5565099.89922715 6394015.16332675 11158935.2281116 2880539.15492228 15269849.9806227 11796476.4940446 6809898.05569064 7915523.78207862 9102764.55159482 6995795.53513265 8543892.81403644 8109193.99239704 6222614.91670969 6863116.30586065 9293596.09437281 5865977.64221998 11682857.0301144 4368426.23597192 6784266.68059996 8781627.37365664 PE O-18:2/22:6 1177369751.76124 920768780.656906 810908293.80857 805434530.716535 938559530.86749 504998297.360173 945300197.14373 1024264203.44287 781613911.562656 975621626.542267 812474129.889311 1024784199.98676 860895470.277042 899653707.659278 1026920111.73215 1127207787.86555 1164013483.99852 915320847.416432 1060877645.46157 515541770.079719 982430697.153888 1167501074.466 PE O-20:2/22:6 50112638.9575356 45887656.8878285 59590513.3360225 49946555.551916 35771980.7467238 19751408.597264 30636182.1358528 60673913.1614498 49406013.0070796 37643585.7933612 46691793.0716485 44660498.9144278 83247622.0679767 67178453.3567399 51692442.8142443 64106537.2162231 70731517.7216261 27881375.4624601 61096327.1144968 25441992.6167918 84274877.5625554 43671851.932711 PE O-18:3/22:6 275968844.889983 231321121.766325 224857424.838982 182185865.35309 235606035.34653 118644025.599909 271544655.887619 249139041.755689 200099066.863502 227586134.230733 194920469.715801 216022445.173334 224769542.274486 197743212.766392 247549584.815517 274565763.645589 289722235.425346 219877465.927101 256303323.69643 126196435.627738 247464604.0879 284833829.4532 PS 18:1/18:1 9971726.12441982 8154585.83874556 8028176.37992109 8759423.33603631 8998414.00581365 2314569.77068509 9260709.69668194 11198452.6749198 10356267.677114 5723992.32855258 7146043.77136537 5936319.00929035 6605208.76666603 10094916.2262246 8967908.96025957 12672512.911773 7492650.72811257 7975735.19195673 10078454.2073864 7730319.11970997 9328622.79191358 7250489.30510444 PS 20:2/20:3 9299511.50945531 9624795.32059115 8079733.50194547 5995636.70952849 12142891.2956039 2471651.47509153 5296655.23852785 5551339.66049949 5343505.73347941 5920971.05696568 4289921.93320104 3795031.74052043 3253312.48147313 5610403.01014657 5804868.63251984 5489295.12139249 5950137.77282965 7515802.72385649 6568169.69158867 5505138.15185422 5349003.30138478 5485875.62389227 PS 20:3/20:3 289249486.275647 291429070.960388 235202846.244764 220885432.608054 231271744.187907 113493621.631289 266629942.877306 222213904.731513 271528760.689056 247950693.702045 223527639.669903 200963357.980891 213722963.035533 218706770.005716 199879011.225986 232652218.015711 236530218.593549 266147620.48496 269153744.882424 211017494.677256 207201479.136142 217861994.307116 PS 22:5/22:5 1626030.94678242 1611874.02542425 1209087.66882936 909217.983576068 1140547.68064801 417170.096144311 1678065.42265831 1273236.47307933 1616385.46206658 1437975.34464844 855854.018497775 905807.412840831 1272794.61532274 1504753.44139881 1102441.33971878 1072392.15965939 926093.679714806 1126035.77910868 933346.663226466 638835.415714651 1154830.118965 1193547.86932882 SM 8:0;2O/26:0 69354080.2691486 66761304.5034848 70518743.8928532 45879957.3777669 75793687.317752 23647647.5947224 81456380.0712864 81014158.2937409 61112903.9967796 82739277.2825248 54817519.0898163 61927091.4021025 68800402.3183603 53682569.760107 48735926.382694 58008303.0081709 64084646.56495 54747914.8211385 62935317.4170787 31490608.7789807 49411219.0622942 63697767.5211699 SM 8:0;2O/28:0 7870970.81485686 6190314.84079341 6031196.97379059 5381581.71354924 7423027.71167418 2660570.10909459 9116206.57434955 6765977.1313829 6245977.21075949 7382411.3722814 4416711.9354247 6928751.58392412 6629183.61749298 8501348.70118501 5410951.56500914 7220399.15328 5755158.00832657 3954848.23921968 6357002.12314006 2892957.93891632 5019104.32456806 7849060.42373246 SM 8:0;2O/32:0 2466548.55388634 2784836.5716915 2094538.45911556 2199817.58641087 2532445.23739396 1387045.51147044 2474852.41659329 2443627.80361546 3186742.51210504 2297621.35672571 2003380.91354133 2273635.42490719 3061811.50574914 2350180.24198234 2678337.92406186 3410400.97024164 3074602.65572447 3512788.12782141 4211407.88371938 2482262.65438943 2755132.3411294 2562412.6160893 SM 8:1;2O/24:0 1028772.55803652 972808.592232657 835250.037446754 778051.39742547 1245835.68454068 415529.653948448 1154852.1389446 1081395.02865974 663911.000179328 1162868.48659848 778928.674734989 1380746.4091755 1062546.71853205 1126360.23809038 1016089.73866194 1065148.64065357 986719.156180185 640482.512840447 838800.034690418 541534.91504122 1113220.13691541 1660072.54783528 SM 8:1;2O/25:0 8424244.01085266 6937668.62274941 5758782.65715093 5676750.07032935 7944902.56035913 3039171.33259577 6502489.7838677 7197332.33708849 5134360.69003527 7809604.10371663 5047368.86333928 7233596.82362243 6487464.51807281 6703725.19414556 5407581.98411159 5720876.29055203 6044202.53105093 4173504.21014098 6034208.75642592 3237756.66547876 5905017.57307579 7121784.96068354 SM 8:1;2O/26:0 1187775144.95234 997477053.464982 986779441.431969 747723467.751609 1058846599.06038 426301391.183892 1135154030.34837 1093442530.53221 852992564.283487 1075593504.08295 835075782.613953 1032317491.58212 935819760.307248 947322715.56272 857578020.447965 966814778.365096 1000670632.83781 691003583.48436 963670390.466609 541978841.287975 842429480.930411 1130835213.66957 SM 8:1;2O/27:0 22308210.1843697 12675161.5001156 12281805.8501492 11743851.4414047 17149405.1365166 5355744.10784301 16936846.5195868 15383680.2344713 11572282.8019056 15162544.5508794 12054802.356981 15088534.7049295 13423288.9838812 15732122.2236905 11428791.0559369 16775190.097607 13550945.5449476 9735295.78742337 15644870.6036656 6812647.38612872 14768353.8733963 18807840.4194596 SM 8:1;2O/28:0 424424699.934636 335018583.899618 346899247.567228 254940408.384757 427581684.912511 134958398.561436 429410879.887919 378387013.290035 323622736.645119 374080255.894426 314552047.620044 406315415.755524 342100438.234324 346550580.417457 313562140.830996 359720549.916642 356050147.419465 242332907.057362 357092558.954625 197363509.438996 328509624.149764 420178245.448443 SM 8:1;2O/29:0 80839735.2870746 49288834.8633261 49056512.8571817 44157914.7774601 60319903.6505163 20371369.8291912 62383625.9314821 50226694.6519879 45887028.5063651 54121130.3620306 47354496.2118835 48535000.4753948 38426367.7835072 48975576.6943677 51206603.569439404 55516283.0554848 57958087.3399478 44688981.8388853 71924498.5969339 32767027.6902968 54802590.2856521 56521812.6201891 SM 8:1;2O/30:0 277285402.076005 216284942.837387 204597072.249616 183638700.086745 205723482.175435 106356771.754282 239502352.874005 237730226.709008 203398320.358483 208155425.732306 186966367.35704 187477910.80634 196833008.771479 194740192.543391 225008630.277289 242741632.390332 256948253.574516 217555384.447973 262781480.610954 150469431.943097 204089366.714702 235059474.489714 SM 8:1;2O/31:0 73485431.2300738 57807650.2557509 46455185.2623802 51501449.1145272 55355611.5786688 26537560.2954076 47349793.7307097 55412380.1304121 53946484.1548001 49504240.3615341 50787751.2625867 48848358.215238 42386649.331161 50675172.8224355 57780484.2723164 60630546.1617398 63028140.7925932 63348423.8945055 78630700.4341261 47657093.7744208 60333072.9271314 57099922.293235 SM 8:1;2O/32:0 337656781.290887 262311073.111754 212346530.743609 237696953.271176 256558305.462782 137780137.175397 271762919.321974 278949079.367046 297889446.077877 235661763.815987 231390285.291487 243531374.776189 221984162.436629 256638145.744392 292941933.033 296736066.892717 322781397.134087 334681859.478502 383357757.179243 241564658.457893 258743967.03038 251079831.654525 SM 8:1;2O/33:0 74818913.6423055 58591840.1183654 50164957.7931335 56186850.4277799 65479232.2702503 30609977.3842599 58014700.798419 63624762.3465739 69352021.7286039 57887511.1630746 56417080.6998907 52770238.3370981 48550971.7412587 63252754.6170503 72353519.0791158 58880625.7221469 58771541.3498387 74310553.3304488 92920732.7951601 57315923.4272223 64665855.547875 63750893.6975088 SM 8:1;2O/34:0 63282331.5161984 60324552.2815959 46789584.6820159 54098660.589573 59063196.79871 28613009.461995 56769305.2041811 60752191.1244175 69950793.752009 47969239.6336687 52595618.816424 55483193.3244159 51500404.0359 58514766.2171894 63408833.6088554 62445311.5615141 65618012.0352421 77397014.8942515 87653914.2732018 60616163.2130186 57707547.277195 56872551.1421447 SM 8:1;2O/26:1 10433017.5406528 8785498.7070132 8968448.18088768 6236480.52171188 5586355.35156187 3657265.67661919 9815497.01744856 8766027.59127726 6617520.45366483 8963657.79584437 7014426.89387976 10138711.1628061 8402077.40026511 9444153.10755825 8568449.55924589 8485245.42583762 8494560.99052311 4985748.34839643 7838557.11667285 2742529.75797833 8122991.8099447 13788517.1148514 SM 8:1;2O/28:1 33832802.7829557 23586342.6206357 28980770.2304415 16076599.1419197 18353459.6876208 9797422.50375045 32413198.211559 26685655.8934133 21882328.4808436 30072810.2206811 18934497.3316057 28953825.1579938 24205242.8880204 27121099.073154 23767153.0367767 28311913.1511464 23639714.3928513 14736767.983113 20467605.3883431 11022886.8851794 24380784.6353528 44123499.4055884 SM 9:1;2O/28:1 13854186.8419441 8237243.10488772 7419282.58077681 6322805.11025689 6043881.38217399 2594042.78529849 8718969.23493611 7858469.0490069 6594542.36541223 9038338.61482176 7400742.22900288 7732357.33992087 5224822.86839608 8531863.00458176 8926523.81992717 10169340.7396535 10082617.0734731 5889436.28533741 10864644.0375317 3201716.6167872 9226485.89475043 9983886.54636804 SM 8:1;2O/30:1 177230858.330418 102219177.897578 105484266.073652 88867978.7963251 65112994.0070102 54179828.092158 138369328.819044 154414051.964605 99149730.7498671 119632186.421517 101229086.227027 126245928.08957 105473800.33494 113733612.257016 153036982.658636 184175815.966084 175360545.281203 103723606.759147 153618105.68683 63207288.9914518 126539618.272406 165421082.778675 SM 9:1;2O/30:1 20854085.9835565 12797135.8387055 10949832.3133664 14737185.3896244 6340683.04550268 7243806.90944883 15398968.6371571 16082421.1681839 13076047.5599916 12509088.1049471 16476837.0038971 10656811.523934 13730755.7947385 11330376.0375752 19120306.1795694 21096477.7016046 22447562.6037093 17819465.7563679 24771909.9250283 9713086.75727605 19180422.9449945 20452238.164106 SM 8:1;2O/32:1 75491681.7753779 53671275.0023564 45287517.6670508 49457224.5277223 33112378.5353231 29893219.8897577 67022707.4224579 86586688.03231 52925958.6440944 51528889.3928406 47585468.1405155 53730346.7526932 54281691.7096646 55559868.3047226 65515821.8020697 73409511.119691 78582084.6191344 54025951.4443207 65865458.433836 37986777.4243475 58658023.871928 77703266.6411285 SM 9:1;2O/32:1 26174710.3229569 19914516.7170173 16643828.5473102 20285447.7993312 13851240.7976084 9582070.96876102 22756844.4051265 25869217.6648547 19734226.2349947 19618106.7675532 19072099.439075 17891041.6122808 19104752.7351339 20322239.5888824 24323730.8849852 24143027.5090837 20708174.1644727 18286259.9091779 22760202.5153307 12803579.4592395 21181752.5886633 27090168.7137192 SM 8:1;2O/34:1 281024107.086664 215953860.276052 170035768.058933 177313613.31664 240740059.110453 91198562.5211309 223346628.932269 209066364.391016 233660227.757634 198086679.430951 177072572.073293 235744506.324471 159881301.579728 227977916.659273 181337878.004411 238985675.793561 243657596.176096 190896297.121873 242711903.890663 151850487.071599 182384601.895048 187136958.975132 SM 8:1;2O/34:2 67232970.6447565 52873633.2165713 46026890.3623628 42540702.1852309 52496412.177203 22217892.9413572 67190845.4502396 59396506.9817641 47611376.3272076 53917064.9885919 45844720.1487637 60784561.7113496 50520296.7015846 57479511.2267477 54784665.195159 63381267.4833396 59015447.7676126 39452830.3276348 55244749.8714171 31582038.8333476 48374785.1560687 65646327.1862133 (R)-Ketamine 3769439923.03512 2355898159.38238 2260150383.15488 3084969798.45081 3957536404.67685 2465452095.71537 2473906276.6674 4234558004.14953 1950859105.16266 3007675790.65814 3454401191.65489 3514252052.23311 1822849200.40052 2621958350.94743 725789998.823675 2852079115.15357 4057822529.03673 1845242179.57679 3031042390.03892 1435254470.50861 2063944441.98346 3467196549.26905 Bis(2-ethylhexyl)adipate 31547161.9981671 9284517.2759012 31041309.3038994 110793535.331568 31442160.1365165 16237630.7933139 135908521.317826 79778312.4172299 22386076.7305656 67473350.2812335 76424524.454356 90882381.6542349 33455479.0062042 55887117.0984752 132191394.451165 36626543.0972324 37437797.2222897 24156537.9414846 28092437.376911 28531335.2063045 32087200.1973265 44668260.2527733 Linoleoyl ethanolamide 8524612.9025663 12473209.5118983 5638548.3177228 5229275.13798116 7816502.85642111 4564718.89797923 9828222.21263678 5538860.29622133 11012083.2489971 7828229.00917597 8795613.41455678 11376224.3535789 7765919.00246329 7735446.43127579 10672061.7694282 10311713.8535754 10365523.8020613 7532762.40802067 11857205.0680482 7709520.78458865 9673283.68931772 9970318.31006995 MLCL 18:2_18:2_18:2_2 13260795.1750557 9238350.0904296 11714604.1439493 21151834.3291659 18732091.7100762 6680887.90971499 16288515.8343142 21470474.6891212 12846772.289214 11783435.6202851 13556543.9997385 15244992.6376474 10368132.0050863 11628214.8300417 21099046.0327667 21037148.9534151 16249986.4841117 15482519.5560691 13573584.6139074 16970788.3643077 27199558.5796053 18577733.9314312 Norketamine 16681908.6666814 15050495.40749 21520648.1557134 15371400.7499519 11434629.442813 20316404.2542569 23900332.8056364 18018140.1546995 11700127.5103756 16930735.4466961 18276431.1995275 16967466.0851868 18253787.0930954 16771450.4845599 16213072.7652628 22177342.9579401 17548610.9812351 9816795.17043532 17221565.7283105 8333769.81105641 14412045.8566355 13146361.9167732 Oleoyl ethanolamide 3667864.93644872 3108825.11061196 1768737.58737589 1742256.52669015 2500585.18777511 926616.319131538 2332133.64037171 1978862.74174624 2999845.05425309 2365965.18972559 2671773.47142606 3722901.08879615 1589151.44883016 2939052.85910293 3926131.42166478 4567705.33791998 3642444.06666207 1879429.75602631 3405469.79610489 2016089.13244115 3326242.62232264 4118808.14550199 Palmitoyl ethanolamide 4891248.50772535 8762235.82180059 3970259.55178305 2853331.68061122 5314885.04830259 2937414.77015253 6024779.03940876 3695011.09452219 7191943.25101987 5749868.8436137 5940040.08841993 6652494.91618647 5870399.47120116 4559505.26146143 6422877.59108137 6702282.96117206 7418879.35003025 5835253.62212196 8081875.22341776 5502074.96925899 5548322.8446367 6235643.36864319 SPB 18:0;2O 3584515.97744052 1054387.28554509 1252702.72570776 1095375.60342816 789537.6925708 485906.866525228 2236112.27949208 1685566.45531294 1254337.93621735 2340866.57545556 485412.785039118 1048491.40777338 1069085.76007085 2138977.44526336 2686086.40053616 3459358.59643053 977842.261989948 808686.710299689 766393.172088841 851876.535757858 2797672.90829053 2914864.3102858 SPB 18:1;2O 7914522.95422252 4719230.23757666 5663145.03130661 3951692.4214762 3727662.23871606 1698273.37940249 6178629.25590246 4817932.2338527 4817024.36531643 7049726.44191707 3260310.44238842 4384765.158784 3897827.87647347 4658754.94357374 3592763.65195182 4101117.87621527 3906517.56606596 3552803.28864592 3360636.13404364 2216030.66165384 4156435.79282104 6840165.58076504 Stearoyl ethanolamide 4671018.10107813 6740900.23589823 3202656.91697354 2998297.20456604 4733802.57290221 2340691.14969201 5093250.91411949 3179695.31471862 5907742.80565359 4359606.75950789 4816769.56451578 5886477.32276704 4533070.15825939 4733643.22562672 5630402.10841385 5843744.43690564 5421338.45231744 3831644.99300612 5665569.90149897 3841067.06278733 5065784.38608143 5311308.16866531 Xylazine 397623854.477398 346956051.038438 213509347.973878 256988223.547787 440302756.729946 179251167.262729 311415442.569502 352454721.458329 302346675.573204 234564696.20331 392760975.543315 431319876.58549 251759677.475553 394920837.634295 172979280.32009 482727125.476878 387944959.62193 168771572.106809 268864092.442381 161650074.824607 209209613.817551 460307239.676314 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Neutral_masses Retention_time Cer 17:1;2O/16:0 523.49652 8.267 Cer 17:1;2O/18:0 551.52806 11.088 Cer 18:0;2O/16:0 539.52786 10.621 Cer 18:0;2O/24:1 649.63748 14.543 Cer 18:1;2O/16:0 537.51202 9.572 Cer 18:1;2O/18:0 565.54369 12.806 Cer 18:1;2O/20:0 593.57483 13.8 Cer 18:1;2O/21:0 607.59053 14.106 Cer 18:1;2O/22:0 621.60617 14.382 Cer 18:1;2O/23:0 635.62195 14.643 Cer 18:1;2O/24:0 649.63751 14.883 Cer 18:1;2O/24:1 647.62178 14.355 Cer 18:2;2O/16:0 535.49644 7.451 Cer 18:2;2O/18:0 563.52779 10.033 Cer 18:2;2O/19:0 577.54382 11.624 Cer 18:2;2O/20:0 591.55915 13.182 Cer 18:2;2O/24:1 645.60606 13.877 CL 18:1/18:2/18:2/18:2 1450.98765 15.429 CL 18:2/18:2/18:2/18:2 1448.97209 15.201 DG 16:0/18:2 592.50675 13.078 DG 18:1/18:2 618.52228 13.196 DG 18:2/18:2 616.50681 10.835 DG 18:0/20:4 644.53802 13.715 LPC 16:0-SN1 495.3324 1.334 LPC 18:0-SN1 523.36361 1.893 LPC 19:0-SN1 537.37961 2.288 LPC 16:1-SN1 493.31685 1.045 LPC 17:1-SN1 507.33272 1.216 LPC 18:2-SN2 519.3324 1.063 LPC 18:3-SN1 517.31698 0.953 LPC 20:3-SN1 545.34821 1.163 LPC 22:4-SN1 571.3639 1.291 LPC 22:5-SN2 569.3482 1.068 LPC 22:6-SN1 567.33225 0.987 LPC 24:6-SN2 595.36401 1.187 LPC O-18:2 505.35336 1.582 LPE 19:0 495.33262 2.407 LPE 18:2 477.28547 1.112 LPE 20:3 503.30123 1.219 LPE 20:4 501.2855 1.077 LPE 22:5 527.30118 1.226 LPE 22:6 525.28537 1.026 PC 15:0/15:0 705.53108 6.806 PC 15:0/16:0 719.54651 7.851 PC 16:0/16:0 733.56182 9.043 PC 16:0/17:0 747.57814 10.448 PC 17:0/17:0 761.59346 12.037 PC 16:0/16:1 731.54643 7.211 PC 16:0/17:1 745.56218 8.177 PC 17:0/17:1 759.57739 9.365 PC 17:0/18:1 773.59352 10.837 PC 18:0/18:1 787.60872 12.428 PC 18:0/19:1 801.62473 13.352 PC 19:0/19:1 815.64024 13.632 PC 16:1/16:1 729.53026 5.68 PC 16:0/17:2 743.54612 6.547 PC 17:1/17:1 757.56178 7.537 PC 18:1/18:1 785.59301 10.051 PC 18:0/19:2 799.60913 11.616 PC 20:1/20:1 841.65629 13.665 PC 21:1/21:1 869.68715 14.353 PC 17:1/17:2 755.5463 6.569 PC 17:0/18:3 769.56228 6.82 PC 18:1/18:2 783.57736 7.781 PC 18:1/19:2 797.59282 8.892 PC 19:1/19:2 811.60898 10.867 PC 17:2/17:2 753.53087 5.494 PC 17:0/18:4 767.54636 6.296 PC 18:2/18:2 781.56171 6.286 PC 18:2/19:2 795.57747 8.381 PC 19:2/19:2 809.59281 9.648 PC 19:0/20:4 823.60905 11.144 PC 20:2/20:2 837.62464 11.817 PC 18:2/18:3 779.54615 6.031 PC 19:2/18:3 793.56245 6.584 PC 18:0/20:5 807.57736 7.42 PC 19:0/20:5 821.59169 9.378 PC 20:2/20:3 835.60862 9.751 PC 21:2/20:3 849.62465 11.289 PC 20:0/22:5 863.6404 12.87 PC 18:3/18:3 777.53079 5.13 PC 19:2/18:4 791.54637 5.878 PC 18:1/20:5 805.56168 6.031 PC 19:1/20:5 819.57732 7.468 PC 20:3/20:3 833.59297 8.951 PC 21:2/20:4 847.60888 10.365 PC 20:0/22:6 861.62464 11.911 PC 18:2/20:5 803.54633 5.03 PC 19:2/20:5 817.56116 6.126 PC 20:3/20:4 831.57735 6.942 PC 20:1/22:6 859.60864 9.045 PC 20:4/20:4 829.56173 5.628 PC 20:2/22:6 857.5926 7.243 PC 20:3/22:6 855.57735 6.035 PC 20:4/22:6 853.56196 5.334 PC 22:5/22:5 881.59326 6.564 PC 22:6/22:6 877.56194 4.996 PC O-32:0 719.58287 10.793 PC O-34:0 747.61425 13.366 PC O-36:0 775.64521 13.995 PC O-32:1 717.5671 10.36 PC O-34:1 745.5981 10.989 PC O-36:1 773.62936 13.421 PC O-34:2 743.58288 8.929 PC O-36:2 771.61407 11.926 PC O-34:3 741.56762 7.35 PC O-36:3 769.59866 11.394 PC O-36:4 767.5827 8.559 PC O-38:4 795.61426 11.431 PC O-36:5 765.5672 8.174 PC O-38:5 793.59788 10.025 PC O-40:5 821.63053 11.574 PC O-36:6 763.55129 5.993 PC O-38:6 791.58331 9.105 PC O-40:6 819.61444 10.566 PC O-38:7 789.56762 7.538 PC O-39:7 803.5829 8.384 PC O-40:7 817.59833 10.042 PC O-40:8 815.58332 7.775 PC O-40:9 813.56703 6.28 PE 18:1/18:1 743.54629 10.841 PE 18:1/18:2 741.53085 8.392 PE 19:1/19:2 769.56185 11.675 PE 18:2/18:2 739.51483 6.742 PE 19:2/19:2 767.5462 10.401 PE 19:0/20:4 781.56221 11.967 PE 18:0/20:5 765.53026 8.037 PE 20:2/20:3 793.56194 11.641 PE 19:2/18:4 749.5002 6.292 PE 18:1/20:5 763.51506 7.248 PE 19:1/20:5 777.5306 8.362 PE 20:3/20:3 791.54628 9.658 PE 21:2/20:4 805.562 11.126 PE 20:0/22:6 819.57741 12.793 PE 19:2/20:5 775.51467 6.575 PE 20:3/20:4 789.53028 7.467 PE 20:4/20:4 787.51488 6.024 PE 20:4/20:5 785.49927 5.007 PE 20:4/22:6 811.5154 5.688 PC O-36:7_2 761.53571 9.09 PE O-16:1/18:2 699.52012 9.323 PE O-18:1/18:2 727.55146 12.387 PE O-18:2/18:2 725.53531 9.596 PE O-16:1/20:4 723.51998 8.89 PE O-16:1/22:4 751.55152 10.899 PE O-16:1/22:6 747.52005 8.212 PE O-18:1/22:6 775.55133 10.936 PE O-16:2/22:6 745.5047 6.602 PE O-18:2/22:6 773.53578 8.458 PE O-20:2/22:6 801.56746 11.033 PE O-18:3/22:6 771.5203 6.794 PS 18:1/18:1 787.53612 7.723 PS 20:2/20:3 837.5524 8.345 PS 20:3/20:3 835.5361 6.956 PS 22:5/22:5 883.53582 5.176 SM 8:0;2O/26:0 704.58341 7.437 SM 8:0;2O/28:0 732.6139 9.965 SM 8:0;2O/32:0 788.67664 13.845 SM 8:1;2O/24:0 674.53623 5.054 SM 8:1;2O/25:0 688.55213 5.805 SM 8:1;2O/26:0 702.5674 6.653 SM 8:1;2O/27:0 716.58232 7.739 SM 8:1;2O/28:0 730.59869 8.928 SM 8:1;2O/29:0 744.6146 10.368 SM 8:1;2O/30:0 758.63015 11.918 SM 8:1;2O/31:0 772.646 13.261 SM 8:1;2O/32:0 786.6612 13.611 SM 8:1;2O/33:0 800.67693 13.925 SM 8:1;2O/34:0 814.69263 14.206 SM 8:1;2O/26:1 700.55198 5.278 SM 8:1;2O/28:1 728.5832 6.991 SM 9:1;2O/28:1 742.59891 8.127 SM 8:1;2O/30:1 756.61485 9.364 SM 9:1;2O/30:1 770.63202 10.848 SM 8:1;2O/32:1 784.64587 12.479 SM 9:1;2O/32:1 798.66107 13.385 SM 8:1;2O/34:1 812.67681 13.584 SM 8:1;2O/34:2 810.66139 12.408 DG 41:0 711.67443 15.202 DG 34:1_1 611.54908 13.691 DG 34:1_2 594.52241 13.69 DG 36:1 639.58041 14.272 DG 36:2 620.53805 13.751 LPC 15:0 481.31697 1.144 PC 42:1 871.70288 14.708 PC O 38:3 797.63183 14.82 PC O 38:5 793.59648 9.579 DG 38:2 665.59616 14.291 DG 38:3 663.58044 13.847 DG 40:3 691.61162 14.384 DG 40:4 689.59595 13.712 DG 42:6 713.59622 13.526 DG 42:7 711.58031 11.811 PE 23:5 555.29645 1.171 PE 26:6 595.3274 1.02 LPC 18:1 521.34803 1.319 LPC 20:1 549.37962 1.822 LPC 20:4 543.33235 1.03 PE O 36:2 729.56715 12.968 PE O 38:4_2 753.56752 12.417 PE O 40:6 777.5674 11.488 (R)-Ketamine 237.09191 0.62 Bis(2-ethylhexyl)adipate 370.30833 3.309 Linoleoyl ethanolamide 323.28244 1.501 MLCL 18:2_18:2_18:2_2 1186.74252 13.062 Norketamine 223.07638 0.638 Oleoyl ethanolamide 325.29809 1.936 Palmitoyl ethanolamide 299.28244 1.816 SPB 18:0;2O 301.29803 1.335 SPB 18:1;2O 299.28241 1.22 Stearoyl ethanolamide 327.31381 2.662 Xylazine 220.10331 0.6 METABOLITES_END #END