#METABOLOMICS WORKBENCH chhzhu_20190314_132044 DATATRACK_ID:1674 STUDY_ID:ST001151 ANALYSIS_ID:AN001899 PROJECT_ID:PR000770 VERSION 1 CREATED_ON March 19, 2019, 1:07 pm #PROJECT PR:PROJECT_TITLE Fast Food Project PR:PROJECT_TYPE Dietary intervention study PR:PROJECT_SUMMARY A human study looks at 4-day effect of fast food vs Mediterranean to HDL PR:PROJECT_SUMMARY composition and function, host metabolome and gut microbiome PR:INSTITUTE University of California, Davis PR:DEPARTMENT Department of nutrition PR:LABORATORY Zivkovic PR:LAST_NAME Zivkovic PR:FIRST_NAME Angela PR:ADDRESS 3402 Meyer hall, Davis, CA, 95616, USA PR:EMAIL amzivkovic@ucdavis.edu PR:PHONE +1(530)752-3973 #STUDY ST:STUDY_TITLE 4-day dietary effect of fast food vs Mediterranean diet to HDL lipidome ST:STUDY_TYPE Dietary intervention study ST:STUDY_SUMMARY In this randomized order cross-over study, ten healthy subjects consumed a ST:STUDY_SUMMARY Mediterranean (Med) and a fast food (FF) diet for 4 days, with a 4-day wash-out ST:STUDY_SUMMARY between treatments. Lipidomic composition was analyzed in isolated HDL fractions ST:STUDY_SUMMARY by an untargeted LC-MS method with 15 internal standards. HDL PE content was ST:STUDY_SUMMARY increased by FF diet, and 41 out of 170 lipid species were differentially ST:STUDY_SUMMARY affected by diet. Saturated fatty acids (FA) and odd chain FA were enriched ST:STUDY_SUMMARY after FF diet, while very-long chain FA and unsaturated FA were enriched after ST:STUDY_SUMMARY Med diet. The composition of PC, TG and CE were significantly altered to reflect ST:STUDY_SUMMARY the FA composition of the diet whereas the composition of SM and ceramides were ST:STUDY_SUMMARY generally unaffected, indicating that glycerolipids may be sensitive markers of ST:STUDY_SUMMARY dietary intake, whereas sphingolipids are more indicative of non-dietary ST:STUDY_SUMMARY factors. Results from this study indicate that the HDL lipidome is widely ST:STUDY_SUMMARY remodeled within 4 days of diet change and that certain lipid classes are more ST:STUDY_SUMMARY sensitive markers of diet whereas other lipid classes are better indicators of ST:STUDY_SUMMARY non-dietary factors ST:INSTITUTE University of California, Davis ST:DEPARTMENT Nutrition ST:LABORATORY Zivkovic ST:LAST_NAME Zivkovic ST:FIRST_NAME Angela ST:ADDRESS 3402 Meyer hall, Davis, CA, 95616, USA ST:EMAIL amzivkovic@ucdavis.edu ST:PHONE +1(530)752-3973 ST:NUM_GROUPS 4 ST:TOTAL_SUBJECTS 10 ST:NUM_MALES 5 ST:NUM_FEMALES 5 #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 SU:AGE_OR_AGE_RANGE 19 - 26 yr SU:WEIGHT_OR_WEIGHT_RANGE 50.6 - 94.1 kg SU:HEIGHT_OR_HEIGHT_RANGE 1.6 - 1.85 m SU:GENDER Male and female SU:HUMAN_SMOKING_STATUS Non-smoker SU:HUMAN_EXCLUSION_CRITERIA Subjects with anemia, diabetes, thyroid disease, MetS, cancer, previous SU:HUMAN_EXCLUSION_CRITERIA cardiovascular events or other disease diagnoses were excluded. Subjects were SU:HUMAN_EXCLUSION_CRITERIA also excluded if they had extreme dietary or exercise patterns, or were taking SU:HUMAN_EXCLUSION_CRITERIA prescription medications or other supplements known to alter lipoprotein SU:HUMAN_EXCLUSION_CRITERIA metabolism such as isoflavones. #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS 107 FFS107A Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 107 FFS107B Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 107 FFS107C Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 107 FFS107D Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 108 FFS108A Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 108 FFS108B Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 108 FFS108C Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 108 FFS108D Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 109 FFS109A Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 109 FFS109B Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 109 FFS109C Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 109 FFS109D Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 110 FFS110A Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 110 FFS110B Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 110 FFS110C Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 110 FFS110D Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 111 FFS111A Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 111 FFS111B Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 111 FFS111C Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 111 FFS111D Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 112 FFS112A Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 112 FFS112B Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 112 FFS112C Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 112 FFS112D Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 113 FFS113A Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 113 FFS113B Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 113 FFS113C Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 113 FFS113D Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 114 FFS114A Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 114 FFS114B Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 114 FFS114C Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 114 FFS114D Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 116 FFS116A Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 116 FFS116B Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 116 FFS116C Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 116 FFS116D Treatment:FF | Timepoint:Post SUBJECT_SAMPLE_FACTORS 118 FFS118A Treatment:Med | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 118 FFS118B Treatment:Med | Timepoint:Post SUBJECT_SAMPLE_FACTORS 118 FFS118C Treatment:FF | Timepoint:Pre SUBJECT_SAMPLE_FACTORS 118 FFS118D Treatment:FF | Timepoint:Post #COLLECTION CO:COLLECTION_SUMMARY HDL fractions were isolated from plasma using a 2-step sequential density-based CO:COLLECTION_SUMMARY ultracentrifugation method CO:SAMPLE_TYPE Blood (plasma) CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY Each subject was given either a fast food or a Mediterranean for 4 days in TR:TREATMENT_SUMMARY randomized order. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Lipids were extracted using methanol-MTBE method. SP:SAMPLEPREP_PROTOCOL_FILENAME protocol.pdf #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Waters Acquity CH:COLUMN_NAME Waters Acquity CSH C18 (100 x 2.1mm, 1.7um) CH:FLOW_GRADIENT 0 min 15% (B), 0–2 min 30% (B), 2–2.5 min 48% (B), 2.5–11 min 82% (B), CH:FLOW_GRADIENT 11–11.5 min 99% (B), 11.5–12 min 99% (B), 12–12.1 min 15% (B), 12.1–15 CH:FLOW_GRADIENT min 15% (B) CH:FLOW_RATE 0.6 mL/min CH:COLUMN_TEMPERATURE 65°C CH:METHODS_FILENAME protocol.pdf CH:SOLVENT_A 60:40 acetonitrile:water + 10 mM ammonium formiate + 0.1% formic acid CH:SOLVENT_B 90:10 v/v isopropanol:acetonitrile + 10 mM ammonium formiate + 0.1% formic acid CH:INJECTION_TEMPERATURE 4°C #ANALYSIS AN:ANALYSIS_TYPE MS AN:LABORATORY_NAME West Coast Metabolomics Center, NIH, Davis, CA #MS MS:INSTRUMENT_NAME Agilent 6550 QTOF MS:INSTRUMENT_TYPE QTOF MS:MS_TYPE ESI MS:ION_MODE NEGATIVE MS:MS_COMMENTS Data are analyzed in a four-stage process. First, raw data are processed in an MS:MS_COMMENTS untargeted (qualitative) manner by Agilent’s software MassHunter Qual to find MS:MS_COMMENTS peaks in up to 300 chromatograms. Peak features are then imported into MS:MS_COMMENTS MassProfilerProfessional for peak alignments to seek which peaks are present in MS:MS_COMMENTS multiple chromatograms, using exclusion criteria by the minimum percentage of MS:MS_COMMENTS chromatograms in which these peaks are positively detected. We usually use 30% MS:MS_COMMENTS as minimum criterion. In a tedious manual process, these peaks are then collated MS:MS_COMMENTS and constrained into a MassHunter quantification method on the accurate mass MS:MS_COMMENTS precursor ion level, using the MS/MS information and the LipidBlast library to MS:MS_COMMENTS identify lipids with manual confirmation of adduct ions and spectral scoring MS:MS_COMMENTS accuracy. MassHunter enables back-filling of quantifications for peaks that were MS:MS_COMMENTS missed in the primary peak finding process, hence yielding data sets without MS:MS_COMMENTS missing values. #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS ug/ml MS_METABOLITE_DATA_START Samples FFS107A FFS107B FFS107C FFS107D FFS108A FFS108B FFS108C FFS108D FFS109A FFS109B FFS109C FFS109D FFS110A FFS110B FFS110C FFS110D FFS111A FFS111B FFS111C FFS111D FFS112A FFS112B FFS112C FFS112D FFS113A FFS113B FFS113C FFS113D FFS114A FFS114B FFS114C FFS114D FFS116A FFS116B FFS116C FFS116D FFS118A FFS118B FFS118C FFS118D Factors Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Treatment:Med | Timepoint:Pre Treatment:Med | Timepoint:Post Treatment:FF | Timepoint:Pre Treatment:FF | Timepoint:Post Ceramide 34:1 d 0.069313029 0.056075935 0.066063603 0.060227513 0.087571634 0.055060821 0.058857034 0.071699077 0.079151672 0.07544314 0.080264284 0.07476555 0.085197706 0.096555129 0.087494632 0.066777504 0.095411192 0.093226631 0.083583773 0.101257435 0.071231152 0.073273136 0.076980226 0.079113203 0.098879539 0.066115064 0.068743993 0.075486884 0.096832499 0.097029098 0.094725049 0.106328312 0.098377549 0.087452221 0.099829408 0.085805987 0.052586586 0.066127909 0.056249107 0.069898894 Ceramide 38:1 d 0.01192055 0.009409271 0.009554416 0.009472654 0.00940928 0.010141534 0.012506981 0.009821361 0.010060315 0.009623342 0.014413287 0.013764517 0.010845789 0.010684991 0.011216678 0.009331354 0.011512943 0.011309358 0.008745223 0.010200206 0.01579153 0.011278367 0.012187033 0.010296906 0.014034382 0.009806541 0.009364787 0.010462415 0.016533239 0.014204941 0.016708232 0.018424344 0.012666553 0.010934458 0.014376872 0.013601183 0.006908874 0.006765942 0.009707699 0.010260274 Ceramide 41:1 d 0.022202024 0.02032545 0.023517676 0.019909233 0.024399949 0.018349653 0.02192322 0.017299821 0.028951602 0.025770779 0.029432958 0.032101454 0.024503864 0.027028091 0.024899433 0.024707901 0.022317932 0.030321587 0.02262899 0.023284364 0.034739375 0.034270079 0.034385703 0.028487718 0.046492756 0.026244505 0.027203091 0.031465993 0.039496072 0.035614957 0.03853517 0.049847127 0.026485506 0.017602953 0.026013154 0.029231494 0.013924697 0.01446548 0.014852515 0.016649683 Ceramide 42:1 d 0.069511705 0.070753449 0.092010172 0.071973128 0.102470617 0.061691368 0.067043623 0.064743586 0.096249697 0.096800206 0.107971379 0.108190288 0.134832877 0.125052263 0.122428843 0.103015011 0.088923556 0.108048665 0.097099117 0.088586958 0.131888153 0.125843375 0.127423007 0.109133268 0.151822753 0.093250007 0.08398599 0.105659137 0.143853315 0.121106815 0.139170877 0.163176259 0.113998974 0.073857397 0.103255147 0.106910925 0.071880098 0.068645469 0.064449071 0.06151202 Ceramide 42:2 d 0.007313754 0.014001186 0.013560363 0.003070282 0.020090705 0.013083172 0.013836333 0.016724555 0.018113079 0.010105715 0.025444816 0.023441032 0.025389006 0.02063546 0.031320328 0.019851559 0.014542054 0.017386183 0.021824275 0.005815181 0.030238889 0.027268999 0.0289412 0.004515779 0.039001569 0.020105166 0.018070809 0.021734823 0.008031104 0.005267001 0.035251471 0.034097981 0.001270595 0.017028689 0.017398262 0.022029095 0.001379636 0.015178789 0.014376388 0.014354459 GlcCer 40:1 d 0.015347708 0.015045342 0.020075784 0.015482315 0.020594978 0.017104202 0.016517191 0.015992398 0.012270878 0.016328327 0.015894264 0.018443272 0.022195773 0.017869528 0.017171631 0.018909451 0.017710434 0.018418097 0.021058341 0.017197335 0.012336511 0.016498107 0.015384026 0.012897251 0.020021149 0.015793568 0.017825387 0.024862297 0.025671269 0.020110366 0.023546051 0.024173861 0.025106565 0.019079632 0.025395397 0.023264653 0.012149351 0.014381561 0.015500577 0.013548029 GlcCer 42:1 d 0.020923048 0.023624034 0.025750876 0.021087365 0.030244934 0.005396957 0.006458432 0.024590012 0.021823666 0.02003054 0.020978563 0.023700963 0.034542942 0.031217158 0.030581641 0.005091869 0.027459297 0.036554762 0.038345183 0.028295821 0.001702618 0.026875447 0.004098401 0.018005074 0.003771354 0.02936104 0.003771749 0.031915989 0.039719813 0.032206227 0.006799188 0.040430001 0.032149011 0.029123394 0.034740364 0.034173726 0.023336166 0.002045517 0.004668689 0.021612331 GlcCer 42:2 d 0.014043897 0.005315704 0.013594897 0.013673466 0.021718132 0.013688106 0.015542334 0.018523569 0.015045359 0.014929445 0.015392831 0.014508865 0.015618832 0.019740262 0.014978299 0.019100116 0.017605982 0.017459147 0.019536168 0.014301564 0.010414843 0.012749008 0.011658208 0.01193373 0.017795432 0.014739102 0.01675328 0.018179852 0.019995328 0.019916559 0.023913053 0.020980883 0.016153302 0.016196592 0.015657313 0.016524333 0.015561009 0.017843206 0.016770249 0.014366865 PC 32:2 0.439515216 0.652519371 0.614598183 0.628207673 0.463459997 0.261429309 0.392407425 0.277281677 0.418400972 0.34938979 0.447146506 0.447582894 0.470739254 0.329611924 0.330740818 0.338998627 0.315382868 0.553512256 0.69808022 0.035401275 0.32798618 0.449617386 0.360683991 0.009616807 1.049476897 0.410693512 0.44301046 0.664844583 1.283400116 0.543091643 0.784127581 1.091077453 0.946554394 0.536144273 0.69021606 0.934702525 0.567930292 0.434630416 0.422188868 0.045361185 PC 34:2 18.4504624 20.30405646 20.10707919 18.80901095 18.9277469 16.51383264 15.63778835 15.12116803 18.72995087 17.85453132 17.67510487 21.30121342 21.02480548 24.61415075 18.67061983 22.48272379 18.16596398 24.13144974 25.30534494 22.78259754 21.53180558 25.10120437 19.91209166 18.91601837 31.62616899 18.22809314 20.80585594 29.73054567 31.02080032 23.35504565 23.41850663 27.9311311 26.24138541 22.32007004 28.18642044 26.81305749 20.14501005 21.26660498 19.50902202 16.96581107 PC 34:3 0.483466738 0.580824964 0.944208969 0.49368669 0.430464488 0.345395767 0.448801307 0.262419379 0.284155959 0.269725968 0.392670554 0.505048864 0.3822217 0.28397335 0.352389308 0.561858836 0.156353176 0.70921766 0.470933135 0.313784025 0.316388366 0.622749275 0.492761798 0.380344705 1.063083561 0.587828973 0.736700335 0.526868956 1.229725204 0.617293117 0.576102633 0.75055489 0.636702711 0.455421947 0.820030854 0.442813617 0.605151418 0.439254144 0.330118603 0.537299603 PC 35:2 0.536111967 0.92651233 0.739434162 0.60800294 0.603817817 0.759561607 0.629731676 0.597153819 0.533364833 0.575595707 0.475493721 0.770162491 0.707269766 0.707651446 0.513790827 0.965989144 0.720205998 1.178259132 0.810771393 0.750936128 0.803496553 1.310313524 0.665059762 0.687601679 1.287593504 0.740012611 0.743736383 1.380047359 1.067501031 0.805164936 0.768645641 1.289569234 0.857694185 0.796121048 1.043884711 1.141909308 0.715582309 0.771931362 0.633550173 0.678234623 PC 36:3 4.873547573 4.710773729 6.46601091 5.60867426 5.006941602 3.204891516 4.602445649 4.010602169 4.423337 3.789194974 4.262188666 4.986505912 5.534233556 3.642718856 3.824807085 3.578318845 3.27025715 3.998283746 4.522016938 3.824678613 4.503663127 5.07980058 4.253735729 3.764739405 5.056135276 3.300384312 2.65285087 3.921826211 6.373221041 4.639697161 4.502846093 5.054639635 3.922598678 3.684777574 4.820013077 4.492888293 5.248425254 3.915835102 4.326501853 3.476316301 PC 36:5 0.840633224 0.983667311 1.774532483 1.205903515 1.118547759 0.832452735 1.120593419 0.940983097 1.550204522 1.162255833 1.375209679 1.560171477 2.345570067 3.449769107 1.562299353 1.312834962 0.506976845 0.782618198 0.823376669 0.634809219 0.954964004 1.127838936 0.627693938 0.583499747 1.154046624 0.633461585 0.665558067 0.794669751 2.374290214 1.560862222 1.596166267 1.730717845 1.199419639 0.783399764 2.876879823 0.679329254 0.705722408 0.479018204 0.516394096 0.412859559 PC 38:3 2.346818062 2.452149245 3.526890154 3.10222401 2.421362745 1.333675823 2.162940328 1.994653468 2.03271532 1.703183024 2.137133522 2.700604396 2.37546288 1.269259455 1.479072937 1.099129809 1.736613161 1.90408216 2.452482621 1.919178189 2.103147588 2.159623248 1.646950569 1.252108233 2.235272403 1.156325902 0.922243539 1.318627829 3.073263501 2.183417855 2.238339717 2.145016115 1.514100681 1.229338573 2.087513881 1.627209404 2.60301384 1.687660659 1.905721054 1.459320275 PC 40:5 0.346782336 0.328891823 0.482370601 0.439452934 0.417266284 0.30263984 0.315570762 0.267299536 0.289940305 0.033439135 0.251920468 0.344499607 0.407180748 0.238081228 0.30476263 0.048129435 0.338579345 0.333310641 0.427318878 0.366081362 0.335872693 0.380423022 0.325134562 0.266145126 0.369647685 0.254238841 0.240789215 0.324271832 0.52505458 0.444419469 0.400131844 0.39271762 0.066451982 0.185730738 0.284417058 0.273549305 0.391438066 0.328284676 0.256996132 0.262706758 PC 40:6 1.162541897 0.977149638 1.34746203 1.167620863 1.417791645 0.950417881 1.064904461 1.186765576 1.120475874 1.058496163 0.913273322 1.186938885 1.666742006 1.304249029 1.667655338 1.064602171 1.770738747 1.72575495 2.282563492 1.993735419 1.254419561 1.123751505 1.067261334 1.241770166 1.501268513 1.192292493 1.024917728 1.248766752 1.29449493 1.611382375 1.358267715 1.149545955 1.329619162 1.352619374 2.137344363 1.535647635 1.096913976 1.218121098 0.994892605 0.705160246 PC 34:1 p 0.271919854 0.54623116 0.458826973 0.326200091 0.402545211 0.531100724 0.538091619 0.334956265 0.292109434 0.407662401 0.387247608 0.708549492 0.032795028 0.440158692 0.264111577 0.481294348 0.46415258 0.909926017 0.627490671 0.448416145 0.572932011 0.670046688 0.411024059 0.370247058 0.70326291 0.319653078 0.547508809 0.941378013 0.500466073 0.385216165 0.384431848 0.640895082 0.725562919 0.322889303 0.702226484 0.809742295 0.429645182 0.369204667 0.493976988 0.445606939 PC 34:2 p 0.689942293 1.293507474 0.989927408 0.692543795 0.682753227 1.050868552 0.758497705 0.522620504 0.792937325 0.943426197 0.944825005 1.979910034 0.893882183 0.894516052 0.719932558 1.21369879 1.312831373 2.376733494 1.529020055 1.219198441 1.252563911 2.20721262 1.146404224 1.020102771 1.414337053 0.83397533 1.09215108 2.554295628 1.140366972 1.003824912 1.006326137 1.389442469 1.193044885 0.905755381 1.332645965 2.299041044 0.756993892 0.801985593 0.757644878 0.940941381 PC 36:3 p 0.851741851 1.0729093 1.267249439 0.966105241 1.572870538 1.102381716 1.321496622 1.326959191 1.117583701 1.208234644 1.090258543 1.206489164 1.737556049 1.705614933 1.16781576 1.357302375 0.870090925 1.121223304 1.166492299 1.216248335 1.355088586 1.557603086 1.063369061 0.968652855 1.32967337 0.817790364 1.105962583 1.412940283 1.374857367 1.074342625 0.963805314 1.195467568 1.433933319 0.891646321 1.403175263 1.116462861 0.887884077 0.984854028 0.880938972 0.667561403 PC 38:4 p 0.149724964 0.287780345 0.208059964 0.170145117 0.287314741 0.358274058 0.2737453 0.290591197 0.251619017 0.096629266 0.120537289 0.385673678 0.414436285 0.413536191 0.304041014 0.433688059 0.272558603 0.394678304 0.336812992 0.097085314 0.332161393 0.537789107 0.301002467 0.221186554 0.391569531 0.239852204 0.184240232 0.509403687 0.098953747 0.070517713 0.17400829 0.318189101 0.317965007 0.061062161 0.300516137 0.363975072 0.166385828 0.069124731 0.193214122 0.170286375 PE 36:2 0.853846481 1.017817725 0.789433057 1.047508692 0.613890927 0.505177344 0.47572173 0.343156016 0.637958532 0.660065191 1.056842421 0.746577032 0.586045887 0.959261809 0.668342165 0.860186139 0.697822874 1.016132184 0.943997051 0.879628623 0.855649154 1.030683826 0.870761703 0.887805547 2.463928123 1.026927712 0.888725897 1.214157157 1.119069922 0.676570665 0.745387265 1.502354543 1.67990629 1.434910097 0.853242807 1.946710851 0.678802614 0.764163543 0.686272797 0.627871372 PE 36:4 0.843510746 0.634530485 0.769608273 0.85199667 0.717283084 0.413275662 0.433844817 0.51206147 0.820802005 0.657640709 0.678382427 0.38744295 1.641697428 1.837885147 1.602281256 0.826960064 0.701773746 0.707872853 1.148414903 0.982855341 0.927985447 0.745218875 0.831953382 0.815195001 2.495692369 0.811110192 0.643746202 0.898750563 0.927638644 0.896248453 1.045023072 1.344422396 2.918731149 2.083341397 0.98775507 1.889576861 0.504716059 0.814249169 0.586134657 0.412880396 PE 38:6 0.229682981 0.408462943 0.141315126 0.409944562 0.115141265 0.360277146 0.483538754 0.130955178 0.072909547 0.366096764 0.036423218 0.035524855 1.831187429 2.076440624 1.845361293 0.633602773 0.750171936 0.578413704 0.903572846 1.012698136 0.762008338 0.563162147 0.161297084 0.80901538 1.206063984 0.764692676 0.665869919 0.629230881 0.20401973 0.940553217 0.615561536 0.276381258 3.77908229 2.661224765 1.181754605 2.178882609 0.396305568 0.513735416 0.369531506 0.249682701 PE 34:2 p 0.615550388 0.909408063 0.615584953 0.588256113 0.615065838 0.791594855 0.769418479 0.470369617 0.760993392 0.796442297 1.023264768 1.226162575 0.410836292 0.717346397 0.324447881 0.724974476 0.884007745 1.513450723 1.109828163 0.518579722 1.070676215 1.283621307 1.005984446 0.635985993 1.987953115 0.573280242 0.800770632 1.629249113 0.695837504 0.344284936 0.624446947 1.106524604 1.8418785 0.526496603 1.171544104 2.826054893 0.620773762 0.580039244 0.85171842 0.773967512 PE 36:2 p 0.643686553 1.3435605 0.805191219 0.347449517 0.936991415 1.351462157 0.990528579 0.150732082 1.301549327 1.049194533 1.510425302 2.299679288 0.192236233 0.899902935 0.597721018 1.471638195 1.429722024 3.107019561 1.500748596 0.882074753 1.73706192 2.59103136 1.704534224 0.969685525 2.457086593 1.057553701 1.125611549 2.734227064 0.959760899 0.242753185 0.920627317 1.828214544 1.767153166 0.739446842 1.583515656 3.778114923 0.993687855 0.805663061 1.026415936 1.250856585 PE 36:4 p 1.762242669 2.386553928 2.072960726 1.697113151 2.657060923 1.841416523 3.450099262 1.665536054 3.092390065 3.108185768 2.829059599 2.619402984 1.827342704 3.04690222 1.271692405 1.858352779 2.36114024 2.490012375 2.605523733 1.546933095 2.739365475 2.35508584 2.525572766 1.717934632 2.675038188 1.300168962 1.957139544 2.617663758 1.744151648 1.054545682 1.381187792 1.978150127 4.468171045 1.385265256 3.335282626 4.646551567 1.299576376 1.50781583 1.850922904 1.184404829 PE 38:4 p 1.6336202 3.571353359 2.258500369 1.663285558 3.23629198 3.603335271 3.876685415 2.232117639 4.223057642 3.542168024 4.334362887 4.778093004 3.240553639 3.468014234 2.312074964 3.974669105 3.482200342 5.054769088 3.33040322 1.905535865 4.482868298 4.894170346 3.986948604 2.333321888 5.4355955 2.010787626 2.620851052 5.520142835 2.460391125 1.493439749 1.985395747 4.158713291 4.92904459 1.42402307 3.630943245 6.106584705 1.623458339 1.890374608 2.299367618 2.232485835 PE 38:5 p 1.294263596 1.581445208 1.332835464 1.158165056 1.892781405 1.390365323 2.127905533 1.344829497 2.105832763 2.094146222 2.106855489 1.779018132 1.86743769 2.584350992 1.629915618 1.66545696 1.653440185 2.047408645 2.042341064 1.1990933 2.253325046 2.099720935 1.739704265 1.43933672 2.431186516 1.292512465 1.695432161 2.556481208 1.628685163 0.993165124 1.303193628 1.892187059 3.76211762 1.021203089 2.407458762 2.990185264 1.289230147 1.481580503 1.495541353 1.109157988 PE 38:6 p 0.860162763 0.891425418 0.861615603 0.715539599 0.989862404 0.774680435 1.178695508 0.950894942 1.319776714 1.222544987 1.160420946 1.086283458 1.219876209 2.340195622 1.014283439 0.995859274 1.229215239 1.735729639 1.605943401 1.087060511 1.432357676 1.137004955 1.084207468 0.976380115 2.009455066 1.196806247 1.149893678 1.843388038 0.874246247 0.845482577 1.053908483 1.326430126 3.705164798 1.295991638 3.024084287 3.523608968 0.703543597 1.105222802 0.75702257 0.656699707 PE 40:6 p 0.547219701 0.656623449 0.19316456 0.034974291 0.741368756 0.792158669 0.919058648 0.670811216 1.091364775 1.092229086 1.101233218 1.175095596 0.949097744 1.541650765 0.807537471 1.184601833 1.296380073 1.768949345 1.153008563 0.906536061 1.029058074 1.079232286 1.035090687 0.932092831 1.440142042 1.002044095 1.085141335 1.825455222 0.517862846 0.576423438 0.636294162 0.968583867 1.611643687 0.830897865 1.597721572 2.279126791 0.535754747 0.771318633 0.61225765 0.699697902 SM 33:1 d 2.025418923 2.77625021 2.623533089 0.8656301 3.33138006 2.04267452 0.530071056 0.666177117 2.974289141 2.984070224 3.115244832 3.278174549 3.38552713 3.60118362 0.598635186 2.54317111 0.808453139 3.243506488 0.569322353 2.915249444 2.748127094 0.205761539 0.631654718 2.98852977 0.65148683 2.880438919 0.533197139 0.475528495 4.002415035 0.392892701 4.727933506 0.708481461 1.993513304 3.213356952 3.445300456 0.66376834 2.284022114 2.039121865 2.187988478 1.521087157 SM 40:2 d 3.022099889 3.032995354 3.602253162 4.79348087 3.077053664 2.358313924 2.527726902 3.026876188 3.757148571 6.070443194 2.591918589 3.034681026 4.118981448 4.506657891 3.504274839 2.814185809 2.418062908 5.215213348 3.103482803 3.182213678 2.688523045 2.727434867 2.597882482 2.921688896 4.607816474 3.744570594 3.940755866 3.904413487 4.375021555 5.000076578 4.793808922 4.485525639 7.182485916 5.714270127 5.414483811 4.611443202 2.482140513 3.461441029 2.851207611 2.692127455 SM 42:2 d 5.111632792 5.202955825 5.800500693 4.550699807 5.380777646 3.180772698 4.032232063 4.240270223 6.049499388 6.064679659 6.224674929 6.77859822 9.94067939 8.403748135 7.732841777 5.858284562 7.03675277 8.375231895 10.51669076 7.972314805 6.347197095 7.308182886 6.907711214 6.987099423 8.530501259 6.505677044 6.677221642 7.115994656 9.569777453 8.319675255 9.079828178 9.415947164 12.7938567 0.53138885 2.018489981 7.993168217 5.543069777 6.582184058 4.963036954 4.554826608 CE 16:1 5.689508007 3.489893627 7.268921796 6.794737196 2.946771642 1.74563591 3.410337246 2.346162402 2.912067491 3.367196519 3.297706664 2.391390163 5.828467045 7.651565652 3.839674159 2.709762852 4.003466205 3.960973526 4.890501806 3.474159226 2.795988504 2.019922489 2.158505846 1.778908765 9.017703584 3.381080302 3.390641752 4.07165766 6.998943614 6.382436996 8.356551789 5.254287994 4.830794776 2.667196873 4.780021536 4.791362532 2.1094488 1.414702559 1.678798359 1.617365783 CE 18:1 35.80549026 30.20095285 41.05836237 35.53136181 37.62289987 29.80182522 35.05591009 40.10937884 41.54581395 53.57644138 40.66388687 38.88936013 61.16049815 58.65959126 52.42435119 42.3318002 40.28406258 44.29211803 42.80935688 46.14470272 38.67953904 40.9434752 35.64462588 40.73559888 43.57137412 44.3491641 41.99762598 42.52485977 52.07673414 55.1811499 54.65940249 48.04135919 48.31979117 37.38743217 51.5585529 40.57505534 36.84383333 39.80724607 34.25014075 32.91323605 CE 18:2 213.9460398 223.1852224 228.8206543 205.7878248 223.2878776 209.2229533 217.0845895 219.0299424 253.2688486 321.5789053 247.1359674 248.9562315 277.5972575 282.3133936 230.3901352 260.8739637 251.4218561 319.4306768 286.7711662 267.0980475 284.8735315 333.4473899 253.8552677 260.7710829 254.919462 275.2866558 289.2336754 320.9736196 266.5340642 261.8078349 302.6945305 298.7073694 308.9024151 246.0809179 293.4127665 304.302465 265.6836788 256.7606629 240.0933805 251.0574165 CE 18:3 5.920235828 7.69301246 14.51655052 9.628764845 6.348414074 5.636175519 6.395609833 5.326459768 7.433477246 8.584799419 15.39436337 15.15040544 8.816439739 8.787650206 6.25555563 8.421173937 6.045677928 9.117769478 6.343097283 3.747521463 8.203118798 7.940313223 5.121855197 4.63222195 8.784498406 5.508440168 6.506100985 7.680169295 20.22739365 8.53011358 16.88773426 13.65538991 3.726725908 2.251114161 6.793917867 6.823903454 6.372738542 3.27908353 5.774270088 4.754361795 CE 20:3 6.924502009 4.683770603 5.798369144 6.344341604 4.088186544 3.788401337 5.025021808 5.672974122 7.676546709 7.793430652 7.309663158 7.152638559 7.395424447 5.489386896 3.83552316 3.967115268 3.985185537 4.486593207 3.088584771 4.083077225 2.918249324 3.902548495 2.77133085 3.070735368 1.721525862 3.553347232 4.283580947 3.12120147 5.899018474 5.847874235 7.269509656 6.330649182 3.635926442 2.288454917 5.303494241 3.344026195 6.091588312 5.256240991 5.378790316 4.549432408 CE 20:4 83.65017152 69.69709072 82.24847561 76.18891838 88.1135576 69.82676288 81.01059027 91.1017737 103.1694833 130.4109781 85.98214061 84.11045392 126.9220134 119.8286992 100.0819717 85.49856098 70.21343273 73.24638269 72.00972808 76.46910836 88.64491612 86.62575929 76.99397162 81.30883704 49.86791392 59.12447135 66.34145096 66.97762742 83.79336905 97.82902479 99.26468055 91.10540487 99.2359207 70.23262806 88.57354645 70.45183937 66.95814683 83.45460303 69.58851444 58.8919769 CE 20:5 4.187776639 3.914986187 7.469875145 4.864272396 3.689821442 2.834668648 4.741645369 4.018470805 8.331086702 8.317130571 6.729421517 6.68566479 13.71548597 18.43640909 7.50362269 5.759123119 4.661570238 4.04681972 3.222491368 2.584647184 5.426051611 4.32483919 2.774054516 2.527179912 3.794169632 4.154914289 3.404681677 3.219200484 8.301755178 8.396809516 10.26395199 7.75254288 11.17886179 2.453821123 18.34680609 4.598036018 2.522131301 2.135615568 2.074278131 2.433930574 CE 22:6 6.088280368 5.807875547 7.058652729 5.522542877 8.31198674 6.063299199 7.672206663 10.40912683 9.158793829 14.65195997 7.577679536 7.958740251 13.32374662 17.80541181 14.4676155 10.83063164 14.15315401 14.98392609 13.73852576 15.12315107 8.923584341 8.248190183 7.618095711 8.733594936 7.279145883 10.70515922 11.54783785 11.7169232 8.055484236 12.18049052 11.72326883 8.269470483 18.34543993 12.92923684 18.86185832 16.11794501 7.133981562 9.751597559 7.020429502 6.286603064 Ceramide 40:1 d 0.034932817 0.030358879 0.046666566 0.04500526 0.036558509 0.028545201 0.046654468 0.037611696 0.010876116 0.053142623 0.05932146 0.05989356 0.068573594 0.062417394 0.049391333 0.047218319 0.032745747 0.058498516 0.048274512 0.036616765 0.059653541 0.070396263 0.053121698 0.049502912 0.070614509 0.045881442 0.03136841 0.057956138 0.070099441 0.063075815 0.067823235 0.096531405 0.056632526 0.02785967 0.052227669 0.05074749 0.030583546 0.036555386 0.027119535 0.020145494 Cholesterol 59.59776215 68.71006196 74.34052482 68.14820478 79.62538921 57.82181275 63.23820038 67.61890573 82.73229582 78.44552773 83.53475287 74.5020696 109.6912112 115.8018608 98.90152697 85.86372785 86.64885244 112.3953925 114.7531985 103.383339 89.63689876 95.65894246 82.17288194 81.12922594 123.3628656 80.14325427 90.34420474 98.87646138 118.1875192 105.7371179 120.9927758 128.1378783 136.9388825 101.6276592 111.0803927 126.7544464 72.3236985 69.70404117 69.46515996 54.31817548 DG 36:2 0.270576686 0.272330585 0.343488393 0.260128787 0.297610625 0.170103478 0.237530052 0.304498715 0.330465816 0.587167149 0.2483396 0.221476651 0.469638264 0.465336053 0.393939394 0.268519041 0.238291166 0.336007924 0.788274681 0.304843398 0.577723295 0.256458863 0.392482961 0.257701406 0.583949187 0.078754255 0.205970329 0.231682078 0.287265508 0.262266211 0.269337496 0.254010055 0.312782118 0.283757172 0.222452498 0.230424002 0.324769854 0.246890642 0.084672713 0.075068499 DG 36:3 0.33413793 0.355358203 0.543696711 0.32108704 0.583540702 0.359083235 0.363575692 0.443227011 0.313730386 0.485609411 0.240765472 0.272958415 0.498582606 0.426489898 0.465830721 0.410165767 0.380554548 0.411950474 0.89572436 0.521722035 0.726246492 0.621000708 0.630913532 0.461251672 0.742720682 0.327272727 0.293680182 0.326190015 0.313013009 0.444647952 0.286720409 0.324033179 0.422337313 0.529404562 0.381965974 0.431343759 0.479934954 0.446075324 0.337570841 0.28277098 Gal-Gal-Cer 34:1 d 0.120135926 0.148440297 0.166519856 0.149165329 0.208867364 0.159092492 0.159759025 0.192743367 0.159179124 0.22362101 0.146268333 0.153928127 0.346111315 0.366469985 0.303286203 0.197258677 0.216354291 0.325360302 0.389767422 0.222536069 0.178430551 0.16831447 0.161372981 0.171219284 0.17119169 0.078896659 0.073527553 0.156669684 0.274767112 0.260335703 0.29194588 0.263655047 0.374861873 0.189138213 0.240629557 0.249328176 0.160248787 0.181721526 0.165514502 0.14779782 GlcCer 40:1 d 1 0.036764157 0.042958244 0.046042562 0.036894616 0.053404096 0.038929159 0.038568933 0.054627563 0.034272412 0.042270915 0.039059774 0.046052611 0.061484567 0.049274446 0.045922232 0.048429046 0.042986861 0.05518159 0.063996568 0.041212194 0.037512821 0.045682682 0.029419905 0.025489658 0.049607621 0.041074814 0.039599481 0.05244717 0.061238802 0.04933611 0.057988502 0.053359294 0.071603831 0.046493085 0.061319726 0.060913319 0.03557586 0.01285675 0.032382242 0.02939008 GlcCer 42:1 d 1 0.049629323 0.04906442 0.057586631 0.013840991 0.058332327 0.019785072 0.049163772 0.05197574 0.049532699 0.041877531 0.060968008 0.050666261 0.080620306 0.078021743 0.067474025 0.059953365 0.060844266 0.074630839 0.094742834 0.063651573 0.018756411 0.057384188 0.016979738 0.044943434 0.072595512 0.057436768 0.05811939 0.06364426 0.088300853 0.064132716 0.07685662 0.080914051 0.094640035 0.057437956 0.07159995 0.070752535 0.053701109 0.056608078 0.014555415 0.045568106 LPC 16:0 1.116993199 1.18759361 1.370774805 0.953567555 1.456494933 0.656023925 0.874328384 0.944367675 1.019966859 1.095408636 1.184526404 1.160705653 1.573177204 1.506247254 1.379014025 1.342123324 1.082634133 1.338179244 1.51426073 1.263363368 1.395229876 1.224346682 1.274830012 1.085945766 1.944721311 0.83840599 0.826260195 0.85811927 1.210338901 1.568319087 1.581472652 1.455464474 1.26746253 1.010719415 1.594851131 0.865686763 1.358477305 1.503640048 1.073635382 0.810922153 LPC 18:0 0.530830517 0.551615839 0.66381081 0.422746573 0.699562011 0.339254244 0.484472199 0.448479765 0.506849989 0.436984328 0.588873999 0.619073772 0.628536655 0.521623993 0.576201682 0.663128827 0.559293915 0.827363398 0.860457771 0.644546658 0.708452175 0.726850913 0.675564268 0.531652816 0.929149445 0.392536501 0.397167863 0.445001633 0.563724531 0.672779364 0.846058009 0.773824169 0.462921491 0.293159763 0.68394299 0.408505569 0.670540828 0.620108649 0.499510263 0.412685327 LPC 18:1 0.294109697 0.265413756 0.339226611 0.287236906 0.392010353 0.174111222 0.207991515 0.335587914 0.317436708 0.375575413 0.422591233 0.400984225 0.560781705 0.549204823 0.55857163 0.386883651 0.328117394 0.438124786 0.425139784 0.409617723 0.363376261 0.329882181 0.379296465 0.359190348 0.495674404 0.281443959 0.182209768 0.203672767 0.442242754 0.514959099 0.536875491 0.454849324 0.283700042 0.190468625 0.358085335 0.156316535 0.343903571 0.376704676 0.245253053 0.186183817 LPC 18:2 0.444514994 0.480730062 0.364189664 0.367427348 0.572401928 0.327723699 0.364343286 0.405124148 0.532429095 0.566735422 0.695563281 0.688474888 0.430681895 0.646603494 0.374039663 0.766676892 0.450283329 0.718613997 0.547917681 0.510094317 0.514582876 0.577396605 0.571353379 0.409012839 0.65315526 0.335419513 0.306200288 0.378759883 0.675021473 0.624945442 0.75685926 1.023694468 0.395193538 0.255378514 0.553965632 0.285769054 0.546313908 0.521164495 0.378237508 0.366205772 LPC 20:4 0.086182832 0.072577851 0.089854092 0.016538077 0.122294449 0.006662092 0.08308746 0.101377526 0.102188529 0.096594053 0.074774288 0.103805088 0.144784343 0.117311288 0.098101715 0.101161194 0.043489285 0.058395365 0.076789475 0.025729948 0.080292772 0.085862562 0.092946762 0.015613886 0.080227266 0.035555325 0.038309363 0.01147549 0.074545636 0.127282582 0.101576908 0.096052651 0.001303654 0.025637276 0.075426485 0.029328605 0.073139326 0.075543828 0.011963564 0.036386851 PC 30:0 0.568333483 0.760539294 0.701451537 0.810237175 0.379478925 0.212532989 0.373290625 0.183429021 0.841530103 0.560102309 0.629200186 0.3782824 1.10064887 0.710740058 0.717542351 0.411805594 0.412326807 0.627942299 0.947537991 0.332686721 0.321310618 0.287544151 0.507178402 0.287057276 1.48031161 0.308037097 0.36435695 0.599735663 2.577626875 0.741267196 1.296545009 1.828161158 1.652356705 0.4622868 0.674269916 0.867924494 0.384117915 0.295602923 0.308211953 0.213182677 PC 32:0 0.844751773 0.90543877 0.82308596 0.79443734 1.025189848 0.618670627 0.893401201 0.77787379 1.095966109 1.007585675 0.989870868 0.862323133 1.837746956 1.886381786 1.782677641 1.184298778 1.017892971 1.316838933 1.452035019 1.12833483 0.907705245 1.000076141 1.022544051 0.975073322 1.341915398 0.786956087 0.80536279 0.998611274 1.660918721 1.284000631 1.491728581 1.527828523 2.118038286 1.104380178 1.337393694 1.385747646 0.942954083 0.966825301 0.816105003 0.621696065 PC 32:1 3.163552382 2.420845789 3.301531833 3.751229309 2.310237316 0.900587238 1.948268273 1.167821229 2.056237095 2.330988876 2.143791504 1.824742237 4.627097925 4.129617599 4.134440594 1.554611642 2.047467292 3.170188663 6.253606256 1.916246038 1.58583224 1.256328162 1.877536811 1.125264524 12.33631435 1.597759327 1.527620601 2.468955989 6.652165091 3.906633962 6.640993941 5.107461623 6.092531876 2.331419603 3.23609548 3.983159052 1.576135654 1.43381165 1.330205416 0.85543713 PC 33:0 0.022187193 0.088122787 0.080927355 0.074072992 0.01525782 0.053741875 0.075754765 0.037604481 0.07871174 0.045551061 0.030249371 0.069957585 0.022637276 0.018502607 0.059847529 0.090399522 0.014477418 0.145439297 0.083695835 0.056663585 0.072715352 0.103035064 0.027793549 0.038061669 0.16745881 0.046263479 0.037912354 0.100526998 0.122434642 0.011585057 0.10146009 0.146218095 0.10701386 0.041759056 0.103244678 0.142086381 0.056840797 0.040889505 0.036590777 0.025242578 PC 33:1 0.27484812 0.309436002 0.38492214 0.325068092 0.315124833 0.193300336 0.30944018 0.185143884 0.252783426 0.210798342 0.262293889 0.305645847 0.373998758 0.29364205 0.364862687 0.262418757 0.235615318 0.454341348 0.308518741 0.210370008 0.247715867 0.292441497 0.273913682 0.212067993 0.919809985 0.192276197 0.184754043 0.356402146 0.495945201 0.323911124 0.527526155 0.510726087 0.409474628 0.176422435 0.33224066 0.432184608 0.246375683 0.211215444 0.168905639 0.185910284 PC 33:2 0.410087595 0.572157779 0.498768065 0.394995879 0.49292929 0.361707776 0.45294135 0.306102921 0.398883678 0.382030434 0.374800322 0.402210451 0.376062555 0.409520149 0.376480518 0.473134191 0.379208937 0.697595456 0.422607207 0.3264972 0.382868589 0.522616742 0.459922187 0.343476435 0.798220327 0.411193072 0.46889065 0.717911452 0.792575471 0.550496011 0.783442102 0.95915055 0.782136023 0.462989169 0.592960266 0.920380441 0.442663281 0.444215125 0.387143486 0.374579035 PC 34:0 0.13742406 0.191491732 0.159055718 0.161542801 0.201403218 0.125316559 0.170412149 0.151765314 0.220772353 0.158454995 0.208760462 0.200374598 0.243399088 0.23598717 0.235810566 0.245704601 0.200881942 0.270539621 0.233388571 0.187748785 0.214518533 0.245503301 0.235203804 0.190946248 0.27515424 0.148806242 0.153847233 0.220189681 0.291419039 0.183714297 0.288133393 0.311708872 0.37202268 0.140920852 0.257147126 0.236020574 0.188748161 0.16694198 0.162306231 0.140369551 PC 34:1 31.80790125 25.5909794 38.37082293 31.19013622 30.23123333 14.42540273 24.41063844 21.69741779 30.05692868 31.27505468 32.69804443 30.54406623 66.54546545 56.26080632 60.81369243 25.95045108 31.924198 40.08123027 49.4165598 34.79188357 35.85020752 27.17110965 34.31849732 31.68913873 87.8808059 26.60443023 19.39670194 30.96425467 56.15633766 38.78394651 63.70754218 42.78876805 55.82099572 27.5531872 43.77367155 38.0654281 28.12885199 27.35952043 21.88383277 17.52131562 PC 34:3 1 0.899912549 0.836343187 0.829961743 0.559902904 0.870577277 0.411371842 0.544784985 0.738186977 0.030113667 0.626267719 0.449893059 0.481361766 0.709301317 0.877389814 0.893191393 0.595336135 0.667949544 0.905929113 0.994029943 0.640689045 0.554791205 0.664830572 0.584239068 0.616428922 1.632480702 0.881935895 0.76799989 0.873324251 1.138507495 1.183263566 1.330641346 1.213041375 1.349257221 1.15392915 1.097037225 1.322251624 0.813800252 0.782188035 0.81486353 0.501624669 PC 34:4 0.167530374 0.190820901 0.197207185 0.208702005 0.177465394 0.068653268 0.15872427 0.127695997 0.174255306 0.110671504 0.158809198 0.098756487 0.184709854 0.126739698 0.138597582 0.006763705 0.073443382 0.093559272 0.135347827 0.046274033 0.097063728 0.103162268 0.113400552 0.053513147 0.199919123 0.076310893 0.083448387 0.079451884 0.331645055 0.130258377 0.217509213 0.259512024 0.28057025 0.134088713 0.175694577 0.166162476 0.115255043 0.091155397 0.089190018 0.050953574 PC 35:1 0.162205448 0.239364664 0.257993973 0.184311385 0.240734486 0.193543787 0.264997384 0.20474231 0.190964719 0.200633663 0.203387219 0.284883848 0.37000015 0.286569381 0.332144363 0.296237284 0.295078362 0.500401298 0.292161417 0.270791517 0.325872504 0.34230538 0.298834513 0.23652102 0.654606195 0.229409623 0.195124995 0.359569878 0.359106484 0.245050409 0.384233119 0.433635357 0.357390291 0.180892059 0.40804869 0.388336177 0.211759834 0.204377027 0.168186892 0.18929331 PC 35:2 1 0.560346093 1.0866241 0.717515313 0.540858997 0.83958695 0.826456316 0.778037515 0.686557372 0.663786019 0.693525595 0.606247813 0.896845284 0.814297002 0.871895866 0.737638059 1.154447425 1.033737355 1.985959828 1.163279228 0.910301605 1.108098423 1.632660554 0.884581758 0.932475439 1.863343301 0.948844196 0.892039222 1.722987485 1.141493706 0.956737486 1.18624308 1.92178089 1.559278453 0.90797214 1.492796583 2.032558785 0.854054289 0.810810689 0.693133856 0.865430068 PC 35:3 0.19599825 0.314802649 0.29407662 0.213748341 0.264333247 0.188674761 0.240395122 0.222932099 0.208408612 0.205383513 0.200733765 0.253893064 0.235530861 0.343277028 0.273427218 0.33629923 0.256741164 0.562231773 0.317136007 0.202264684 0.253212114 0.351591256 0.200013006 0.209091103 0.738032233 0.278739164 0.198490403 0.466044454 0.421582697 0.318559651 0.4214241 0.640415179 0.484726913 0.257194921 0.435342439 0.609886145 0.216217935 0.199865081 0.1961527 0.187367588 PC 35:4 0.075504725 0.166731973 0.195260061 0.152291187 0.205946658 0.08161705 0.102954334 0.154337607 0.156689 0.125348541 0.123849947 0.109411471 0.195996245 0.173027788 0.162712431 0.132932823 0.095687656 0.120344134 0.099949958 0.090927002 0.119488417 0.103543879 0.091855165 0.106104875 0.16345436 0.081352863 0.103434791 0.091670278 0.218403258 0.18500806 0.216846075 0.220565144 0.191904941 0.101396607 0.136754543 0.159862772 0.088440872 0.108145691 0.093959887 0.074374523 PC 36:1 2.879488043 2.790534603 3.732880718 3.153899418 2.738948139 1.654434202 2.39962238 2.133717421 2.825849396 2.526112713 4.008506025 3.355772211 4.560089008 3.741315456 3.795011537 2.523122208 3.561382701 5.021535785 4.810601306 3.264898319 3.212006935 3.083928514 2.979224249 2.721657373 9.293963947 2.554507151 1.872677966 2.995058051 6.248616764 2.750421797 6.997264748 5.098962906 5.055258089 1.832034926 5.06892073 3.730796673 2.635918227 2.219172146 2.140299076 1.799873864 PC 36:2 46.13871161 61.10214527 46.89612423 40.07414925 46.30273543 32.99915483 38.90973982 35.00854646 46.35613469 42.41943768 52.3319427 53.38530916 41.81033947 48.10690337 40.41560747 45.56831807 54.75987062 98.96305547 84.53011027 53.15493792 59.26658451 68.737617 48.59877959 47.4270362 113.9224104 45.20418844 44.4924823 70.84069637 88.15739203 45.79508159 92.68821329 105.6624819 90.56676435 38.83068645 68.06732297 89.64116286 53.09120608 43.09316754 43.54093341 39.8104077 PC 36:3 1 10.47727042 12.24784774 11.44203269 7.461006578 11.8970983 5.737842932 6.983795754 14.12323846 9.280334486 15.57770298 10.42853702 9.620477017 16.21706081 25.31699658 18.90491111 13.67426098 13.39875719 19.15856085 21.14315725 16.8560535 14.31261277 14.78960223 13.06555338 20.86715029 30.65218235 18.3954903 11.56264975 16.12853856 26.92414475 17.20592601 21.75114234 23.53214611 30.74839742 18.64988823 20.18294133 20.25335957 13.62369674 14.69773265 12.38218817 9.062449743 PC 36:3 2 11.42367367 11.68752098 13.37400596 10.61334404 11.08422949 5.341930248 11.08992048 8.722034657 9.849617452 8.385955129 9.397802971 9.439768476 12.82101794 0.550910374 8.95207244 0.27458042 7.689310886 10.6317753 10.78757786 0.49390899 10.65464032 9.842965122 9.57757073 0.692339624 13.49730142 0.787228625 0.403574258 0.415166803 14.53031609 9.367018068 13.97198281 13.63756429 14.05829985 8.184072652 11.18557846 12.87459797 11.7960717 8.06644189 8.26637919 6.684650965 PC 36:4 2.558012684 5.188145249 3.099091751 2.609796349 2.876471952 2.491358924 2.315859254 2.656260463 3.511792218 3.410629775 4.235508981 3.825017737 2.283914124 4.137132309 2.364134374 5.513720507 3.692984295 7.21019694 4.733613522 2.965811852 4.403648317 6.046695424 4.036671826 3.918438142 9.858712716 4.07588745 3.915206023 6.584679958 7.208302932 3.312561672 6.794178783 8.930010827 6.534058403 3.050071251 5.005330582 6.982067401 4.34914051 3.267212464 4.093789169 3.243697266 PC 36:4 1 37.10101455 28.67594779 37.43742021 28.544595 48.09142657 19.23429635 34.43948718 38.82815726 38.52364329 33.2625819 26.48199767 23.61789998 83.53748212 71.70839889 64.16157448 31.00989773 21.23265585 20.45975442 32.88461995 24.76117631 42.13604574 30.44768829 36.05455275 30.80854624 37.44876511 15.13006541 16.14400056 16.99177778 47.15665958 49.33087612 50.67240736 41.68607617 65.75325224 38.57157598 40.12902723 31.75324996 23.37363085 27.38447713 20.47672139 13.98860385 PC 36:5 1 0.066493311 0.036346838 0.031336532 0.020245416 0.157731948 0.098476053 0.056058526 0.121081528 0.088872042 0.114803874 0.127631118 0.03202584 0.122666949 0.024691192 0.073035336 0.252013057 0.096743948 0.248260624 0.016099322 0.018052768 0.091732368 0.234245766 0.109737836 0.133534792 0.165092544 0.196773089 0.151992824 0.252319531 0.389671229 0.165425198 0.046861741 0.369995353 0.153988473 0.058488219 0.101244089 0.255730537 0.010948573 0.099121801 0.139436996 0.115126973 PC 37:2 0.072637457 0.099343959 0.089932805 0.074974123 0.107279425 0.069931387 0.089462771 0.099829484 0.081588452 0.082979879 0.075424419 0.092485267 0.096547015 0.129960288 0.095705806 0.116999094 0.110600018 0.164776966 0.144739098 0.131600993 0.091072818 0.127330987 0.085607003 0.10674278 0.210354962 0.126526186 0.119712378 0.139121607 0.148607901 0.111087166 0.131577601 0.159936497 0.170769268 0.10727097 0.139612527 0.167035702 0.112435949 0.108357189 0.088275249 0.082545832 PC 37:3 0.007714316 0.124957503 0.122547137 0.003904902 0.113246927 0.004321261 0.126113648 0.091622643 0.100440097 0.077992537 0.072837301 0.109046158 0.108994292 0.073757831 0.078875651 0.079343466 0.10960586 0.145752204 0.105626002 0.029031798 0.096404178 0.126694968 0.084745188 0.029130998 0.152593807 0.07222281 0.062294393 0.108672593 0.107386481 0.022699654 0.126438282 0.159334226 0.133375386 0.009258506 0.13361076 0.160174639 0.097488196 0.010363375 0.014832333 0.038982868 PC 37:4 0.232385246 0.317729911 0.337947765 0.190138701 0.416097692 0.277351899 0.366941654 0.365694386 0.302972872 0.283233554 0.221629712 0.266679046 0.548583106 0.388238994 0.434883667 0.345989539 0.249595658 0.359843355 0.287723783 0.271012571 0.408261251 0.43847144 0.323755343 0.309313075 0.379269935 0.210400034 0.197116767 0.289233304 0.339666837 0.413063132 0.401143134 0.49379557 0.461210574 0.276350452 0.400546482 0.403867129 0.224150734 0.254360922 0.214709451 0.213755189 PC 38:2 0.208354809 0.221923061 0.285983885 0.238259111 0.193265714 0.093059261 0.189386914 0.159543439 0.170766528 0.142305505 0.220701004 0.180769426 0.295638956 0.20902262 0.209686147 0.142428024 0.259040154 0.31140531 0.381533295 0.256717727 0.203031376 0.174777998 0.19390848 0.181165037 0.43982207 0.231930608 0.183723816 0.211139019 0.292707209 0.185890171 0.299019906 0.278115516 0.513527171 0.274434899 0.436414183 0.378044582 0.326687075 0.219745841 0.235095741 0.173419112 PC 38:3 1 4.115075755 3.77354582 4.923425546 4.126159998 3.482987232 1.443179333 3.274265258 2.777280746 2.884118118 2.133205123 3.093860568 3.34158586 3.320907748 1.701355721 2.247265275 1.249594548 2.710321779 3.199038712 3.871886982 2.528345393 3.312698186 2.779275453 2.200358521 1.762744313 3.359612036 1.50754895 1.122329298 1.330576632 3.871124564 2.642745459 4.378975493 3.179591101 2.635339684 1.450776019 2.830118828 2.507469105 3.937290579 2.149941984 2.542405576 1.974854373 PC 38:4 27.22163778 24.3551869 28.76322474 21.346118 35.87737249 16.68146597 24.144631 28.97694702 26.27986688 23.75266977 20.33666546 21.27727382 44.03691873 32.18051639 38.28043856 20.47776806 20.4559082 20.77835659 27.77272396 21.92269173 33.27389655 25.86714367 24.95063502 24.77644512 24.87163771 13.04963969 11.46264905 13.96232722 33.28928228 33.22576571 36.29552363 32.51515681 32.83966772 17.22956951 23.67568379 21.24091605 20.07837249 20.370235 17.22981268 13.93140469 PC 38:5 5.778227743 4.73234614 6.476318041 4.599914752 7.695637301 2.970410228 5.051472056 7.128131391 4.865193458 5.681913036 4.017594104 4.068194931 13.70471012 10.5271622 12.39635108 5.303980608 4.639670738 4.779908796 6.752117639 5.546399745 7.470169586 5.689507201 6.301163781 6.796027862 7.313278133 4.114042897 3.190063576 3.926177244 10.00808047 9.655938793 9.941209946 8.135146511 8.951596141 5.39470817 6.442610823 5.352689639 5.347230822 5.581840455 4.266419227 3.077460579 PC 38:5 1 1.131751649 1.23567053 1.760504626 1.193698574 1.261313082 0.624513459 1.090147149 0.954565852 1.438356057 1.045204487 1.267488451 0.059546143 2.405871643 0.197024343 1.487082345 0.931180116 0.95768431 1.105063296 1.161163612 0.054158303 1.422153995 1.219121056 1.159429074 0.956574075 1.629325681 0.758952714 0.672669552 0.777581175 2.008197468 0.090798616 2.108502037 1.857672453 0.13203989 0.652756624 2.052032637 0.100545762 1.148223445 0.98755205 0.875368993 0.603063399 PC 38:6 8.235408168 7.468787378 8.94867915 6.749773693 12.16360155 6.09766396 10.36426198 12.04219181 10.56206275 13.50135356 7.633322659 8.521004367 22.872162 26.80389888 24.30431368 10.8580232 17.93609184 17.89260063 24.50812198 20.32174281 12.73876234 8.502682463 11.63845878 12.68828601 16.00402632 12.18746286 11.54094631 13.58892276 11.85191924 17.48073297 18.3389113 13.17013482 32.18928127 20.11043357 28.69787648 24.35378043 8.114269688 11.1643859 7.989073375 5.627585492 PC 39:6 0.069838457 0.11635867 0.109769134 0.072030427 0.142338503 0.083442935 0.120486151 0.132901829 0.117945197 0.110054024 0.08119568 0.107219589 0.180259791 0.175364295 0.201333868 0.153744224 0.197961605 0.265908594 0.229363741 0.193643566 0.146529954 0.162630036 0.129344138 0.145371475 0.189907998 0.135179297 0.137844373 0.192520514 0.125596512 0.167542264 0.173134239 0.183692755 0.265357211 0.163396674 0.341814907 0.297957263 0.11276375 0.128026451 0.085400259 0.094932911 PC 40:4 0.258736805 0.225277215 0.303386309 0.260006413 0.250906366 0.131889744 0.216658629 0.187654932 0.18074321 0.155747581 0.175791301 0.185518505 0.29570345 0.192288181 0.213265694 0.15127287 0.240586106 0.24550704 0.298663066 0.27285469 0.263380172 0.250400647 0.241021059 0.205121916 0.321812148 0.162024379 0.129190466 0.140802444 0.253476597 0.209765973 0.309464327 0.235889604 0.176749967 0.099608758 0.185626072 0.158428187 0.259946669 0.219322846 0.191121468 0.141150249 PC 40:5 1 1.49377837 1.318914547 1.764763961 1.455026646 1.609869493 0.818909325 1.205150097 1.201751004 1.017131956 0.865137675 0.862969449 1.012771517 2.025552506 1.220161652 1.459450748 0.848519833 1.332481673 1.50664848 1.891412353 1.290883424 1.537465264 1.362479719 1.192321697 1.144826946 1.88633855 0.84091879 0.615045521 0.843715656 2.022835756 1.851962438 2.545454615 1.905653403 1.228191623 0.668591862 1.047236851 1.04731011 1.389944345 1.140182703 0.920911442 0.834774649 PC 40:5 2 0.274165437 0.03201693 0.298153412 0.250274195 0.228867293 0.115882821 0.17647253 0.172711132 0.234115401 0.170994599 0.219838631 0.23696686 0.356843443 0.169617752 0.219796799 0.116673916 0.212252618 0.224980323 0.295463842 0.254433499 0.280913201 0.227249558 0.262135538 0.23311886 0.317686351 0.161206762 0.134753692 0.146556079 0.253183831 0.211530195 0.295759479 0.207515932 0.026826046 0.096096911 0.163119447 0.137034144 0.267158304 0.258167876 0.202164041 0.135425129 PC 40:6 1 1.776477343 1.640120583 1.717059415 1.520448778 2.194277888 1.105025471 1.747626366 1.881326437 1.816429477 1.68244436 1.443014407 1.517939564 2.82333913 2.436281779 2.982956562 1.39488414 3.361681321 3.641489585 4.776390246 3.473278839 2.094839705 1.839175896 1.756308102 2.028396331 2.873010712 1.702005458 1.518898013 1.822480121 1.811985854 2.24879473 2.934440222 2.020553388 3.445695315 1.974552072 3.918867899 3.282207886 1.627207143 1.859696996 1.368299028 1.014491393 PC 40:7 0.737160954 0.771089635 0.845295347 0.559181999 1.37673001 0.497797055 0.902491773 2.057161069 0.837796498 1.516199611 0.779053979 0.790721636 2.741109708 2.569083764 3.898881225 1.039139258 1.831238044 1.892713463 3.605319359 2.369849461 1.432761752 0.849594066 1.112172859 1.983317706 2.407584433 1.764825676 1.147398155 1.212853377 1.825570185 2.313012403 2.063740233 1.517456072 3.840769814 2.985580965 3.06454498 2.533790638 1.167957101 1.534695929 1.144311202 0.599888559 PC 40:8 0.103426454 0.105381437 0.085004146 0.078999176 0.130878185 0.08313862 0.096893952 0.128737163 0.127309813 0.102976747 0.114629196 0.090597813 0.144143339 0.200497528 0.14902223 0.102431113 0.111034961 0.13523852 0.128691377 0.131822047 0.109650134 0.100427387 0.109809654 0.124533243 0.196642755 0.132862716 0.103572155 0.115331295 0.130163658 0.135786272 0.123840992 0.125205517 0.131981825 0.117870364 0.170121508 0.115390608 0.083523848 0.11152965 0.079258236 0.051265854 PC 32:0 o 0.157221863 0.149595292 0.150658744 0.136611503 0.231918857 0.157269543 0.188016113 0.183980227 0.192433678 0.174224497 0.20391791 0.197573859 0.305893448 0.278928373 0.250819548 0.244338853 0.184975423 0.244255411 0.231014953 0.188338263 0.177418864 0.188706812 0.200156642 0.173155784 0.201921348 0.148806242 0.154328005 0.19879133 0.217232195 0.207060833 0.26497883 0.264530951 0.233827896 0.161544973 0.202988326 0.232215803 0.181536526 0.192392172 0.160934077 0.136882432 PC 32:0 p 0.13264528 0.146363107 0.12942292 0.126819209 0.169327891 0.14083658 0.17647253 0.180917973 0.158831233 0.164107317 0.166835895 0.194834006 0.249719467 0.272866085 0.267649702 0.24349339 0.220951496 0.288875987 0.275907294 0.21781217 0.156862899 0.177258472 0.166474021 0.148631879 0.199797776 0.138381629 0.140110873 0.194912474 0.215124282 0.17824521 0.243371589 0.236893389 0.304725304 0.180125837 0.243357352 0.302323394 0.16180287 0.150304181 0.136888709 0.118457953 PC 34:0 p 0.385715817 0.326816621 0.370622945 0.310830218 0.448105207 0.304618445 0.386926483 0.468034919 0.43291457 0.473987529 0.468201889 0.453232606 0.738774921 0.727727092 0.707557297 0.471768442 0.494841876 0.640583752 0.656460182 0.578867526 0.465367261 0.455898358 0.423869573 0.523649175 0.564081361 0.403766387 0.416005664 0.477745667 0.582018335 0.526090943 0.659214279 0.56747343 0.682264163 0.442301197 0.567595657 0.569343499 0.435713887 0.453168516 0.359504381 0.2966133 PC 34:1 p 1 0.424355667 0.922392497 0.666890081 0.424132458 0.642116859 0.60041178 0.837054085 0.53613945 0.437382655 0.631065068 0.5905261 0.859461509 0.46944938 0.715602517 0.345771765 0.615302073 0.794891025 1.83613983 1.171638491 0.777079548 0.849664874 0.958862116 0.724930443 0.606222441 1.230640232 0.52477366 0.742518943 1.283577837 0.741575675 0.426235989 0.686181884 1.121295376 1.717389544 0.46662872 1.268230477 1.577420802 0.662945956 0.515489762 0.664253279 0.641681941 PC 34:1 p 2 0.262150219 0.305776924 0.255864306 0.220296561 0.248261677 0.179971377 0.235489099 0.232363842 0.262454075 0.294300704 0.337452962 0.358981656 0.475640772 0.489971755 0.477461447 0.369987685 0.491859404 0.651723251 0.598151739 0.52065656 0.330599276 0.397384618 0.34810163 0.348650554 0.642532173 0.380055502 0.334549049 0.45970899 0.474924619 0.383306591 0.473977774 0.520094752 0.599579553 0.38860186 0.459635305 0.563979395 0.243228787 0.271351216 0.229541783 0.207821883 PC 34:2 p 1 0.832804823 1.621032394 1.006419884 0.668579337 0.85138633 1.190476879 0.991810248 0.699112614 1.003544081 1.295521581 1.254884546 2.185428691 1.114257033 1.308696309 1.010248889 1.46791915 1.800170623 3.910840158 1.994303534 1.410694855 1.51872306 2.682155365 1.542936956 1.326984279 2.074244323 1.114207176 1.275489713 2.903129183 1.369148362 0.975026585 1.420662308 1.969092649 2.209316522 0.997428467 1.804531207 3.922157962 0.938627102 0.870805463 0.870729805 1.230796864 PC 36:1 p 0.128753988 0.14746083 0.128996986 0.108376056 0.134133187 0.115578507 0.038887446 0.133330544 0.040641209 0.127438475 0.132075653 0.16219931 0.238884532 0.224809827 0.22865147 0.162068784 0.056418436 0.282242353 0.210632798 0.192906719 0.158072073 0.059785778 0.161662218 0.179818348 0.19482255 0.147784221 0.144437826 0.207001573 0.177474605 0.052456195 0.186341734 0.205307604 0.222040694 0.116784884 0.200701939 0.033182597 0.126531418 0.165109002 0.115652991 0.034506864 PC 36:2 p 0.306865946 0.418049624 0.32212738 0.234234058 0.34130047 0.259640816 0.327404882 0.295874992 0.208041372 0.26784404 0.291415542 0.364765791 0.321049459 0.424107528 0.326366847 0.352102888 0.410027818 0.794096057 0.632053196 0.445424414 0.402325304 0.437771819 0.369575199 0.383026549 0.563110585 0.283917404 0.361815724 0.569222002 0.434698603 0.291861094 0.469446332 0.541375005 0.713445087 0.25968514 0.508435384 0.615437369 0.342749353 0.311112735 0.34963794 0.32242839 PC 36:3 p 1 1.259003734 1.547484933 1.581612579 1.22968375 2.430197684 1.40112312 2.207277423 1.952799448 1.721314357 1.814062703 1.697944962 1.682269871 2.575941435 2.937746621 1.896971976 1.867107832 1.462778435 1.992092811 1.79481642 1.623349091 2.054552212 2.045818441 1.719250037 1.497021416 2.328708906 1.149841638 1.561068638 1.943177165 1.754486658 1.432724529 1.744991976 1.902307451 3.072801659 1.207053821 2.264881008 2.126368231 1.300061146 1.308252669 1.13535953 0.966920845 PC 36:4 p 1.322151899 1.970047419 1.589583619 1.141192658 2.098187531 1.709393334 1.95750314 1.828655667 1.653007746 2.015693834 1.592337509 2.137511703 2.716086167 3.130666291 2.179756259 2.16581647 1.952463119 2.758715609 2.299261848 1.773666015 2.227354228 2.934654874 1.891828584 1.608583923 2.394539634 1.19283465 1.490669793 2.436438253 2.000234239 1.561865566 1.982837416 2.26005662 3.18225425 1.494961443 2.298676671 2.924621747 1.182642613 1.281603992 1.075376792 1.155693689 PC 38:2 p 0.058983799 0.07208383 0.082022612 0.065241905 0.024005636 0.058489176 0.033548539 0.058182828 0.073631589 0.056950701 0.070581866 0.082439139 0.085067143 0.074768212 0.059533533 0.051573253 0.074499675 0.078852631 0.066770907 0.080095341 0.070461891 0.070025683 0.023987197 0.054009295 0.07911822 0.047626174 0.055082804 0.073116421 0.080217819 0.027992319 0.102344274 0.094222003 0.074090985 0.021645749 0.072449899 0.070668951 0.031796755 0.066762692 0.058153199 0.053243623 PC 38:3 p 0.442719836 0.503001211 0.537710551 0.439511765 0.772181294 0.540644484 0.71916524 0.759684001 0.826412063 0.703262787 0.718555236 0.750963322 1.090071909 0.920267869 0.786746943 0.680077558 0.522554016 0.713991797 0.731796753 0.59655187 0.702805145 0.752601182 0.684927842 0.598709337 0.729234578 0.422912245 0.430291479 0.576333237 0.656088073 0.585015951 0.749787856 0.776126985 0.781903763 0.431254841 0.581814128 0.672571313 0.519499976 0.527192621 0.420728592 0.379211179 PC 38:4 p 1 1.299691633 1.342027721 1.307068049 1.038944295 2.139620987 1.135517747 1.603908753 1.710697638 1.309760905 1.42599996 1.328385211 1.327915522 2.817341219 3.015545977 2.632160871 1.924079042 1.241019186 1.616729256 1.595587308 1.46256893 1.635298466 1.628971644 1.41739917 1.42855294 1.585701448 1.001035396 1.217934364 1.481787338 1.502883763 1.36321419 1.679562375 1.664611033 2.521590281 1.253410205 1.843399792 1.816372921 1.195754677 1.334689849 1.113601086 0.906390705 PC 38:4 p 2 0.216547004 0.338525669 0.270771976 0.1828095 0.332891716 0.323668509 0.31138816 0.294466356 0.315887473 0.309785215 0.314633261 0.421450309 0.456486154 0.435411168 0.362790317 0.444518515 0.337764998 0.519113152 0.370542412 0.312202356 0.389738898 0.552827641 0.338765296 0.273732149 0.516209983 0.252030352 0.240042892 0.495006572 0.28140645 0.260222716 0.287083425 0.392011716 0.415397261 0.210519279 0.333741102 0.502167453 0.209071861 0.217983362 0.187789093 0.228276177 PC 38:5 p 0.355199893 0.409816699 0.389424865 0.310710067 0.369239233 0.30881798 0.371270498 0.38694643 0.307991816 0.349066475 0.271912658 0.320745482 0.585344495 0.615132732 0.501199502 0.427414144 0.370199385 0.510289167 0.433340088 0.413813649 0.377702116 0.453481486 0.377116084 0.378844727 0.429568251 0.286438389 0.304672466 0.481883112 0.409462195 0.370486579 0.411090202 0.474924402 0.631341127 0.360698637 0.481927581 0.519507231 0.273648776 0.316752667 0.252476359 0.228952783 PC 40:3 p 0.078303724 0.030126406 0.029693646 0.016761042 0.10232911 0.074617825 0.098553342 0.103626679 0.112252979 0.111003994 0.117415322 0.102166082 0.181098209 0.177132462 0.136211216 0.113877384 0.088107205 0.093747017 0.10144637 0.106179749 0.074144376 0.099282553 0.09695424 0.024949176 0.078329465 0.05968602 0.06675871 0.014028526 0.097783765 0.107382301 0.105107348 0.098437903 0.089942739 0.020879528 0.078880363 0.02682052 0.083196046 0.106735708 0.085922985 0.015770105 PC 40:4 p 0.121654086 0.10818673 0.124920195 0.101947986 0.199504467 0.130002997 0.164928947 0.194269401 0.158219166 0.149572776 0.131080608 0.152396724 0.303055727 0.279875605 0.283663469 0.223592488 0.145084855 0.16152273 0.181065774 0.152159043 0.128502262 0.145711933 0.150745889 0.139488573 0.145252316 0.10697152 0.117033788 0.121666758 0.148549348 0.149429587 0.181976077 0.196875805 0.167111171 0.111485187 0.144113852 0.152003736 0.138528956 0.142408277 0.118005255 0.099408914 PC 40:5 p 0.071613432 0.0761698 0.061091026 0.049982749 0.025836574 0.067070834 0.023520051 0.100441935 0.135021849 0.098179399 0.101428264 0.098086745 0.150528212 0.144989709 0.133071262 0.101780757 0.111097096 0.152260675 0.145100301 0.136758927 0.11245322 0.113147765 0.101981497 0.115744329 0.128809802 0.114261936 0.123558559 0.142483281 0.081154669 0.075332271 0.096320772 0.021614849 0.161304668 0.100566535 0.165834532 0.176890684 0.079590229 0.106524211 0.07670995 0.056990975 PC 40:6 p 0.118172403 0.135080951 0.137576503 0.097262103 0.15271382 0.116247998 0.118466024 0.132411868 0.138388215 0.136938175 0.144546885 0.17528972 0.172520551 0.194372092 0.192918791 0.145874913 0.185783176 0.288375335 0.23457538 0.166601257 0.165052307 0.185781125 0.154408604 0.125242027 0.243664703 0.142810386 0.127198694 0.246953782 0.139063737 0.115909373 0.151748043 0.174524847 0.240679571 0.139388409 0.219135937 0.269265544 0.133874173 0.123726003 0.09618147 0.104249244 PC 42:4 p 0.091138162 0.086781125 0.09802554 0.083324606 0.159291636 0.099023818 0.147685719 0.151704069 0.109253854 0.114186393 0.109454961 0.114708521 0.25416953 0.236239765 0.256597063 0.21136579 0.125760919 0.133173332 0.133541813 0.135358916 0.089918606 0.09953696 0.095230609 0.090795153 0.084639507 0.085713485 0.085371478 0.085140872 0.10680095 0.1105579 0.141303622 0.139459272 0.124143045 0.093287433 0.10110119 0.112147197 0.103323064 0.109485175 0.100885999 0.069326007 PC 42:5 p 0.079737358 0.043725978 0.050990318 0.037607212 0.113111302 0.070357427 0.104685871 0.11158854 0.060349748 0.053673305 0.062555169 0.041889311 0.121119101 0.11960388 0.120574244 0.094756909 0.076053046 0.096563182 0.090661888 0.082821678 0.05644646 0.070788905 0.08783336 0.056631794 0.050176969 0.050283428 0.014285814 0.057277762 0.066750594 0.070686487 0.082450139 0.083113443 0.085355602 0.012834205 0.062589853 0.064930607 0.007801678 0.091507893 0.02626695 0.062716095 PC 44:4 p 0.117557989 0.097819343 0.102345722 0.088190715 0.187840712 0.133654766 0.16233164 0.205844722 0.142978713 0.146770364 0.137581569 0.148012959 0.36593705 0.346055577 0.362978714 0.313211582 0.183794861 0.210023356 0.193398268 0.178464504 0.11223337 0.12675857 0.127620507 0.135661143 0.127778353 0.106426442 0.114629925 0.138604426 0.133501187 0.128788192 0.160258312 0.151973132 0.1577627 0.113017629 0.127108846 0.142086381 0.154263433 0.210651451 0.156621593 0.113617623 PC 38:4 1 0.66124662 0.676746416 0.995710701 0.74998153 0.756245349 0.376193128 0.678474109 0.501719714 0.548044261 0.429433936 0.618851717 0.56331382 0.939027748 0.638750394 0.653110489 0.45440393 0.540076041 0.6977832 0.853831679 0.613425681 0.811960617 0.714630853 0.772258476 0.53839187 1.217170719 0.370448506 0.36586795 0.403013056 0.834850847 0.607892027 0.96398138 0.740860653 0.635115354 0.37525684 0.635401331 0.65267423 0.802589438 0.613342578 0.550560509 0.42704196 PE 38:4 1.350913369 0.473627954 0.372959046 1.12796312 0.670047795 0.714194869 0.511743485 0.794740169 1.058207217 0.336603017 0.797089397 0.8244053 1.787635483 1.243423692 1.809361718 0.546421663 0.784997976 0.869390444 0.854143495 1.252923121 1.413487383 1.208013895 1.162002182 0.574063402 0.673126628 0.580524302 0.760272473 0.515922365 0.400588034 0.71187854 0.549912685 1.306681694 2.173931244 1.770706722 0.41740672 1.604149593 0.658064326 1.020141259 0.647225368 0.474122167 PE 38:6 1 0.434689872 0.378295703 0.466082404 0.418209992 0.496146501 0.370965296 0.459675031 0.464963965 0.524817441 0.435521174 0.329143829 0.173876258 1.15816102 1.544874938 1.475439239 0.695445753 0.702621645 0.694841011 1.129586423 1.186330751 0.66919134 0.599817049 0.529250873 0.638342681 1.170785576 0.770083258 0.739380267 0.79557681 0.373833298 0.713881574 0.538838055 0.619104646 2.740961837 2.48330305 0.980707448 2.078674323 0.335000098 0.495371188 0.331257078 0.243982575 PE 36:2 p 1 0.416053111 0.963722387 0.587142768 0.22297554 0.680604103 0.832071692 0.683727163 0.46445189 0.840565139 0.798846157 1.099187299 1.789766287 0.193476783 0.707231709 0.346836608 1.070423773 1.026877496 2.503273837 1.215734771 0.546057439 1.309269059 1.918532473 1.3404705 0.741189526 2.113334462 0.69899865 0.895307463 2.219786629 0.752431138 0.263599369 0.654930733 1.45884259 1.403824578 0.504949564 1.15260673 2.998008844 0.573319645 0.502720909 0.751467106 0.910868279 PE 36:4 p 1 1.403801476 1.894078486 1.762825155 1.469754265 2.116817659 1.284758315 2.551354207 1.341124035 2.39263414 3.032708797 2.404536003 2.06889564 1.627454705 2.681461499 1.158120641 1.510902057 1.917672524 2.008157657 2.482463184 1.374762496 2.235419748 2.005858778 2.176306446 1.184716548 2.112047413 0.942326732 1.625515542 2.330610903 1.51219234 0.810828455 1.040251496 1.620038039 3.461335587 1.064031075 2.578048477 3.865685084 0.966407646 1.084328822 1.42788016 1.070408658 PE 38:5 p 1 1.208367327 1.393150843 1.217587898 1.14889979 1.736790552 1.137164645 1.984386605 1.137318244 1.864483013 2.274179993 1.766150065 1.631191139 1.73724153 2.68697891 1.527095755 1.398364691 1.324078376 1.817244215 1.901058408 1.239604647 1.949346779 1.807389902 1.771256094 1.369148632 1.969184974 0.958275202 1.409969123 2.165553474 1.544078121 0.981487013 1.233484703 1.647141699 2.995277883 0.995097424 2.017833121 2.345651628 1.124358999 1.177915268 1.25414393 0.942361066 PC 36:2 p 1 0.135512548 0.350234718 0.176214751 0.110779072 0.170073828 0.28276869 0.180440637 0.113058422 0.204185353 0.195503825 0.237550434 0.499505683 0.214247952 0.204412756 0.169243535 0.309569587 0.377593431 0.842158612 0.396497409 0.292602208 0.291905695 0.568410104 0.32353989 0.244175881 0.445586051 0.203859101 0.222666396 0.617966283 0.259917443 0.208413403 0.27575482 0.389134197 0.381603411 0.164226747 0.354675836 0.667519076 0.185732387 0.192039676 0.17387153 0.273504631 PC 38:6 p 0.180774422 0.245219189 0.211323837 0.15277179 0.294035136 0.224340377 0.284116444 0.265619922 0.264779928 0.310782684 0.241928632 0.339559141 0.358004329 0.657253 0.396136631 0.378832531 0.490740977 0.700098714 0.550318176 0.470771973 0.411559 0.481211911 0.30666267 0.324835432 0.525007638 0.357639177 0.413052347 0.663478184 0.229059932 0.237287833 0.302335596 0.346640609 0.828007401 0.475695671 0.715210539 0.960361727 0.220413796 0.235326152 0.190664083 0.214327702 SM 32:1 d 0.835479005 0.826737552 0.901565299 0.893969494 0.827227265 0.639410439 0.689872534 0.690873174 1.003207035 0.86379545 0.980616572 0.948928256 1.077496272 1.013388082 0.807766902 0.839398454 0.734947307 0.879167286 0.785765607 0.797954415 0.721776263 0.796725076 0.773253122 0.725482635 1.183194683 0.925521661 1.138734145 1.06384339 1.17434409 1.099239456 1.104499365 1.229490532 1.096385633 0.870253123 1.151967124 0.980161012 0.666318025 0.796749345 0.715382589 0.532110946 SM 32:2 d 0.177399628 0.147243152 0.209857357 0.172259497 0.038614555 0.029868437 0.093479433 0.08491387 0.138993823 0.091525838 0.116242508 0.039528903 0.128651267 0.092807441 0.022982123 0.067186018 0.114298194 0.146192796 0.174724886 0.013529147 0.092525036 0.086738466 0.069159901 0.004709317 0.16105093 0.073569315 0.104539528 0.090741441 0.181195482 0.155380914 0.189720609 0.141320751 0.109020364 0.091238977 0.107961896 0.117893114 0.009055824 0.005116862 0.088188838 0.067143019 SM 34:0 d 0.480555606 0.412048447 0.48649292 0.423760802 0.339967317 0.263796024 0.264953105 0.340028456 0.420580015 0.408609122 0.413901694 0.410185675 0.676229507 0.677129238 0.525415106 0.425186288 0.476150625 0.585249877 0.615590849 0.565704053 0.344691189 0.377252167 0.392242648 0.423590647 0.557394218 0.386177389 0.493895934 0.492867084 0.672150259 0.603912476 0.776275497 0.702477601 0.67851601 0.518657615 0.572061071 0.550738269 0.383442669 0.447860118 0.35551948 0.25447909 SM 34:1 d 9.202559158 9.08376169 10.33121935 8.714404383 12.44091951 8.540113908 10.29154574 10.58153636 12.85029382 12.55817549 12.81345083 12.17947657 17.70849475 16.55402289 15.10100579 12.40173416 14.57583035 17.49450032 19.60012804 16.75704272 11.02971312 12.01191026 11.15985863 11.19553301 15.20108921 11.61792344 12.8766297 14.14397998 15.0523829 14.46471518 16.04137046 15.5157806 18.95492367 12.83043834 16.9759185 15.29061986 10.31839694 12.0483259 10.57950156 8.367912712 SM 34:2 d 1.768409869 1.660446444 1.728615166 1.605682831 1.704480946 1.253344858 1.469956983 1.522855048 1.807481973 1.834262471 1.956923029 1.990872595 1.929880771 1.88727678 1.767434693 1.543815198 1.952438003 2.306820837 2.476510155 2.337359159 1.745726741 1.677454113 1.820874171 1.741331825 2.069333888 1.752868886 1.961716246 1.97746864 2.279152244 2.229474586 2.23937647 2.254117553 2.319669299 1.844648858 2.136948201 1.985809992 1.395431043 1.740406503 1.539619162 1.240182908 SM 36:0 d 0.264920089 0.217167805 0.176170668 0.16006845 0.034102889 0.059611376 0.102429592 0.073475984 0.046331274 0.047228635 0.103573381 0.095596604 0.125745156 0.195030129 0.11698995 0.137420403 0.140640786 0.091526073 0.130712746 0.156911581 0.099712429 0.140553504 0.114593412 0.011029715 0.121641032 0.079597569 0.135074671 0.167587441 0.119060874 0.153670113 0.146197884 0.172370055 0.230738884 0.195039015 0.24805086 0.232814134 0.122372785 0.040800245 0.088452088 0.03452782 SM 36:1 d 1.734518968 1.541722411 1.788251318 1.512177499 1.822182355 1.486895953 1.619694555 1.467157517 1.854600429 1.662773669 1.875422664 1.909468861 1.855104318 1.874595018 1.520322152 1.570396962 1.716126211 2.011946042 1.866379459 1.952706931 1.635182606 1.812210468 1.722561101 1.580843268 1.535370157 1.446781169 1.75263719 1.775247865 1.806472352 1.961180859 1.960847058 2.103616111 2.289845338 1.869656788 2.354117228 2.243121396 1.461085769 1.891757908 1.520007017 1.268469548 SM 36:2 d 5.406033315 5.03024434 5.828868437 5.068062156 4.692132835 4.190114962 4.327898862 4.450083566 6.614239233 7.48370294 6.085229982 6.777506004 6.629061091 7.753744646 5.671878504 4.922137913 6.765527237 8.606227246 8.554652834 7.593167619 6.831263086 5.762365518 6.25013671 5.500110149 7.039918594 4.569171141 5.459390176 6.738025696 8.142192125 8.240723366 9.060742105 9.051645669 8.538842453 6.365032025 7.486852377 7.833632697 3.986945836 5.545736312 4.565549307 3.755579865 SM 38:1 d 1.128455297 0.985071472 1.333183436 1.1047527 1.090496257 0.764657076 0.953547044 0.964512161 1.105315766 1.001165635 1.180710417 1.229618654 1.629768998 1.259625629 1.215973181 1.074732419 0.866109169 0.986585961 1.011286459 1.022113817 1.00613384 1.063503282 1.033738587 1.05030156 1.145580224 1.046086758 1.165669075 1.1490056 1.482093148 1.367231278 1.349284638 1.416714739 1.644829072 1.359335149 1.563641895 1.352123244 1.000549438 1.254304571 1.066690065 0.867624715 SM 38:2 d 0.72536461 0.662277303 0.823716909 0.626132186 0.620752189 0.512281337 0.532605463 0.563937505 0.75243339 0.71681668 0.825060587 0.955848747 0.879433679 0.72430155 0.754251387 0.575165966 0.699566671 0.907984595 0.84317994 0.800872466 0.687560222 0.76511421 0.660805182 0.610600093 0.763510681 0.569239496 0.586834774 0.719510149 0.981544057 0.868281427 1.040778248 0.932613802 0.890374739 0.656829283 0.827334296 0.896492025 0.662981669 0.766182824 0.591391715 0.512179435 SM 39:1 d 0.391669578 0.382261812 0.478041489 0.434610834 0.374202901 0.29742939 0.363831046 0.329585169 0.391904105 0.310080418 0.406326339 0.426724474 0.4828614 0.401300912 0.388616755 0.385557512 0.266842746 0.330585281 0.307919519 0.346187005 0.359369668 0.44145832 0.423541289 0.391988653 0.491142497 0.465651932 0.51723065 0.485919363 0.439602351 0.486873614 0.466406517 0.498129858 0.467910388 0.44089323 0.507059791 0.468420235 0.307183095 0.398711308 0.286679536 0.222467876 SM 40:1 d 1.85841318 1.65273572 2.17475548 1.720156765 1.861194998 1.387501828 1.55903237 1.59832023 1.801296972 1.529067774 1.975600196 1.927297921 3.000111768 2.503206908 2.212193492 2.055209317 1.749302447 2.012711951 1.991714781 2.125269879 1.857485646 2.067066238 1.961213239 1.948913549 1.911335205 1.755452423 2.033853854 2.1038961 2.316158886 2.193547782 2.147040964 2.326841005 2.724924306 2.245004119 2.503919027 2.274463493 1.722632276 2.124305841 1.730212352 1.507949673 SM 40:2 d 1 1.303372076 1.286529115 1.645291201 1.433179513 1.328951084 0.927553004 0.928685493 1.056015249 1.470455688 1.330707507 1.538319391 1.591478193 2.015275704 1.473198032 1.563440992 1.281045926 1.253312212 1.491032485 1.66435381 1.643393484 1.32936408 1.529572138 1.362248115 1.409944642 1.37764079 1.261750652 0.792313617 1.399649882 2.011790681 1.81234124 1.914759458 1.890397139 1.753682354 1.382173442 1.69526326 1.481004105 1.179997747 1.409156987 1.150798524 1.005635329 SM 41:1 d 0.766083349 0.656784732 0.942394041 0.712688621 0.675422967 0.537255366 0.619123662 0.627467502 0.685073115 0.622115124 0.707250764 0.721725038 0.957116243 0.814803216 0.726235085 0.69002845 0.705518553 0.803629554 0.800574203 0.911891058 0.70891994 0.791912349 0.753817676 0.88225331 0.893231191 0.841249118 1.014460114 0.982155039 0.849599389 0.928159434 0.841118747 0.947880569 0.916188757 0.869910548 0.981867989 0.89144847 0.620562281 0.828527753 0.636275885 0.560900906 SM 41:2 d 0.529219465 0.493169494 0.639809015 0.498370011 0.415073289 0.31650503 0.392244248 0.407661173 0.572056293 0.525703565 0.640509279 0.567128321 0.568368106 0.483636292 0.490394728 0.411651537 0.493896053 0.608131395 0.605911487 0.704974687 0.531765878 0.576542816 0.579403474 0.586186003 0.660272906 0.658679114 0.706708544 0.660559793 0.715735859 0.709579548 0.679291155 0.751063056 0.582193804 0.562621327 0.55861253 0.548486682 0.42657699 0.538886408 0.41067041 0.321118789 SM 42:1 d 1.024796312 0.870255614 1.085354158 0.964189926 0.921972255 0.738051578 0.823272515 0.851500876 1.007142945 0.844822567 1.038999045 1.019892607 1.791169892 1.474254846 1.42675208 1.226541117 1.176819496 1.255611342 1.328223502 1.500143689 1.067580992 1.20657253 1.094442806 1.197405743 1.073313781 1.026771738 1.174202914 1.170059299 1.167216885 1.184376925 1.141209141 1.251152837 1.462543682 1.284768126 1.371377574 1.160558191 1.051786339 1.366336927 1.046683045 0.832794903 SM 42:3 d 1.945312927 1.761636501 2.037747075 1.674196517 2.340360487 1.544122873 1.917749039 2.263209511 2.090417619 2.149717182 2.182746957 1.896097066 2.503837551 2.504263722 2.664065804 2.054965448 2.786583357 2.994223767 3.186495462 3.435607589 1.908607247 1.954295294 1.951747925 2.249194455 2.328146504 2.135355506 2.371073837 2.23379742 2.875827229 3.187925248 3.072319678 2.738321644 3.163428435 2.944084242 2.979972461 2.436487719 2.088320763 2.789093996 2.469550715 1.790312745 SM 43:2 d 0.043574016 0.128864164 0.156172917 0.021943885 0.033970192 0.142941804 0.180850028 0.155903358 0.039359092 0.103495854 0.043754202 0.045745614 0.12328614 0.110388975 0.099042006 0.143273269 0.046843522 0.143512116 0.112677696 0.139137996 0.037252968 0.13792838 0.122291868 0.047093167 0.138518164 0.113921714 0.16520979 0.166113682 0.103709971 0.144009124 0.140106306 0.160713671 0.189469873 0.17357102 0.211814515 0.205885149 0.069944328 0.162393056 0.136232011 0.136601315 TG 46:0 0.175646946 0.142009788 0.12404527 0.185061263 0.167779752 0.121510942 0.178057773 0.133470155 0.223304565 0.138008267 0.173278948 0.113244049 0.116824744 0.137109205 0.170288053 0.097485588 0.096843049 0.175126338 0.166485946 0.103701102 0.18394875 0.141342414 0.184563778 0.112733401 0.425069922 0.102184942 0.105766912 0.152423392 0.259252706 0.091973438 0.126886246 0.229939345 0.175558024 0.123370947 0.085384239 0.191512197 0.111947343 0.115545583 0.082385442 0.190303946 TG 46:1 0.133688729 0.110359324 0.102727002 0.201345437 0.12658996 0.091285859 0.12488598 0.080002882 0.233152869 0.09926791 0.143378255 0.073056384 0.076118105 0.069521169 0.137017755 0.033224943 0.053413144 0.092601591 0.14996444 0.055380364 0.117342391 0.0229551 0.155290918 0.068748894 0.434462435 0.025260709 0.011628823 0.020281587 0.269840805 0.011984746 0.099924886 0.237428998 0.151811298 0.070302038 0.05090693 0.143824483 0.0933311 0.059190529 0.05582034 0.10381851 TG 48:1 1.038848062 0.927942802 0.94090205 1.672704231 0.914321844 0.410557386 0.914673383 0.327615763 1.101635854 0.605343613 0.758558816 0.451845084 0.591934099 0.579581731 0.869218287 0.352596487 0.357309677 0.661844515 1.6854699 0.364838709 1.025137439 0.74989334 1.292268129 0.385511271 5.337941321 0.315355764 0.261648512 0.52829034 1.402715444 0.339477429 0.522074745 1.424573985 1.519161401 0.737486643 0.434638139 1.211018762 0.515195168 0.334018888 0.241238025 0.338864575 TG 48:2 0.56405772 0.512056994 0.537465097 0.846777031 0.66132499 0.241419039 0.573036144 0.240483911 0.663348159 0.325786659 0.322057058 0.237865731 0.283026972 0.267273453 0.458799952 0.166446662 0.234690697 0.367442586 1.173082188 0.199040318 0.507666688 0.460626981 0.610628658 0.2103864 2.851860502 0.193889377 0.191114164 0.28013509 0.870559689 0.263555959 0.30255472 0.738535776 0.758479859 0.414393996 0.250240544 0.710124735 0.284990949 0.171900638 0.140895919 0.15911641 TG 48:3 0.118400311 0.123520268 0.117991139 0.159265306 0.205582827 0.070525195 0.145291079 0.011960827 0.154137407 0.075574335 0.064314698 0.043181779 0.057320243 0.012744354 0.088064702 0.048356458 0.061253088 0.072908934 0.287717332 0.038793671 0.107599602 0.107311077 0.156818897 0.036961771 0.549285908 0.010749238 0.057451922 0.008375672 0.180257187 0.074674188 0.069763831 0.15840266 0.147879721 0.110988202 0.081650235 0.162235125 0.074402503 0.049762576 0.039679519 0.031967224 TG 49:2 0.105150348 0.105030747 0.084693422 0.126164299 0.127413756 0.028545912 0.139956966 0.067883634 0.103598049 0.078161564 0.033285677 0.023952913 0.06559395 0.030285741 0.131811334 0.01345739 0.028878067 0.09714605 0.117308219 0.004318023 0.109682966 0.1167018 0.117011023 0.008205513 0.300208201 0.018945532 0.010728973 0.077872986 0.117091913 0.020661486 0.064098798 0.111364839 0.118209419 0.085766204 0.060117475 0.148254111 0.074902268 0.068760255 0.044050991 0.07389047 TG 50:1 3.505889252 2.992156508 3.186791254 4.220188184 3.067358024 1.324713513 2.578239304 1.111644008 3.601120113 2.065630398 2.946064489 1.941050897 2.779436062 3.158881528 3.693320564 1.769550156 1.547853114 2.323140769 4.807868783 2.121862999 4.99774416 3.46943054 6.27315797 2.600260585 14.30826098 1.484604106 1.200952826 2.34075814 3.720574777 1.826724792 1.887557491 3.799143947 6.969375717 3.66289598 2.037148461 4.434472885 1.8192068 1.575602256 1.06556322 1.173790902 TG 50:2 5.026832122 3.511596469 4.55502475 4.972380038 5.407121261 1.613378326 3.896696578 1.835234432 3.148708882 2.67015699 2.079105587 1.732594021 3.190010502 3.111985168 4.921845373 1.787707974 2.443637217 2.912010488 10.15486912 2.899929695 6.038506826 4.425598726 7.177560695 2.868898736 20.05507014 1.96811826 1.464539475 2.472692285 3.643603453 2.702153568 2.253214383 3.51229724 7.511304308 5.793983583 2.697071546 6.296439321 2.374133279 1.800809813 1.336661764 1.184286707 TG 50:3 1.657009798 1.357888349 1.756470717 1.674834871 2.913399736 0.789744798 1.72520456 1.122495884 0.933069536 0.974296153 0.60736286 0.591171193 1.0795533 0.92131658 1.572910491 0.682399118 1.089131787 1.123601098 3.800277935 1.030362635 2.021230339 1.686637981 2.176565867 0.954574696 5.540291276 0.86571674 0.719671846 0.95101952 1.159241081 1.107097718 0.880912616 1.214023742 2.12981396 2.366473893 1.204652128 2.598115236 1.069621882 0.691501327 0.635746599 0.463134911 TG 50:4 0.177855273 0.213913478 0.220460519 0.211389881 0.588556357 0.171809756 0.256206763 0.235493632 0.140166558 0.147131655 0.092442304 0.076117034 0.130526003 0.122718108 0.209336208 0.155500459 0.169151022 0.192184525 0.548856588 0.117888893 0.290016467 0.36439214 0.285088712 0.129809739 0.871860031 0.151631436 0.143076051 0.165852156 0.207765482 0.15607285 0.11345802 0.232459228 0.289626182 0.365947218 0.221737642 0.467256539 0.204591266 0.105550536 0.1208544 0.069272316 TG 51:2 0.315281171 0.426350363 0.371427348 0.352164279 0.433225076 0.239205586 0.409795351 0.200720102 0.289188955 0.238978302 0.151679525 0.213580138 0.258205851 0.237775285 0.411116757 0.240236942 0.271408708 0.425071599 0.566980515 0.23954749 0.564530259 0.503727989 0.583205456 0.265311592 1.6162754 0.183072956 0.139199777 0.349563183 0.323715542 0.222883743 0.194919095 0.401501394 0.573957839 0.386261768 0.201387317 0.599384036 0.274870709 0.194017338 0.077677703 0.170391904 TG 51:3 0.237649978 0.308094473 0.242422843 0.222880115 0.481737498 0.262637658 0.326735591 0.209829341 0.163451307 0.14706357 0.113638752 0.132273307 0.170173607 0.143123395 0.284194379 0.160007719 0.203500129 0.27767305 0.395134749 0.18937617 0.409442222 0.435906104 0.466998633 0.218444066 0.835111824 0.169502044 0.145221846 0.266844767 0.188665383 0.186387208 0.126309252 0.23693902 0.364221305 0.371197045 0.187695966 0.499371342 0.211962799 0.169632258 0.118164263 0.127029234 TG 52:1 0.801877569 1.020839801 0.693455566 1.099562194 0.682469083 0.416510811 0.830428265 0.320249161 0.973684247 0.633735052 1.436683963 0.720250779 0.564928719 0.815638676 0.656135995 0.600302602 0.504350929 0.940307906 1.504948962 0.499794076 1.707010088 1.306193323 1.751707287 0.504971714 3.64605619 0.378507536 0.341319792 0.846496667 0.900559301 0.317948269 0.807057373 1.299279791 2.001015494 0.591975119 0.55873156 1.164576881 0.526065055 0.370809169 0.277756633 0.378748635 TG 52:2 15.05459099 11.49977545 17.77550684 12.75393222 18.34391952 5.651861656 11.42541612 8.848239555 11.19057427 11.52590307 9.213362538 7.320742024 14.22634147 16.97877342 21.02422525 6.458323639 10.7712934 11.25445226 30.07483243 14.73940158 27.4671269 15.16810375 27.7427104 14.69393026 50.18044064 9.296545499 5.43024491 9.35472611 10.65209424 9.940886103 8.909575589 11.85892046 25.56961467 20.3476468 10.0478953 18.33831377 10.46189154 9.451416042 6.177764847 5.261097435 TG 52:3 15.20492711 14.24867921 18.39663487 11.55483872 30.13655689 9.783920623 14.25190336 13.13520588 9.317411603 12.05145107 7.518775025 7.379493196 13.33834104 14.83915385 20.42472495 11.17137193 13.90535331 14.20703357 33.92694038 18.59772686 32.71677423 25.80121087 33.58111813 20.06100117 45.85694944 13.70675622 8.641322811 13.73624104 8.946787544 12.60659737 9.253516522 11.40338157 26.46407468 31.60002445 14.35009097 30.30689172 14.26778886 12.39747398 9.744348327 7.991446268 TG 52:4 3.823463686 4.314863408 4.964966672 2.909160016 11.72902203 4.046879186 4.36694521 4.840332791 2.176627847 3.258138932 1.71344671 1.953626176 3.488393474 3.52939857 5.271056518 4.684781338 3.942476581 4.336204517 8.820274015 5.061477385 9.060732097 9.445541901 9.259070184 5.913144113 12.06462441 4.530131908 3.272959851 4.780778381 2.41465739 3.835389964 2.54957953 3.139494515 6.79670085 10.55460709 4.988319022 11.46560753 4.298603067 3.683564836 3.415330534 2.631508334 TG 52:5 0.451857713 0.672106904 0.741373365 0.457707031 1.738300744 0.665715099 0.642802955 0.813336232 0.299648006 0.481020428 0.256775222 0.287434953 0.413751544 0.427365454 0.699755642 0.668104666 0.475754874 0.632601907 1.213695255 0.51795719 0.990210461 1.399699236 1.037095637 0.60255079 2.24522156 0.658054902 0.506892077 0.641050424 0.492502289 0.541808146 0.360568853 0.555704249 0.75800807 1.506985822 0.767275719 1.70512992 0.617084742 0.457645574 0.466469736 0.351879374 TG 52:6 0.051386075 0.057522952 0.072327538 0.048852521 0.201463848 0.072738648 0.074846919 0.102657164 0.023819154 0.035131853 0.020793474 0.026481276 0.039779984 0.032791653 0.064699301 0.059109491 0.042922283 0.056904534 0.132890375 0.041740893 0.077697207 0.130266177 0.09087454 0.057956057 0.247786237 0.050252687 0.057313484 0.050807797 0.050397273 0.06155062 0.037452162 0.038778203 0.062852813 0.131302752 0.074431159 0.136557125 0.07708874 0.03998019 0.046673875 0.037245115 TG 53:2 0.087653601 0.124226465 0.098605041 0.091921878 0.117253607 0.080905527 0.125478659 0.084676318 0.098406695 0.078774329 0.071326451 0.074254029 0.076515243 0.084485045 0.104064921 0.084607703 0.092894876 0.139561004 0.131011675 0.085263827 0.195652352 0.172965873 0.186574277 0.09329151 1.30162621 0.075446213 0.062297265 0.119128364 0.076971324 0.067624338 0.069711377 0.11696458 0.138234252 0.092842059 0.070199287 0.162858041 0.084772626 0.061742456 0.045127046 0.057457038 TG 53:3 0.191529914 0.350851488 0.257880198 0.130425578 0.459952674 0.257142189 0.359078943 0.258940022 0.123981748 0.204186874 0.072535373 0.153365177 0.200356091 0.234267007 0.302670823 0.308039005 0.284381278 0.407420656 0.461994356 0.236874427 0.598109178 0.628616573 0.524498895 0.243725917 1.084013422 0.208736762 0.165987601 0.397671384 0.181347138 0.185031468 0.158988099 0.259967953 0.392266555 0.39995697 0.22279561 0.603329173 0.270810119 0.195009754 0.134708604 0.161275547 TG 53:4 0.084680853 0.129234043 0.091971259 0.063538715 0.203202973 0.120824008 0.127849376 0.108597972 0.013207415 0.080544539 0.039572076 0.051432226 0.00966369 0.028066218 0.104191907 0.139016767 0.101637259 0.150757498 0.161789197 0.090609952 0.177085905 0.261495505 0.16687139 0.101940564 0.362374897 0.090763877 0.019589029 0.143009413 0.005605464 0.083784765 0.015841111 0.090995783 0.128221835 0.170961775 0.102062793 0.259479301 0.089895216 0.022471135 0.064092511 0.068012819 TG 54:2 0.878744342 1.173570943 1.072547186 0.953537291 0.995145368 0.476350371 0.750755243 0.630676186 0.815500637 0.899266498 1.398643189 0.721182281 0.836107743 1.270211178 1.092205476 0.766298538 0.772431891 1.124918332 1.757302535 0.790472446 2.163818194 1.591847867 1.886249858 0.882055701 3.70517032 0.676261423 0.420298879 0.948250703 0.875801836 0.462578669 0.955449762 1.318528899 1.901520382 1.07524457 0.735661146 1.330341866 0.747023623 0.589211587 0.429278593 0.428468765 TG 54:3 3.287349798 3.50209491 5.135641628 2.623045563 5.947348262 1.990046982 2.716841575 5.572398768 2.870742413 4.617932277 2.429532035 1.985896073 4.433647961 7.53921634 7.030826718 3.033128217 3.305692641 3.556072336 8.003868489 4.495062377 9.306017522 5.820000631 7.824619589 5.930220451 14.9419034 4.185148557 2.067992313 3.07227967 2.93586173 3.126771503 2.714547386 3.217960879 6.490142676 7.357576241 3.11079926 5.145428176 3.442880573 3.387824853 2.196429512 1.748661158 TG 54:4 2.668678448 3.093335272 4.7495942 1.918184345 8.258827842 2.497996303 2.840457527 7.251825607 1.90224952 3.979363191 1.641314311 1.646829286 3.643144891 6.027936392 6.286372049 3.685586253 3.417200334 3.246851519 7.617629935 4.820010774 9.248479922 6.743582208 7.836280481 7.185220421 13.04050653 5.403373114 2.788494789 3.278556558 2.183224393 3.934196334 2.328485885 2.539832304 5.32298848 9.510119661 3.770224478 6.005260494 4.054218018 3.922453557 2.979595612 1.94568242 TG 54:5 1.003005213 1.375992671 1.973131302 0.75622485 4.937374569 1.540868656 1.325738761 3.384042704 0.693122101 1.566022769 0.611876172 0.687581667 1.337692961 1.823731421 2.297110913 2.139467399 1.400811862 1.428079871 3.154226266 1.896297681 3.826526168 3.837595021 3.308959141 3.078693748 5.34469219 2.38848064 1.381130359 1.577256772 0.881459202 1.723525823 0.951725528 1.037911903 1.88768123 4.578648506 1.942366977 3.255222861 1.920096844 1.631531989 1.454220746 1.038784856 TG 54:5 1 0.623682554 0.571891136 0.722438106 0.71718849 1.324297571 0.403917026 0.690132625 0.535147992 0.607083043 0.607794672 0.600270513 0.348448344 0.861921709 0.853585349 0.879821607 0.442741681 0.405759403 0.397146226 1.038699904 0.53104834 1.200997837 0.875424025 1.09290708 0.643947973 1.643337578 0.323955154 0.263171334 0.370121652 0.606739567 0.487198917 0.445596801 0.497816931 0.871447175 0.706615375 0.442977416 0.564985206 0.317288257 0.309775582 0.27042601 0.185445888 TG 54:6 0.315875721 0.367415017 0.306506459 0.367383133 0.976655729 0.328888599 0.44230804 0.317793627 0.294838369 0.327624954 0.304084404 0.162081376 0.411699664 0.460586692 0.434291679 0.304626366 0.187876643 0.24263461 0.496971324 0.228169841 0.641737262 0.594424711 0.521764616 0.331103544 0.731207147 0.20967732 0.16439556 0.229881056 0.238284119 0.31783981 0.191089952 0.272777359 0.412658335 0.368572132 0.267230265 0.365167457 0.186537259 0.18607801 0.170352918 0.135185974 TG 56:4 0.053254659 0.062530531 0.084049365 0.062701678 0.143889672 0.043429476 0.070274823 0.112241667 0.062983339 0.095114726 0.069472769 0.047240467 0.091143157 0.125295618 0.123557252 0.072953218 0.026057943 0.069352401 0.141344524 0.078889602 0.197429338 0.141181889 0.177647663 0.140232959 0.245320702 0.104133241 0.066173539 0.07371976 0.052006249 0.068003945 0.051247566 0.07293662 0.162924556 0.220435694 0.081027901 0.122437686 0.094705453 0.071312182 0.05561858 0.035925643 TG 56:5 0.15110054 0.093282198 0.152641376 0.096563628 0.218031298 0.115939146 0.163156124 0.157391809 0.134517143 0.157412488 0.137091856 0.117435808 0.248277402 0.267989428 0.180637401 0.140240166 0.139539722 0.125532456 0.153279792 0.168060213 0.36936811 0.322254283 0.310742675 0.264941974 0.194072803 0.143905421 0.11608057 0.128265461 0.080604495 0.111767249 0.114612008 0.107865002 0.192909384 0.191276325 0.132743865 0.174070537 0.025737894 0.083221175 0.065975607 0.063574593 TG 56:7 0.188811973 0.194717761 0.277459513 0.179506382 0.653727761 0.18554843 0.234446968 0.34781451 0.157114802 0.237548517 0.155628673 0.139126501 0.31810749 0.358202273 0.308893131 0.290331914 0.160070223 0.1676181 0.266222797 0.230088962 0.505522049 0.516409478 0.432980995 0.394456019 0.333434216 0.221904578 0.149721093 0.167790328 0.134894451 0.264206715 0.162292702 0.178911709 0.246431254 0.321723127 0.187198099 0.275121425 0.161236659 0.170837335 0.144662111 0.096801314 TG 56:8 0.088842701 0.05116718 0.082439224 0.072061273 0.209610274 0.094415223 0.140803651 0.150896525 0.080465987 0.097021105 0.085349956 0.064074042 0.104910606 0.321544355 0.020508218 0.087312059 0.114271414 0.105576352 0.166099155 0.133173325 0.179475646 0.195680185 0.147972703 0.129218351 0.213092642 0.133424914 0.119195433 0.136571913 0.042715711 0.029609373 0.051929468 0.064886993 0.21157127 0.315674413 0.180227957 0.348487139 0.055911201 0.052314503 0.025018273 0.041023605 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Identifier Annotation InChIKey Species count ESI mode quantitated m/z rtimes qc_mean qc_sd qc_cv class ESI keep molwt Ceramide 34:1 d 5.78_572.48_5.76_596.53 Ceramide 34:1 d YDNKGFDKKRUKPY-TURZORIXSA-N [M+Cl]-_[M+Hac-H]- 40 (-) ES) 572.4815_596.5264 5.77 20985.4 1064.574469 19.71247725 Cer neg TRUE 537.512098 Ceramide 38:1 d 7.18_628.55 Ceramide 38:1 d XWBWIAOWSABHFI-NUKVNZTCSA-N [M+Cl]- 40 (-) ES) 628.5452 7.18 4417 217.0080644 20.35408229 Cer neg TRUE 593.575798 Ceramide 41:1 d 8.18_670.59 Ceramide 41:1 d NAJHAHQNQCNWOP-PUYNVXOJSA-N? [M+Cl]- 40 (-) ES) 670.5915 8.18 18551.4 1472.398316 12.59944392 Cer neg TRUE 635.622098 Ceramide 42:1 d 8.50_684.61_8.50_708.65 Ceramide 42:1 d ZJVVOYPTFQEGPH-AUTSUKAISA-N [M+Cl]- 40 (-) ES) 684.6068_708.6511 8.5 165194.6 14628.24956 11.29284808 Cer neg TRUE 649.637398 Ceramide 42:2 d 7.91_682.59 Ceramide 42:2 d VJSBNBBOSZJDKB-KPEYJIHVSA-N [M+Cl]- 38 (-) ES) 682.5932 7.91 1172.4 967.7837052 1.211427712 Cer neg TRUE 647.623798 GlcCer 40:1 d 7.18_818.63 GlcCer 40:1 d YIGARKIIFOHVPF-YAEABVQUSA-N [M+Cl]- 40 (-) ES) 818.6277 7.18 4717.2 360.5158804 13.08458311 Cer neg TRUE 783.658298 GlcCer 42:1 d 7.83_846.66 GlcCer 42:1 d POQRWMRXUOPCLD-AAAFHMTMSA-N [M+Cl]- 40 (-) ES) 846.6584 7.83 2958 2820.599493 1.048713228 Cer neg TRUE 811.688998 GlcCer 42:2 d 7.16_844.65 GlcCer 42:2 d WBOZIXHPUPAOIA-RBELZSLISA-N [M+Cl]- 40 (-) ES) 844.6453 7.16 4191.2 446.8889124 9.37861711 Cer neg TRUE 809.675898 PC 32:2 4.58_788.54 PC 32:2 GPWHCUUIQMGELX-VHQDNGOZSA-N [M+Hac-H]- 40 (-) ES) 788.5446 4.58 2769.6 276.6673092 10.01057916 PC neg TRUE 729.530749 PC 34:2 5.18_816.58 PC 34:2 JLPULHDHAOZNQI-ZTIMHPMXSA-N [M+Hac-H]- 40 (-) ES) 816.5771 5.18 139850.2 9551.882417 14.64111407 PC neg TRUE 757.563249 PC 34:3 4.82_814.56 PC 34:3 CNNSEHUKQJCGTE-UPPWDXJYSA-N [M+Hac-H]- 40 (-) ES) 814.561 4.82 3042 710.0580962 4.284156488 PC neg TRUE 755.547149 PC 35:2 5.51_830.59 PC 35:2 ZSKWZJYUVZYDQU-WESJWMGVSA-N [M+Hac-H]- 40 (-) ES) 830.5897 5.51 3962 189.9105052 20.86245832 PC neg TRUE 771.575849 PC 36:3 5.35_842.59 PC 36:3 YPAZQMWFRMHBBM-CLKMJQEKSA-N [M+Hac-H]- 40 (-) ES) 842.5922 5.35 29331.6 1624.921321 18.05108938 PC neg TRUE 783.578349 PC 36:5 4.70_838.56 PC 36:5 DYDDZDMJSQYFGN-OIVUZXIWSA-N [M+Hac-H]- 40 (-) ES) 838.5607 4.7 7166.6 244.4356766 29.31896072 PC neg TRUE 779.546849 PC 38:3 6.03_870.62 PC 38:3 OJHJKEBRZSDTTL-VHWCKNCUSA-N [M+Hac-H]- 40 (-) ES) 870.6243 6.03 16112 791.96433 20.34435061 PC neg TRUE 811.610449 PC 40:5 5.77_894.62 PC 40:5 LJFKFKIYUJNFPZ-ZLFSCUDPSA-N [M+Hac-H]- 40 (-) ES) 894.6224 5.77 1905.4 963.01703 1.978573525 PC neg TRUE 835.608549 PC 40:6 5.57_892.61 PC 40:6 FYVNIFOYDIIODX-KNKJIUSSSA-N [M+Hac-H]- 40 (-) ES) 892.6075 5.57 8686.8 568.8415421 15.27103658 PC neg TRUE 833.593649 PC 34:1 p 5.58_802.60 PC 34:1 p MBRHHFWRXQYYAN-RTVLTNFHSA-N [M+Hac-H]- 40 (-) ES) 802.5967 5.58 3406.8 143.0723593 23.81172727 PC neg TRUE 743.582849 PC 34:2 p 5.47_800.58 PC 34:2 p QLEHHUPUHJPURI-PWYDUFMYSA-N [M+Hac-H]- 40 (-) ES) 800.5807 5.47 6450.2 392.4483405 16.43579379 PC neg TRUE 741.566849 PC 36:3 p 5.47_826.60 PC 36:3 p SOUZQPFUXRVDGK-KCTKZSJBSA-N [M+Hac-H]- 40 (-) ES) 826.5972 5.47 8328.8 296.581692 28.0826505 PC neg TRUE 767.583349 PC 38:4 p 6.02_852.61 PC 38:4 p DBQMOXDLWKVKKG-REWQMPQJSA-N [M+Hac-H]- 40 (-) ES) 852.6133 6.02 1793.8 199.1624965 9.006715781 PC neg TRUE 793.599449 PE 36:2 5.97_742.54 PE 36:2 MWRBNPKJOOWZPW-CLFAGFIQSA-N [M-H]- 40 (-) ES) 742.5388 5.97 3449.2 357.979329 9.635193209 PE neg TRUE 743.546076 PE 36:4 5.20_738.51 PE 36:4 DUQDVNACTOXOJA-KTKXOIIHSA-N [M-H]- 40 (-) ES) 738.5084 5.2 5900.6 469.4590504 12.56893438 PE neg TRUE 739.515676 PE 38:6 5.07_762.51 PE 38:6 VRBJSZDBPQLNEM-PFTGJCAASA-N [M-H]- 38 (-) ES) 762.5079 5.07 3845 295.3176256 13.01987984 PE neg TRUE 763.515176 PE 34:2 p 5.63_698.51 PE 34:2 p LALFTIIBOJSVNP-OBEJFMRTSA-N [M-H]- 40 (-) ES) 698.5119 5.63 2925.2 154.5176365 18.9311723 PE neg TRUE 699.519176 PE 36:2 p 6.30_726.54 PE 36:2 p XVXISDREVDGQPX-PISDLAQISA-N [M-H]- 40 (-) ES) 726.5415 6.3 3731.4 207.7144675 17.96408332 PE neg TRUE 727.548776 PE 36:4 p 5.50_722.51 PE 36:4 p UUYSKERSKRMYME-MAIXUNBTSA-N [M-H]- 40 (-) ES) 722.5129 5.5 9129.4 821.9956204 11.10638521 PE neg TRUE 723.520176 PE 38:4 p 6.19_750.54 PE 38:4 p URPXXNCTXCOATD-FXMFQVEGSA-N [M-H]- 40 (-) ES) 750.5449 6.19 9397.8 1279.047575 7.34749839 PE neg TRUE 751.552176 PE 38:5 p 5.56_748.53 PE 38:5 p KCNBSSYOJRUKOM-JALPNNRCSA-N [M-H]- 40 (-) ES) 748.5288 5.56 8159 1366.34915 5.971387328 PE neg TRUE 749.536076 PE 38:6 p 5.32_746.51 PE 38:6 p WVGALBKSWOUIEZ-XNHMFJFDSA-N [M-H]- 40 (-) ES) 746.5126 5.32 5213.6 240.6788316 21.66206294 PE neg TRUE 747.519876 PE 40:6 p 5.97_774.54 PE 40:6 p FIJFPUAJUDAZEY-MNDXXDKYSA-N [M-H]- 40 (-) ES) 774.5441 5.97 2529 262.1936307 9.64554323 PE neg TRUE 775.551376 SM 33:1 d 4.57_747.57 SM 33:1 d LQINJRUGTUOHGS-YPDYIYJKSA-N [M+Hac-H]- 40 (-) ES) 747.5669 4.57 4975.4 2219.55081 2.241624736 SM neg TRUE 688.553049 SM 40:2 d 6.25_843.66 SM 40:2 d FOULCGVQZYQEQM-DNXGLLHMSA-N [M+Hac-H]- 40 (-) ES) 843.66 6.25 3950.2 1711.742446 2.307706986 SM neg TRUE 784.646149 SM 42:2 d 7.03_871.69 SM 42:2 d DACOGJMBYLZYDH-GXJPFUDISA-N [M+Hac-H]- 40 (-) ES) 871.6913 7.03 11073.2 5531.443907 2.001864285 SM neg TRUE 812.677449 CE 16:1 10.49_645.56 CE 16:1 HODJWNWCVNUPAQ-FSAOOAOSSA-N [M+Na]+ 40 -1 645.5585 10.49 7012.2 282.9217206 24.78494753 CE pos TRUE 622.569282 CE 18:1 11.06_668.63_11.06_673.59 CE 18:1 RJECHNNFRHZQKU-RMUVNZEASA-N [M+NH4]+_[M+Na]+ 40 -1 668.6350_673.5904 11.06 47728.4 2267.139012 21.05226003 CE pos TRUE 650.601177 CE 18:2 10.58_666.62_10.56_671.58 CE 18:2 NAACPBBQTFFYQB-LJAITQKLSA-N [M+NH4]+_[M+Na]+ 40 -1 666.6194_671.5755 10.57 432313.8 28157.32109 15.35351317 CE pos TRUE 648.585577 CE 18:3 10.17_669.56 CE 18:3 FYMCIBHUFSIWCE-WVXFKAQASA-N [M+Na]+ 40 -1 669.5585 10.17 9479.6 366.1055859 25.89307666 CE pos TRUE 646.569282 CE 20:3 10.68_697.59 CE 20:3 MLPRJPSMAFZPLA-PJSAOELNSA-N [M+Na]+ 40 -1 697.5896 10.68 2067.2 196.4769707 10.52133486 CE pos TRUE 674.600382 CE 20:4 10.35_695.57_10.34_690.62 CE 20:4 IMXSFYNMSOULQS-BEDFLICRSA-N [M+NH4]+_[M+Na]+ 40 -1 695.5744_690.6185 10.345 100722.8 2489.90797 40.45241881 CE pos TRUE 672.584677 CE 20:5 9.92_693.56 CE 20:5 XZFUGMCJZFRBKF-JIKDAPOUSA-N [M+Na]+ 40 -1 693.5567 9.92 5927.4 265.3644663 22.33682633 CE pos TRUE 670.567482 CE 22:6 10.09_719.57 CE 22:6 VOEVEGPMRIYYKC-HNJOWPRISA-N [M+Na]+ 40 -1 719.5735 10.09 12641.8 812.2094557 15.56470429 CE pos TRUE 696.584282 Ceramide 40:1 d 7.83_644.59 Ceramide 40:1 d KEPQASGDXIEOIL-GLQCRSEXSA-N [M+Na]+ 40 -1 644.5948 7.83 5312.6 252.9590876 21.00181516 Cer pos TRUE 621.605582 Cholesterol 4.96_369.35 Cholesterol HVYWMOMLDIMFJA-DPAQBDIFSA-N [M-H2O+H]+ 40 -1 369.3521 4.96 66796 1300.183641 51.37428122 Cholesterol pos TRUE 386.35594 DG 36:2 7.10_643.53 DG 36:2 AFSHUZFNMVJNKX-LLWMBOQKSA-N [M+Na]+ 40 -1 643.5276 7.1 8534.6 999.6250797 8.537800995 DG pos TRUE 620.538382 DG 36:3 6.57_641.51 DG 36:3 BLZVZPYMHLXLHG-JOBMVARSSA-N [M+Na]+ 40 -1 641.5121 6.57 15427.8 2071.672561 7.447026277 DG pos TRUE 618.522882 Gal-Gal-Cer 34:1 d 4.92_862.62_4.92_884.61 Gal-Gal-Cer 34:1 d HLIJNIKSBCIDGO-QKLMXXKVSA-N or HLIJNIKSBCIDGO-NLXPYQMASA-N [M+H]+_[M+Na]+ 40 -1 862.6243_884.6073 4.92 29710.6 2982.34376 9.962164792 Cer pos TRUE 861.617024 GlcCer 40:1 d 1 7.15_806.65 GlcCer 40:1 d 1 QMYGQSYNQBLKGY-YAEABVQUSA-N [M+Na]+ 40 -1 806.6462 7.15 2871.4 131.2566189 21.87623012 Cer pos TRUE 783.656982 GlcCer 42:1 d 1 7.81_834.68 GlcCer 42:1 d 1 SNVYJLGKALMFOP-MOLROICHSA-N [M+Na]+ 40 -1 834.679 7.81 3895 228.0690685 17.07815981 Cer pos TRUE 811.689782 LPC 16:0 1.52_496.34 LPC 16:0 ASWBNKHCZGQVJV-HSZRJFAPSA-N [M+H]+ 40 -1 496.3398 1.52 1485296.8 211318.8194 7.028701011 LPC pos TRUE 495.332524 LPC 18:0 2.31_524.37 LPC 18:0 IHNKQIMGVNPMTC-RUZDIDTESA-N [M+H]+ 40 -1 524.3714 2.31 427646.4 52969.58677 8.073432815 LPC pos TRUE 523.364124 LPC 18:1 1.67_522.36 LPC 18:1 YAMUFBLWGFFICM-PTGWMXDISA-N [M+H]+ 40 -1 522.3558 1.67 148846.6 21218.32878 7.015001112 LPC pos TRUE 521.348524 LPC 18:2 1.26_520.34 LPC 18:2 SPJFYYJXNPEZDW-FTJOPAKQSA-N [M+H]+ 40 -1 520.3398 1.26 307005.6 71919.41267 4.268744538 LPC pos TRUE 519.332524 LPC 20:4 1.23_544.34 LPC 20:4 GOMVPVRDBLLHQC-VEJNOCSESA-N [M+H]+ 40 -1 544.3391 1.23 68888.6 18363.91856 3.75130176 LPC pos TRUE 543.331824 PC 30:0 4.94_706.54_4.93_728.52 PC 30:0 RFVFQQWKPSOBED-PSXMRANNSA-N [M+H]+_[M+Na]+ 40 -1 706.5395_728.5220 4.935 58139.8 7182.615241 8.094516837 PC pos TRUE 705.532224 PC 32:0 5.56_734.57 PC 32:0 KILNVBDSWZSGLL-KXQOOQHDSA-N [M+H]+ 40 -1 734.5696 5.56 71825.8 8599.004198 8.352804388 PC pos TRUE 733.562324 PC 32:1 4.98_732.55_4.98_754.54 PC 32:1 QIBZFHLFHCIUOT-NPBIGWJUSA-N [M+H]+_[M+Na]+ 40 -1 732.5548_754.5376 4.98 213523 24865.44604 8.587137332 PC pos TRUE 731.547524 PC 33:0 5.77_748.58 PC 33:0 FHENRYRLCPXONH-LDLOPFEMSA-N [M+H]+ 40 -1 748.5839 5.77 3245.4 299.5518319 10.83418512 PC pos TRUE 747.576624 PC 33:1 5.31_746.57 PC 33:1 OFRWLQSOUIZELQ-VEAYGOGPSA-N? [M+H]+ 40 -1 746.5695 5.31 10345 1158.290551 8.931265124 PC pos TRUE 745.562224 PC 33:2 4.84_744.55 PC 33:2 SBNDHGBVMZMSNL-UESLNCBNSA-N [M+H]+ 40 -1 744.5533 4.84 16302.4 1964.627267 8.297960774 PC pos TRUE 743.546024 PC 34:0 6.23_762.60 PC 34:0 PZNPLUBHRSSFHT-RRHRGVEJSA-N [M+H]+ 40 -1 762.6025 6.23 12430 1231.502944 10.09335793 PC pos TRUE 761.595224 PC 34:1 5.65_760.59_5.66_782.57 PC 34:1 WTJKGGKOPKCXLL-VYOBOKEXSA-N [M+H]+_[M+Na]+ 40 -1 760.5871_782.5680 5.655 1581248.4 167239.5419 9.454991218 PC pos TRUE 759.579824 PC 34:3 1 4.63_756.55 PC 34:3 1 VKVSSDKCKXJFIM-AFYHZPHLSA-N [M+H]+ 40 -1 756.5538 4.63 19711.8 2079.009428 9.481342287 PC pos TRUE 755.546524 PC 34:4 4.45_754.54 PC 34:4 YWDDIWXKFJEMKF-JTZVLWBESA-N [M+H]+ 40 -1 754.5375 4.45 4087.2 457.1271158 8.941057878 PC pos TRUE 753.530224 PC 35:1 5.96_774.60 PC 35:1 MFHIZGSSDZJFKD-IYEJTHTFSA-N [M+H]+ 40 -1 774.6006 5.96 9908.4 1246.548555 7.948667511 PC pos TRUE 773.593324 PC 35:2 1 5.46_772.59 PC 35:2 1 MJWAVUYQCBFFHQ-WESJWMGVSA-N [M+H]+ 40 -1 772.585 5.46 33103.6 3594.976884 9.208292866 PC pos TRUE 771.577724 PC 35:3 4.95_770.57 PC 35:3 AYXGHIQPMDYMJC-AHMBLZLYSA-N [M+H]+ 40 -1 770.5684 4.95 13820.4 1444.64712 9.566626904 PC pos TRUE 769.561124 PC 35:4 4.75_768.55 PC 35:4 OROZWUJCDDCYAU-IPUAOQJZSA-N [M+H]+ 40 -1 768.5546 4.75 3736.8 1148.975283 3.252289285 PC pos TRUE 767.547324 PC 36:1 6.30_788.62_6.29_810.60 PC 36:1 ATHVAWFAEPLPPQ-VRDBWYNSSA-N [M+H]+_[M+Na]+ 40 -1 788.6171_810.5985 6.295 181198.6 22508.46594 8.050242096 PC pos TRUE 787.609824 PC 36:2 5.78_786.60_5.77_808.58 PC 36:2 SNKAWJBJQDLSFF-NVKMUCNASA-N [M+H]+_[M+Na]+ 40 -1 786.6031_808.5841 5.775 2508804 239638.8332 10.46910456 PC pos TRUE 785.595824 PC 36:3 1 5.19_784.59_5.19_806.57 PC 36:3 1 BXRLDROZWDUSGM-ZRYFCQOPSA-N [M+H]+_[M+Na]+ 40 -1 784.5865_806.5673 5.19 536978.8 62117.60917 8.644550348 PC pos TRUE 783.579224 PC 36:3 2 5.30_784.59_5.30_806.57 PC 36:3 2 WZCLAXMADUBPSG-RIXBAXMTSA- [M+H]+_[M+Na]+ 40 -1 784.5861_806.5668 5.3 584333.6 77708.82328 7.519527067 PC pos TRUE 783.578824 PC 36:4 4.75_782.57 PC 36:4 NKQPOVROGSWLTO-NVPMBMBWSA-N [M+H]+ 40 -1 782.5699 4.75 128745.6 13990.06942 9.202641971 PC pos TRUE 781.562624 PC 36:4 1 5.05_782.57_5.05_804.55 PC 36:4 1 IIZPXYDJLKNOIY-JXPKJXOSSA-N [M+H]+_[M+Na]+ 40 -1 782.5715_804.5524 5.05 1904255.8 201287.906 9.460358738 PC pos TRUE 781.564224 PC 36:5 1 4.36_780.55 PC 36:5 1 SUZYROYNFNQALJ-MHEIZRSESA-N [M+H]+ 40 -1 780.5544 4.36 1803.6 1521.925195 1.185077956 PC pos TRUE 779.547124 PC 37:2 6.12_800.62 PC 37:2 MCZUABDVGPPWPM-HJTCUGKVSA-N [M+H]+ 40 -1 800.6177 6.12 3754.8 260.253146 14.4274913 PC pos TRUE 799.610424 PC 37:3 5.52_798.60 PC 37:3 OOYQEEUUQRMQKL-JUUDQZDJSA-N [M+H]+ 40 -1 798.6 5.52 2567.6 1269.576032 2.022407431 PC pos TRUE 797.592724 PC 37:4 5.36_796.58 PC 37:4 QRPUCJXFPYFTMB-FBFLODOBSA-N [M+H]+ 40 -1 796.5848 5.36 13215.4 1579.522966 8.366703293 PC pos TRUE 795.577524 PC 38:2 6.39_814.63 PC 38:2 KXXLFCAPKGRXBT-FMJYHZMHSA-N [M+H]+ 40 -1 814.6326 6.39 12494 1256.80806 9.941056551 PC pos TRUE 813.625324 PC 38:3 1 5.97_812.62_5.97_834.60 PC 38:3 1 KNNHXKQRTYEWCA-HYYWERRFSA-N [M+H]+_[M+Na]+ 40 -1 812.6166_834.5980 5.97 178175.2 19946.58201 8.932618127 PC pos TRUE 811.609324 PC 38:4 5.69_810.60_5.70_832.58 PC 38:4 PSVRFUPOQYJOOZ-QNPWAGBNSA-N [M+H]+_[M+Na]+ 40 -1 810.6025_832.5836 5.695 1219521 126286.211 9.656802512 PC pos TRUE 809.595224 PC 38:5 5.11_808.59_5.10_830.57 PC 38:5 SUACBSWYGWBPFC-GPUJSUHJSA-N [M+H]+_[M+Na]+ 40 -1 808.5862_830.5671 5.105 285662.4 30629.61897 9.326345204 PC pos TRUE 807.578924 PC 38:5 1 5.28_808.58 PC 38:5 1 YLWBKBDNHWQEFU-YJXJLLHLSA-N [M+H]+ 40 -1 808.584 5.28 63285 33123.37439 1.910584328 PC pos TRUE 807.576724 PC 38:6 4.92_806.57_4.92_828.55 PC 38:6 PLZBTDKJYHXIEW-DZUXOTHRSA-N [M+H]+_[M+Na]+ 40 -1 806.5710_828.5516 4.92 776922.8 89760.90529 8.655469745 PC pos TRUE 805.563724 PC 39:6 5.17_820.58 PC 39:6 QMCWOGICYCFNBF-BWHZRABLSA-N [M+H]+ 40 -1 820.5797 5.17 4795.2 566.1167724 8.470337276 PC pos TRUE 819.572424 PC 40:4 6.16_838.63 PC 40:4 FHUAYOMRHXZKHT-JUGJLYODSA-N [M+H]+ 40 -1 838.6321 6.16 12991 1324.938678 9.804982085 PC pos TRUE 837.624824 PC 40:5 1 5.71_836.62_5.72_858.60 PC 40:5 1 IJTJDJOOHZVSAC-NDRUHXFFSA-N [M+H]+_[M+Na]+ 40 -1 836.6161_858.5972 5.715 68683.4 8633.006475 7.955907388 PC pos TRUE 835.608824 PC 40:5 2 5.95_836.62 PC 40:5 2 SFESOYFQZQJCOY-FXYWPAEZSA-N [M+H]+ 40 -1 836.6151 5.95 15247 2061.168358 7.39726085 PC pos TRUE 835.607824 PC 40:6 1 5.52_834.60_5.51_856.58 PC 40:6 1 TYRTWVKQVGNGSZ-RGBTVBCDSA-N [M+H]+_[M+Na]+ 40 -1 834.6005_856.5829 5.515 119789 16440.81408 7.286074731 PC pos TRUE 833.593224 PC 40:7 4.95_832.59_4.95_854.57 PC 40:7 BPUROMFCPFGBOT-ZEGPSQTJSA-N [M+H]+_[M+Na]+ 40 -1 832.5850_854.5671 4.95 78662.6 9379.607444 8.386555671 PC pos TRUE 831.577724 PC 40:8 4.52_830.57 PC 40:8 SIMZOWLEIOYZJX-VRCXRDLJSA-N [M+H]+ 40 -1 830.5696 4.52 3547.2 227.6866267 15.57930762 PC pos TRUE 829.562324 PC 32:0 o 5.96_720.59 PC 32:0 o SVWBXNAUENUONE-LDLOPFEMSA-N [M+H]+ 40 -1 720.5894 5.96 10588 1191.145877 8.888919658 PC pos TRUE 719.582124 PC 32:0 p 5.87_718.57 PC 32:0 p KEVGQWGZKKFGDC-MCBGMKGZSA-N [M+H]+ 40 -1 718.5731 5.87 10543 1164.419169 9.05429959 PC pos TRUE 717.565824 PC 34:0 p 6.02_746.61 PC 34:0 p QCGUXAIDEOWPBV-SNKLRXETSA-N [M+H]+ 40 -1 746.605 6.02 18300.2 2103.754311 8.698829472 PC pos TRUE 745.597724 PC 34:1 p 1 5.52_744.59 PC 34:1 p 1 MBRHHFWRXQYYAN-JEPFLRBFSA-N [M+H]+ 40 -1 744.5897 5.52 36394.4 4660.154214 7.809698634 PC pos TRUE 743.582424 PC 34:1 p 2 5.95_744.58 PC 34:1 p 2 KMNVIRCHUMQGHD-RCINKDPXSA-N [M+H]+ 40 -1 744.5835 5.95 14120.2 1595.088305 8.852299874 PC pos TRUE 743.576224 PC 34:2 p 1 5.43_742.57 PC 34:2 p 1 QEWRXEALGMKRGP-MZWPLUPDSA-N [M+H]+ 40 -1 742.5743 5.43 51620.4 5190.699789 9.944786271 PC pos TRUE 741.567024 PC 36:1 p 6.08_772.62 PC 36:1 p ZYLPVUZBZNMVMR-ZBBHDILGSA-N [M+H]+ 40 -1 772.6189 6.08 4302.4 1770.242159 2.430401953 PC pos TRUE 771.611624 PC 36:2 p 5.59_770.60 PC 36:2 p DIHWZUCEXWUHOD-IIVNATNGSA-N [M+H]+ 40 -1 770.6046 5.59 17110.8 2252.030795 7.597942284 PC pos TRUE 769.597324 PC 36:3 p 1 5.42_768.59_5.42_790.57 PC 36:3 p 1 PYVYDRMXPDZRIS-FINMKEMFSA-N [M+H]+_[M+Na]+ 40 -1 768.5900_790.5717 5.42 82071.2 9363.379075 8.76512628 PC pos TRUE 767.582724 PC 36:4 p 5.31_766.57_5.31_788.56 PC 36:4 p RWVKPDIHPPTVRQ-HWGQMOSASA-N [M+H]+_[M+Na]+ 40 -1 766.5746_788.5605 5.31 110872.8 15159.76694 7.313621669 PC pos TRUE 765.567324 PC 38:2 p 6.37_798.64 PC 38:2 p VXNFJZDUQIFCMO-WCXGAVHKSA-N [M+H]+ 40 -1 798.6372 6.37 2590.4 189.1383092 13.69579759 PC pos TRUE 797.629924 PC 38:3 p 6.08_796.62 PC 38:3 p GWBOVQHRCURSPU-QMFAPAEZSA-N [M+H]+ 40 -1 796.6212 6.08 28377.2 2774.606585 10.22746798 PC pos TRUE 795.613924 PC 38:4 p 1 5.47_794.60 PC 38:4 p 1 YPAPIRJFGNBODV-AMFPDOHCSA-N [M+H]+ 40 -1 794.6043 5.47 63119.6 7708.366513 8.188453402 PC pos TRUE 793.597024 PC 38:4 p 2 5.98_794.61 PC 38:4 p 2 DYFGXBAIDOATAE-DSLLYOFSSA-N [M+H]+ 40 -1 794.6094 5.98 14314.8 1629.978129 8.782203729 PC pos TRUE 793.602124 PC 38:5 p 5.36_792.59 PC 38:5 p FAKYQMLQEAQOLK-LHZZQLRFSA-N [M+H]+ 40 -1 792.5896 5.36 16405.6 1550.027193 10.58407238 PC pos TRUE 791.582324 PC 40:3 p 6.75_824.65 PC 40:3 p RDNHPNJCALITSY-MBZSPAKGSA-N [M+H]+ 40 -1 824.6528 6.75 3714.4 411.7430024 9.021161206 PC pos TRUE 823.645524 PC 40:4 p 6.09_822.64 PC 40:4 p UWNFEVACEPZILS-RNNLSGHUSA-N [M+H]+ 40 -1 822.6356 6.09 5591.6 683.1605229 8.184899175 PC pos TRUE 821.628324 PC 40:5 p 5.88_820.62 PC 40:5 p KUHMJRMPHBRAMY-DDURNVNNSA-N [M+H]+ 40 -1 820.6213 5.88 3650.2 361.1795952 10.10632951 PC pos TRUE 819.614024 PC 40:6 p 5.75_818.61 PC 40:6 p FMBYBTSZVHUJMV-DIVFMYBRSA-N [M+H]+ 40 -1 818.6052 5.75 5180.8 453.5732576 11.42219016 PC pos TRUE 817.597924 PC 42:4 p 6.73_850.67 PC 42:4 p NLEDXBSUDVLSEN-UFFJXODHSA-N [M+H]+ 40 -1 850.6682 6.73 4089.6 337.3652324 12.12217386 PC pos TRUE 849.660924 PC 42:5 p 6.17_848.65 PC 42:5 p QZMFOSCFDWPISC-KQHSIIGPSA-N [M+H]+ 40 -1 848.6524 6.17 2681 263.2375353 10.18471776 PC pos TRUE 847.645124 PC 44:4 p 7.37_878.70 PC 44:4 p CEZAZXUWDFPTTE-FHIJIHMSSA-N [M+H]+ 40 -1 878.7 7.37 5039.2 376.5596898 13.38220775 PC pos TRUE 877.692724 PC 38:4 1 5.50_810.60 PC 38:4 1 TWXNOZDNXVHOLP-HBZIWDQGNA-N [M+H]+ 40 830.8179 810.6006 5.5 41414 5158.064026 8.028981375 PC pos TRUE 809.593324 PE 38:4 5.88_768.56 PE 38:4 ANRKEHNWXKCXDB-BHFWLYLHSA-N [M+H]+ 40 -1 768.5573 5.88 5600.6 2149.437205 2.60561229 PE pos TRUE 767.550024 PE 38:6 1 5.03_764.52 PE 38:6 1 LFGBKOUQHCWBQI-BZGLIJSBSA-N [M+H]+ 40 -1 764.525 5.03 5471.2 1060.383516 5.159642639 PE pos TRUE 763.517724 PE 36:2 p 1 6.30_728.56 PE 36:2 p 1 CFANDHZPOSNKNO-UDHSZFGOSA-N [M+H]+ 40 -1 728.5585 6.3 2846.2 496.9348046 5.727511886 PE pos TRUE 727.551224 PE 36:4 p 1 5.51_724.53 PE 36:4 p 1 ADWDFBQPQIEGRZ-XBICFDGKSA-N [M+H]+ 40 -1 724.5268 5.51 7652.2 1872.596913 4.086410666 PE pos TRUE 723.519524 PE 38:5 p 1 5.56_750.54 PE 38:5 p 1 IQSPCSIULMCRPM-ZAJUHDLGSA-N [M+H]+ 40 -1 750.5441 5.56 6265.4 1454.414762 4.307849565 PE pos TRUE 749.536824 PC 36:2 p 1 6.08_770.61 PC 36:2 p 1 XEBSIEVNFRMOOU-XGDVQHKZNA-N [M+H]+ 40 952.4993 770.6052 6.08 8642.4 954.5848836 9.053568885 PC pos TRUE 769.597924 PC 38:6 p 5.13_790.57 PC 38:6 p QICWUUGBNFIZAZ-VEOGPPBONA-N [M+H]+ 40 771.907 790.5734 5.13 11694.6 933.3082556 12.53026525 PC pos TRUE 789.566124 SM 32:1 d 4.23_675.54 SM 32:1 d KYICBZWZQPCUMO-PSALXKTOSA-N [M+H]+ 40 -1 675.5433 4.23 24723.2 2239.178354 11.04119284 SM pos TRUE 674.536024 SM 32:2 d 3.77_673.53 SM 32:2 d PEJGMBUENJSLLH-RHAKMSQVSA-N? [M+H]+ 38 -1 673.5272 3.77 3125 642.4947471 4.863852995 SM pos TRUE 672.519924 SM 34:0 d 5.09_705.59 SM 34:0 d QHZIGNLCLJPLCU-QPPIDDCLSA-N [M+H]+ 40 -1 705.5901 5.09 24304.2 3220.062996 7.547740534 SM pos TRUE 704.582824 SM 34:1 d 4.85_703.58_4.86_725.56 SM 34:1 d RWKUXQNLWDTSLO-GWQJGLRPSA-N [M+H]+_[M+Na]+ 40 -1 703.5754_725.5565 4.855 786587.4 81582.63265 9.641603543 SM pos TRUE 702.568124 SM 34:2 d 4.33_701.56 SM 34:2 d YLWSJLLZUHSIEA-CKSUKHGVSA-N [M+H]+ 40 -1 701.559 4.33 66825.8 7511.684878 8.89624646 SM pos TRUE 700.551724 SM 36:0 d 5.74_733.62 SM 36:0 d JCELSEVNSMXGKA-IOLBBIBUSA-N [M+H]+ 40 -1 733.6193 5.74 5652.6 583.7913155 9.682569525 SM pos TRUE 732.612024 SM 36:1 d 5.51_731.61 SM 36:1 d LKQLRGMMMAHREN-YJFXYUILSA-N [M+H]+ 40 -1 731.6057 5.51 73112.6 8827.586862 8.282286104 SM pos TRUE 730.598424 SM 36:2 d 4.96_729.59_4.95_751.57 SM 36:2 d NBEADXWAAWCCDG-QDDWGVBQSA-N [M+H]+_[M+Na]+ 40 -1 729.5909_751.5722 4.955 366876.2 38682.08923 9.484394646 SM pos TRUE 728.583624 SM 38:1 d 6.20_759.64 SM 38:1 d AADLTHQNYQJHQV-SVLGDMRNSA-N [M+H]+ 40 -1 759.637 6.2 36240.2 3936.091361 9.207154174 SM pos TRUE 758.629724 SM 38:2 d 5.63_757.62 SM 38:2 d MDRFMTLYKHBJTF-NQYLGBTJSA-N [M+H]+ 40 -1 757.6191 5.63 25899 3538.976194 7.318218203 SM pos TRUE 756.611824 SM 39:1 d 6.56_773.65 SM 39:1 d YXSZOBWVQJIWNE-LUJNSPTCSA-N [M+H]+ 40 -1 773.6516 6.56 10069.2 906.2878682 11.11037713 SM pos TRUE 772.644324 SM 40:1 d 6.89_787.67 SM 40:1 d FJJANLYCZUNFSE-QVMKKYBKSA-N [M+H]+ 40 -1 787.6686 6.89 88648.8 9528.204485 9.303830553 SM pos TRUE 786.661324 SM 40:2 d 1 6.30_785.65 SM 40:2 d 1 VBFKEZGCUWHGSK-ADSSWVSQSA-N [M+H]+ 40 -1 785.6534 6.3 48964 5736.25335 8.535885187 SM pos TRUE 784.646124 SM 41:1 d 7.22_801.68 SM 41:1 d SXZWBNWTCVLZJN-NMIJJABPSA-N [M+H]+ 40 -1 801.6837 7.22 27367 2205.069727 12.41094541 SM pos TRUE 800.676424 SM 41:2 d 6.65_799.67 SM 41:2 d JBDGKEXQKCCQFK-JWQIMADESA-N [M+H]+ 40 -1 799.6681 6.65 14564.6 1146.756426 12.70069186 SM pos TRUE 798.660824 SM 42:1 d 7.55_815.70 SM 42:1 d QEDPUVGSSDPBMD-XTAIVQBESA-N [M+H]+ 40 -1 815.6996 7.55 48477.6 4318.543539 11.22545126 SM pos TRUE 814.692324 SM 42:3 d 6.29_811.67 SM 42:3 d TXFLWJQVQCDUDZ-BRUGZULGSA-N [M+H]+ 40 -1 811.6673 6.29 83026.8 9800.218707 8.471933381 SM pos TRUE 810.660024 SM 43:2 d 7.07_827.70 SM 43:2 d PBROMOQAZGFDHQ-GPQOMLTASA-N? [M+H]+ 40 -1 827.6989 7.07 2386.2 205.653106 11.60303409 SM pos TRUE 826.691624 TG 46:0 10.56_796.74 TG 46:0 JWVXCFSNEOMSHH-UHFFFAOYSA-N [M+NH4]+ 40 -1 796.7394 10.56 26533 2874.721117 9.229764878 TG pos TRUE 778.705577 TG 46:1 10.13_799.68 TG 46:1 RSDIQTNCDWUNDP-VHXPQNKSSA-N [M+Na]+ 40 -1 799.6779 10.13 14760.4 891.7762051 16.5516863 TG pos TRUE 776.688682 TG 48:1 10.55_827.71_10.59_822.76 TG 48:1 FEKLSEFRUGWUOS-DLOIZKPKSA-N [M+NH4]+_[M+Na]+ 40 -1 827.7108_822.7551 10.57 211747.6 18341.90542 11.54447126 TG pos TRUE 804.721277 TG 48:2 10.16_820.74_10.16_825.69 TG 48:2 RUOVJPPUXXFZPC-YZEIBMOJSA-N [M+NH4]+_[M+Na]+ 40 -1 820.7385_825.6940 10.16 93147.2 8334.221541 11.17647276 TG pos TRUE 802.704677 TG 48:3 9.73_823.68 TG 48:3 SKGWNZXOCSYJQL-BUTYCLJRSA-N [M+Na]+ 40 -1 823.6779 9.73 19543.2 1187.256796 16.4608028 TG pos TRUE 800.688682 TG 49:2 10.39_839.71 TG 49:2 QZYSUBAQYSVFNX-PSMULLBHSA-N [M+Na]+ 40 -1 839.709 10.39 6527.8 418.1850069 15.60983749 TG pos TRUE 816.719782 TG 50:1 11.00_850.79_10.98_855.74 TG 50:1 YHMDGPZOSGBQRH-YYSBDVFPSA-N [M+NH4]+_[M+Na]+ 40 -1 850.7880_855.7435 10.99 634437.2 26759.16114 23.70915877 TG pos TRUE 832.754177 TG 50:2 10.61_848.77_10.60_853.73 TG 50:2 QEZWFCZNHWUARW-XQCAQTCHSA-N [M+NH4]+_[M+Na]+ 40 -1 848.7711_853.7260 10.605 726102.2 54786.90295 13.25320763 TG pos TRUE 830.737277 TG 50:3 10.21_846.75_10.20_851.71 TG 50:3 UFHNZOACKFBCOM-YXKNDSBASA-N [M+NH4]+_[M+Na]+ 40 -1 846.7535_851.7098 10.205 248253.8 25658.40851 9.67533898 TG pos TRUE 828.719677 TG 50:4 9.81_849.69 TG 50:4 PVMBAGXWHHZKFP-JMPJWMFJSA-N [M+Na]+ 40 -1 849.6936 9.81 30358.8 1950.354122 15.56578862 TG pos TRUE 826.704382 TG 51:2 10.81_862.78_10.81_867.74 TG 51:2 NSNSZGBCOIKUBU-SZOKBDNISA-N [M+NH4]+_[M+Na]+ 40 -1 862.7842_867.7407 10.81 48486 3857.251094 12.57009171 TG pos TRUE 844.750377 TG 51:3 10.41_860.77_10.42_865.72 TG 51:3 ISSGPXMQOMAFMJ-DMGKHJLRSA-N [M+NH4]+_[M+Na]+ 40 -1 860.7700_865.7248 10.415 34138.6 2879.190737 11.85701231 TG pos TRUE 842.736177 TG 52:1 11.38_878.82_11.38_883.77 TG 52:1 NPCZZYKITFKRQZ-RFBIWTDZSA-N [M+NH4]+_[M+Na]+ 40 -1 878.8160_883.7726 11.38 276280.8 24582.8041 11.23878297 TG pos TRUE 860.782177 TG 52:2 10.98_881.76_11.01_876.80 TG 52:2 TXMWKTABZBAJCW-QLHBUVOUSA-N [M+NH4]+_[M+Na]+ 40 -1 881.7599_876.8042 10.995 1725119.8 103459.1245 16.67440942 TG pos TRUE 858.770377 TG 52:3 10.66_879.74_10.63_874.79 TG 52:3 DQXQIWIQYYEGLG-MMWLGPPDSA-N [M+NH4]+_[M+Na]+ 40 -1 879.7423_874.7878 10.645 2158623.2 135877.7628 15.88650825 TG pos TRUE 856.753977 TG 52:4 10.28_872.77_10.27_877.73 TG 52:4 WHSWXEYWNPTUPW-HNJDVRDNSA-N [M+NH4]+_[M+Na]+ 40 -1 872.7706_877.7262 10.275 980133.8 91468.26587 10.71556119 TG pos TRUE 854.736777 TG 52:5 9.89_870.75_9.89_875.71 TG 52:5 CQZAAIKPSLHIBC-KDJOUNIJSA-N [M+NH4]+_[M+Na]+ 40 -1 870.7536_875.7089 9.89 81318.8 6387.105816 12.73171329 TG pos TRUE 852.719777 TG 52:6 9.47_873.69 TG 52:6 SSOSFUDNINFYLJ-KIYGNKBKSA-N [M+Na]+ 40 -1 873.6927 9.47 5970.4 396.384031 15.06216077 TG pos TRUE 850.703482 TG 53:2 11.18_890.81_11.18_895.77 TG 53:2 RSINITWKVQRWSZ-RFVLVDBCSA-N [M+NH4]+_[M+Na]+ 40 -1 890.8089_895.7725 11.18 36529.6 3045.509202 11.99457876 TG pos TRUE 872.775077 TG 53:3 10.83_888.80_10.82_893.76 TG 53:3 ZNQBEJJYVJSZLM-LEDQTTRKSA-N [M+NH4]+_[M+Na]+ 40 -1 888.7999_893.7557 10.825 41337.4 3671.15599 11.26005 TG pos TRUE 870.766077 TG 53:4 10.47_891.74 TG 53:4 BMSDHYZLQWTKSQ-LSJAAEOESA-N [M+Na]+ 40 -1 891.7397 10.47 11072.6 581.9203554 19.02768978 TG pos TRUE 868.750482 TG 54:2 11.39_904.83_11.39_909.79 TG 54:2 WUUWGORPQFKFQN-XDVOZUNOSA-N [M+NH4]+_[M+Na]+ 40 -1 904.8319_909.7878 11.39 265172.4 23182.14171 11.43864977 TG pos TRUE 886.798077 TG 54:3 11.03_902.82_11.03_907.77 TG 54:3 PHYFQTYBJUILEZ-IUPFWZBJSA-N [M+NH4]+_[M+Na]+ 40 -1 902.8192_907.7740 11.03 651422.6 30966.22591 21.0365513 TG pos TRUE 884.785377 TG 54:4 10.68_905.76_10.64_900.80 TG 54:4 BRLGHZXETDWABO-NOFIOOQLSA-N [M+NH4]+_[M+Na]+ 40 -1 905.7579_900.8026 10.66 753638 55953.60991 13.46897906 TG pos TRUE 882.768777 TG 54:5 10.30_898.79_10.30_903.74 TG 54:5 OEJXMJPFOHYSIU-GRLFFVHSSA-N [M+NH4]+_[M+Na]+ 40 -1 898.7856_903.7411 10.3 464571.8 45953.28027 10.10965479 TG pos TRUE 880.751777 TG 54:5 1 10.49_903.74_10.54_898.79 TG 54:5 1 VVEBTVMJPTZDHO-YQFZQLSNSA-N [M+NH4]+_[M+Na]+ 40 -1 903.7408_898.7852 10.515 158710 13164.46307 12.05594175 TG pos TRUE 880.751377 TG 54:6 10.14_896.77_10.14_901.73 TG 54:6 CDNDFDKFZBPPFW-AXJGXPKFSA-N [M+NH4]+_[M+Na]+ 40 -1 896.7703_901.7262 10.14 84475.4 15963.07036 5.29192681 TG pos TRUE 878.736477 TG 56:4 11.06_928.83 TG 56:4 YONCDTJKIZDSKQ-IYASBODOSA-N [M+NH4]+ 40 -1 928.8314 11.06 18334 1500.525741 12.21838419 TG pos TRUE 910.797577 TG 56:5 10.93_931.77 TG 56:5 UHEJWASONFIROS-YPSHDQQVSA-N [M+Na]+ 40 -1 931.7723 10.93 18995.8 1298.64206 14.62743321 TG pos TRUE 908.783082 TG 56:7 10.14_927.74 TG 56:7 DODZUDCYRVWEOJ-GKZBLMSTSA-N [M+Na]+ 40 -1 927.7404 10.14 28781 1570.855181 18.32186719 TG pos TRUE 904.751182 TG 56:8 9.96_925.73 TG 56:8 UBGUHMDKBGQUND-VPFWBQFRSA-N [M+Na]+ 40 -1 925.7254 9.96 12201.8 934.4001819 13.05843068 TG pos TRUE 902.736182 METABOLITES_END #END