#METABOLOMICS WORKBENCH ayumiando_20180930_230410_mwtab.txt DATATRACK_ID:1520 STUDY_ID:ST001065 ANALYSIS_ID:AN001742 PROJECT_ID:PR000713 VERSION 1 CREATED_ON October 3, 2018, 9:40 am #PROJECT PR:PROJECT_TITLE Lipidomics analysis for aged mice organs PR:PROJECT_TYPE MS lipidomics analysis PR:PROJECT_SUMMARY Lipidomics studies on samples from aged and young mice. PR:INSTITUTE Takeda Pharmaceutical Company Limited PR:LAST_NAME Ando PR:FIRST_NAME Ayumi PR:ADDRESS 26-1, Muraoka-Higashi 2-chome, Fujisawa-shi, Kanagawa, 251-8555, Japan PR:EMAIL ayumi.kawamura@takeda.com PR:PHONE +81-466-32-4216 PR:PUBLICATIONS Manuscript is now submitting to Metabolomics #STUDY ST:STUDY_TITLE Lipidomics analysis for aged mice brain cortex (part-II) ST:STUDY_TYPE MS lipidomics analysis ST:STUDY_SUMMARY Lipidomics studies on samples from aged and young mice. ST:INSTITUTE Takeda Pharmaceutical Company Limited ST:LAST_NAME Ayumi ST:FIRST_NAME Ando ST:ADDRESS 26-1, Muraoka-Higashi 2-chome, Fujisawa-shi, Kanagawa 251-8555, Japan ST:EMAIL ayumi.kawamura@takeda.com ST:PHONE +81466-32-4216 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENOTYPE_STRAIN C57BL/6J mice SU:AGE_OR_AGE_RANGE 8 week (“young”) and 112 week (“old”). SU:WEIGHT_OR_WEIGHT_RANGE young: 20.2g (mean), aged: 34.3g (mean) SU:GENDER Male SU:ANIMAL_ANIMAL_SUPPLIER CLEA (Tokyo, Japan) SU:ANIMAL_LIGHT_CYCLE a 12-hour light/12-hour dark schedule SU:ANIMAL_FEED CE-2, CLEA SU:ANIMAL_WATER tap water #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS - Adipose_51_young Age:Young 8 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_53_young Age:Young 8 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_55_young Age:Young 8 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_57_young Age:Young 8 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_59_young Age:Young 8 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_52_aged Age:Aged 112 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_54_aged Age:Aged 112 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_56_aged Age:Aged 112 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_58_aged Age:Aged 112 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Adipose_60_aged Age:Aged 112 weeks | Tissue:Epididymal adipose tissue SUBJECT_SAMPLE_FACTORS - Liver_51_young Age:Young 8 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_53_young Age:Young 8 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_55_young Age:Young 8 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_57_young Age:Young 8 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_59_young Age:Young 8 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_52_aged Age:Aged 112 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_54_aged Age:Aged 112 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_56_aged Age:Aged 112 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_58_aged Age:Aged 112 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Liver_60_aged Age:Aged 112 weeks | Tissue:Liver SUBJECT_SAMPLE_FACTORS - Cortex_51_young Age:Young 8 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_53_young Age:Young 8 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_55_young Age:Young 8 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_57_young Age:Young 8 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_59_young Age:Young 8 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_52_aged Age:Aged 112 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_54_aged Age:Aged 112 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_56_aged Age:Aged 112 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_58_aged Age:Aged 112 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Cortex_60_aged Age:Aged 112 weeks | Tissue:Cerebral Cortex SUBJECT_SAMPLE_FACTORS - Femoral_51_young Age:Young 8 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_53_young Age:Young 8 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_55_young Age:Young 8 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_57_young Age:Young 8 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_59_young Age:Young 8 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_52_aged Age:Aged 112 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_54_aged Age:Aged 112 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_56_aged Age:Aged 112 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_58_aged Age:Aged 112 weeks | Tissue:Femoral muscle SUBJECT_SAMPLE_FACTORS - Femoral_60_aged Age:Aged 112 weeks | Tissue:Femoral muscle #COLLECTION CO:COLLECTION_SUMMARY All mice were killed by decapitation for sample collection. Collected tissues CO:COLLECTION_SUMMARY were immediately frozen by liquid nitrogen then stored -80 C until use. CO:COLLECTION_SUMMARY (Femoral, Cortex, Liver, Adipose) tissues. CO:SAMPLE_TYPE Brain CO:STORAGE_CONDITIONS -80℃ #TREATMENT TR:TREATMENT_SUMMARY Tissues were homogenised in isopropanol (100 mg/mL) for lipidomics. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Tissues were homogenised in isopropanol (100 mg/mL) for lipidomics. #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY The liquid chromatography/mass spectrometry system consisted of an Ultimate3000 CH:CHROMATOGRAPHY_SUMMARY RSLC system (Thermo Fisher Scientific inc., Sunnyvale, CA, USA) using a gradient CH:CHROMATOGRAPHY_SUMMARY elution consisting of mobile phase A (0.01% acetic acid and 1 mM ammonia in CH:CHROMATOGRAPHY_SUMMARY MilliQ water) and mobile phase B (0.001% acetic acid and 0.2 mM ammonia in CH:CHROMATOGRAPHY_SUMMARY ethanol/isopropanol [3:1]) CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Orbitrap XL CH:COLUMN_NAME Waters XBridge C18 (50 x 2.1mm, 3um) #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:MS_COMMENTS - MS:INSTRUMENT_NAME Thermo LTQ XL MS:INSTRUMENT_TYPE Single quadrupole MS:MS_TYPE ESI MS:ION_MODE POSITIVE #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS peak area MS_METABOLITE_DATA_START Samples Cortex_51_young Cortex_53_young Cortex_55_young Cortex_57_young Cortex_59_young Cortex_52_aged Cortex_54_aged Cortex_56_aged Cortex_58_aged Cortex_60_aged Factors Age:Young 8 weeks | Tissue:Cerebral Cortex Age:Young 8 weeks | Tissue:Cerebral Cortex Age:Young 8 weeks | Tissue:Cerebral Cortex Age:Young 8 weeks | Tissue:Cerebral Cortex Age:Young 8 weeks | Tissue:Cerebral Cortex Age:Aged 112 weeks | Tissue:Cerebral Cortex Age:Aged 112 weeks | Tissue:Cerebral Cortex Age:Aged 112 weeks | Tissue:Cerebral Cortex Age:Aged 112 weeks | Tissue:Cerebral Cortex Age:Aged 112 weeks | Tissue:Cerebral Cortex Acylcarnitine(C10:0) 1932523 3188246 1726410 1813600 2133721 1842240 2156650 1432442 1578459 1391696 Acylcarnitine(C10:0-OH) 144182 290421 161930 166652 227731 174630 168907 84061 185230 151490 Acylcarnitine(C10:1) 487902 687039 461233 396342 432868 708683 641274 478728 646400 539750 Acylcarnitine(C12:0) 12554356 13685934 10992919 10837898 11742062 11657242 11640259 10751515 11263581 9767799 Acylcarnitine(C12:0-OH) 465356 712343 523014 467611 619693 586372 595878 344889 494187 499913 Acylcarnitine(C12:1) 1360027 1795324 1252517 1320399 1471411 1448162 1468361 1237660 1394023 1272413 Acylcarnitine(C12:1-OH) 86501 134580 69560 69587 80000 70496 74078 28818 64473 63625 Acylcarnitine(C13:0) 2419560 1993451 1451370 1341669 1735412 1545194 1761827 1958911 2151735 1535333 Acylcarnitine(C13:1) 433258 372852 282998 286287 362466 552816 485886 581251 623606 501879 Acylcarnitine(C14:0) 97076936 97705944 85616064 78319800 82649400 87480656 83306192 80816464 85435496 73877992 Acylcarnitine(C14:0-OH) 1360081 1876825 1290100 1205409 1359501 1169896 1131274 735147 1032842 1011495 Acylcarnitine(C14:1) 15431748 17199038 13018925 11877359 13182079 15090856 14362244 11000817 12247240 11436582 Acylcarnitine(C14:1-OH) 926786 1281615 822468 699774 888127 1059244 936463 448222 790611 749188 Acylcarnitine(C14:2) 4112481 5018438 3302717 2925126 3367205 3100850 2846093 2250779 2832720 2318714 Acylcarnitine(C14:2-OH) 590051 950626 587019 531618 743350 674754 489535 306704 631282 476846 Acylcarnitine(C15:0) 4466526 5048664 3474674 2846124 3362631 3368801 3348114 2597393 3324933 2407859 Acylcarnitine(C15:1) 852689 863145 647575 487897 675590 852246 796113 678731 674894 575760 Acylcarnitine(C16:0) 242990592 278375552 204708528 188961344 205338016 223618880 228241200 175166704 218686624 185132256 Acylcarnitine(C16:0-OH) 2142826 3115515 2307464 1929229 2341562 1904838 1897574 1315205 1768591 1893220 Acylcarnitine(C16:1) 63450404 71894288 56868124 51320928 55241424 66586280 67541656 60630784 60280804 57577160 Acylcarnitine(C16:1-OH) 1528172 2075406 1366192 1305699 1545676 1861186 1687981 1153018 1669232 1540252 Acylcarnitine(C16:2-OH) 1034353 1255044 845791 742960 915012 816510 673754 467064 694925 555531 Acylcarnitine(C17:0) 2172026 3826544 1893936 2048724 2496574 2376692 2609801 804910 2339797 1617980 Acylcarnitine(C17:1) 2991049 3352534 2426341 2191711 2491564 4066524 3863705 2523695 3663147 2898525 Acylcarnitine(C18:0) 96950928 113102856 87135984 75997368 78162640 82522056 78425440 70150456 79049656 71265944 Acylcarnitine(C18:1) 168289696 191722080 139662400 139745984 155002944 187915936 192007648 114505248 168392768 151042864 Acylcarnitine(C18:1-OH) 2831773 4077483 3041823 2642957 3115165 4214446 4027814 1985256 3565431 3561147 Acylcarnitine(C18:2) 106452384 119751984 83189416 79639072 91693376 71601344 73898480 65034928 75243608 65235136 Acylcarnitine(C18:2-OH) 2472714 3537127 2094861 1756839 2604495 2215995 2055585 1267939 2250692 1765161 Acylcarnitine(C18:3) 11490281 14968144 8960577 8951961 9670182 5872204 6425571 5108159 6369217 5311374 Acylcarnitine(C18:3-OH) 435451 622828 347190 297334 433270 280563 280246 168081 214067 221335 Acylcarnitine(C19:1) 895845 990919 703712 657407 754501 1561589 1535103 1013528 1585275 1269216 Acylcarnitine(C20:0) 2531591 2752030 2477192 2163917 2115597 3715399 2990115 2430715 2509992 2742318 Acylcarnitine(C20:1) 14699539 17228808 13005497 11272213 12858526 16744206 16211337 11588845 15857633 14249793 Acylcarnitine(C20:2) 2172333 4617153 2591131 2381819 2724307 2250678 1900856 958113 2349816 2071875 Acylcarnitine(C20:2-OH) 318861 458901 232439 243179 364501 280478 334899 0 287176 131039 Acylcarnitine(C20:3) 2331912 4025838 2691575 2631652 2853564 2257961 2432438 1766007 2502044 2184021 Acylcarnitine(C20:4) 31025442 42748496 40065248 30079294 35545408 37537268 36046384 46144192 33432688 37613964 Acylcarnitine(C20:5) 16268678 18848896 14037857 14085040 13433654 7804527 8772506 11798488 11056607 8407190 Acylcarnitine(C22:1) 309175 363529 336968 341964 407229 566840 448641 415752 599559 444406 Acylcarnitine(C22:5) 1003189 1433113 1061402 1160356 1260225 417721 713928 501189 711257 524069 Acylcarnitine(C22:6) 4327473 3689935 3613399 3486293 3696780 2372801 2411137 2910404 2936519 2274880 Acylcarnitine(C5:0) 2565532 2206982 2041458 2077693 2258196 2113557 1842456 2391127 2189792 1864229 Acylcarnitine(C6:0) 1301812 1710457 1301824 1228918 1259311 1009776 998842 852831 957690 1015454 Acylcarnitine(C7:1) 22281 0 0 15187 21994 9048 0 13642 14118 6017 Acylcarnitine(C8:0) 1059753 1417586 914994 948756 1018117 962668 953727 732897 854514 876260 Acylcarnitine(C8:0-OH) 70591 114715 78161 81853 102719 60290 58186 22136 69169 71894 Acylcarnitine(C8:1) 147307 201651 148337 128785 134612 127885 100120 111849 133382 95234 Acylcarnitine(C9:1) 61473 62231 44189 45044 49310 57640 45636 52976 57251 43117 AcylCoA(C16:0) 1079415 835818 946229 1143500 954068 1103628 1048889 637629 1007167 719519 AcylCoA(C18:1) 1832182 1597634 1680933 2096498 1954296 1829649 1633199 1215031 1454676 1061837 AcylCoA(C20:4) 837042 666028 703502 742552 919754 764383 712031 170308 901610 860773 CE(a-18:2) 4886049 6108542 6070503 8023246 5312097 3608820 3871845 4406729 5484603 3887221 CE(a-20:4) 17277082 19775524 21459702 23388328 17856070 20984324 20480336 22420794 24630620 24795000 CE(a-22:6) 7648379 9563029 10399582 14831040 9658848 10648186 18735182 18968488 16839408 13323502 Cholesterol 1680604160 2048822020 1825605500 1731351300 1722163070 2609317890 2482159360 1368665730 1762364930 1680561540 Coenzyme Q10 413456896 364095360 350390144 356152448 370760064 382440224 364534848 510391776 387512448 373704320 Coenzyme Q10 (Reductive) 568096770 624408830 563788480 575975620 596131520 623094660 599661500 425702816 563281020 594829500 Coenzyme Q4 4327473 3689935 3613399 3486293 3696780 2372801 2411137 2910404 2936519 2274880 Coenzyme Q4 (Reductive) 1003189 1433113 1061402 1160356 1260225 417721 713928 501189 711257 524069 Coenzyme Q6 287627008 222429632 255043520 235418192 218106352 138333696 115982496 167835296 111500680 151649136 Coenzyme Q8 (Reductive) 871132220 884150400 889080320 883505600 905208770 753971010 777953220 830406590 808627460 684626370 Coenzyme Q9 854797440 732896130 730567740 709352900 730388610 748559170 701125310 1048231620 772355970 756545660 Coenzyme Q9 (Reductive) 887023420 961848830 918822780 929315900 994673540 1150848900 1182624260 905398980 1161603460 1159654660 DG(aa-34:0) 7961745 7907458 8424450 7990419 7517185 5975325 6127648 5674243 5939659 5924908 DG(aa-34:1) 69189000 79071592 63541232 69930048 79495336 65588840 62398484 62414572 70993632 54436524 DG(aa-34:2) 726729 1317053 1165356 1517703 1188291 1393694 1243921 1067966 977158 701131 DG(aa-36:1) 166499312 164285472 136856560 146828656 173201728 254304448 249468576 225585968 277782400 228861344 DG(aa-36:2) 24296054 25817656 18912518 21775060 25401282 22880268 20266386 21084230 27239866 18303784 DG(aa-36:3) 7011323 8968451 5313445 6897643 7123494 4942307 5125876 6779858 5465257 5329947 DG(aa-36:4) 5319804 8550964 6180844 5895916 6524269 6245224 5485793 7070483 6006508 6433566 DG(aa-37:1) 1249694 931089 994303 0 928468 3766596 3787661 2921086 3875533 2103207 DG(aa-38:1) 35692288 33964580 28446296 30102718 35930356 35221568 32903892 26730294 35049412 30531728 DG(aa-38:2) 34666828 35442932 29339266 29846072 36372416 44412016 44593648 40614676 46286944 39922992 DG(aa-38:3) 42482304 52270772 43940620 43866272 46911968 39102288 40987692 39072400 41505672 39348844 DG(aa-38:4) 40817760 56458064 48258096 45310352 42513260 37680860 31920380 34078008 31879988 29441390 DG(aa-38:5) 14874794 18408950 14450944 15412433 14676274 14285796 12842999 13627835 14392754 12895139 DG(aa-38:6) 4980517 7490771 6071772 6714183 6352698 5545926 5871333 6748521 5121577 6833782 DG(aa-39:1) 2009058 2633239 2027506 2073962 2534439 5211437 4446818 3412234 4596296 3710860 DG(aa-39:2) 1380614 721700 501291 832132 1151685 2249838 1972838 1529462 1206545 2115781 DG(aa-39:4) 692116 899034 0 674740 886124 1119372 1206057 1074701 1496652 830758 DG(aa-40:1) 27180718 24330690 20108048 21608416 24990184 22670392 17614716 12957628 19099426 17551856 DG(aa-40:2) 28109306 26321592 20176524 22450902 26974988 35877340 33427830 28841344 35645204 29090390 DG(aa-40:3) 4495205 4176441 3573930 3697598 4553346 7811115 6835965 5938709 6837855 6718844 DG(aa-40:4) 32545224 35722804 29382214 30558424 34285852 52820680 53001572 51768024 58902448 60665484 DG(aa-40:5) 6269651 8052483 6971088 7186131 7373696 7309914 6923389 6220510 8410567 6826804 DG(aa-40:6) 2767441 4343796 3256944 3163555 3191999 2135415 2818370 2584588 2624160 2386741 DG(aa-42:1) 34897908 30799030 28121878 29663586 32669650 13511088 10834143 8287680 10795851 12560154 DG(aa-42:2) 33631868 31609176 24444546 28577764 32755712 30436152 27930050 21622304 28136310 27618508 DG(aa-42:3) 2186050 2050139 1918455 2055671 1867919 2135266 1151679 1442743 1715741 1203335 DG(aa-42:4) 5959939 6341505 4882049 5353649 5387529 7690709 6868592 5447981 7459192 7616942 DG(aa-42:5) 3187775 2627575 2406913 2228605 3212604 4994975 4200260 4070739 4884947 5254927 DG(aa-44:2) 5703468 5184585 4087931 4238572 5044029 2378289 1893656 1378372 1356510 2066872 DG(aa-44:4) 5390133 5028754 4199462 4489145 5017926 3580910 2784670 2367112 2712676 3765175 DG(aa-44:5) 4390562 3458616 2908449 3346254 3001374 6400542 5954314 5204922 6070770 6917340 DG(ae-34:1) 6589292 6848889 5931630 6546762 7630662 8452741 7152627 8484777 8540418 6265602 DG(ae-34:2) 5671289 5484416 5775665 5262964 5029719 5000242 5428717 6190824 5752228 4433018 DG(ae-36:1) 5336069 4845774 4418116 4125695 4851237 8188632 7743294 7707777 8653702 6415751 DG(ae-36:2)-1 17120368 16623764 15757494 14715984 15945370 20828244 19584706 18724166 21095836 16085165 DG(ae-36:2)-2 4205711 3819072 3969698 3906564 3902395 7137432 6883036 7461551 7653434 5472808 DG(ae-36:3) 10844988 9956875 8686932 8714030 9728061 31765692 34174192 33951424 36719984 25455306 DG(ae-38:1) 3465602 3225179 2873534 2726039 3233389 3103533 2682191 2495618 3430537 1539147 DG(ae-38:2)-1 9277805 9231935 8288825 7995216 9239018 10906644 9147687 8402570 10408110 8489898 DG(ae-38:2)-2 4494852 4216779 3417754 3574933 3725850 8971164 9167494 9092996 10247068 7719051 DG(ae-38:3) 13654357 12998441 10476417 10289658 11767265 48035672 48322936 45749576 49424456 39518368 DG(ae-38:5) 9959023 9844949 9286265 9365435 9898802 10601370 10334572 11463523 12160763 10336554 DG(ae-38:6) 1432025 1772226 1857516 1760595 2013200 2033708 2402376 2697845 2349325 2874164 DG(ae-40:2) 1665795 1160163 1581558 1464131 1737569 1563632 922928 867580 958990 1508990 DG(ae-40:3)-1 2999539 3082957 2909081 2799659 3152733 4262585 4317431 3668744 4256799 4055358 DG(ae-40:3)-2 352547 330600 281125 342412 235656 374850 517528 223494 411894 401770 DG(ae-40:4) 2703257 3298481 1906776 2278312 2395561 3745326 3294771 4171454 4164717 3462099 DG(ae-40:5) 15536823 15732663 14641593 14737914 15204293 20531678 20719688 21263556 21812336 21654956 DG(ae-40:6) 9910380 10555290 8816672 9472090 9680536 22018478 21720884 24773264 24799438 23695476 DG(ae-40:7) 8580760 10208134 9756953 9161999 9646422 8368851 8455867 8874168 9883464 8976797 DG(ae-42:5) 1239542 1160791 704742 1177576 1496304 1746922 1352905 1581090 1943459 1512447 DG(ae-42:6) 409233 815924 739748 464104 775601 2519626 2629165 2643411 2798931 2799994 DHSM(14:0) 9013408 11164299 9931556 9968302 11098698 20701210 24813896 15859452 21196906 20590884 DHSM(15:0) 58862 65884 104574 71594 94897 53220 74744 42739 33577 53929 DHSM(16:0) 4579947 5077766 4891408 4185337 4771809 6143410 7634053 6291223 7923818 7452377 DHSM(18:0) 21131186 25367970 22780090 24340074 24462008 15793920 17827042 15848343 18632686 21011590 DHSM(20:0) 13727530 15844254 11423155 14158400 14855943 13443830 12575433 12384029 13581170 10714137 DHSM(21:0) 282197 521451 200297 102283 233724 442757 466727 146514 387172 340626 DHSM(22:0) 41279108 41037712 39168580 35532644 39854260 18563502 20096894 14893904 18770004 17975146 Dolichol-16 0 0 0 0 490697 18099056 18739226 15525606 17566672 16408217 Dolichol-17 4852591 6678966 6035908 4129776 4427516 102027280 102382296 76720392 88161296 87735272 Dolichol-18 18471414 18913208 18512152 18637402 16670051 241775280 258323568 176251232 226240512 203969824 Dolichol-19 14362241 16496522 16151042 11531576 14017362 174996432 193031040 96907512 161928048 128754792 Dolichol-20 2504360 2822996 1224179 120422 732743 27061720 30128796 10779172 22111360 15893471 LPC(a-14:0)-1 42296140 26937274 36539144 30574686 27009858 26851334 28211908 66279188 28499212 30642888 LPC(a-14:0)-2 10308890 7242210 9203486 8047927 7319543 6639379 7080564 14891293 7142118 7866547 LPC(a-16:0)-1 2483284480 1834898940 2240294140 2033768450 1884174080 2018436740 2009987460 3140271100 2044784640 2113097730 LPC(a-16:0)-2 852763460 610357120 719310340 654025660 626307390 636676290 624489860 1138264830 654708100 684063810 LPC(a-16:1)-1 173735264 112140536 152996432 134699104 118624712 149194000 155751984 332757344 157853408 175738784 LPC(a-16:1)-2 30188648 21976828 27687878 25691228 22899980 32314668 33534864 67277528 32735560 34989024 LPC(a-17:0)-1 5422259 3436115 4471683 3806292 3650953 3811954 3611199 6297235 3681915 3550048 LPC(a-17:0)-2 38001008 24655862 32429402 28244688 25908988 25511294 24473494 48967140 25532360 25227958 LPC(a-17:1)-1 109525 21265 130358 69278 27817 0 24577 230456 31829 36378 LPC(a-17:1)-2 4968446 2174605 4483068 3067948 3061333 3811821 3700159 11743597 5190355 5003136 LPC(a-18:0)-1 1085621760 831986940 989117310 861958140 812727680 909902530 925689280 1536640260 963740350 1029151420 LPC(a-18:0)-2 439808928 311981152 399325536 345437952 301320000 364471456 374267552 577982720 341599680 384549344 LPC(a-18:1)-1 2437874940 1704815100 2064355970 1849849340 1738018180 1983509890 2049026300 3294631680 2070640130 2073826560 LPC(a-18:1)-2 497523776 385964960 457493472 433217344 405424320 475566944 482139392 695170750 480515744 457678272 LPC(a-18:2)-1 133265032 84714568 98952896 90151304 84846320 87952432 82059992 171703088 95992192 84267600 LPC(a-18:2)-2 39538576 27184872 31343572 29839390 27796928 28430274 26501044 53496008 30183790 26508792 LPC(a-18:3) 203839 57376 84050 115565 49122 61292 58207 1040930 50878 60093 LPC(a-19:0)-1 5918008 3911411 5063085 4864681 3889219 7424485 7279574 13489907 7722981 8293505 LPC(a-19:0)-2 1061315 741236 950648 805501 765075 1566771 1247054 2467681 1319712 1451709 LPC(a-19:1)-1 2287670 1250159 2169849 1580897 1521247 1898446 1957128 4117053 1816202 1869916 LPC(a-19:1)-2 10911309 6373680 9109759 6959648 6332053 9161388 9639220 19705560 9482436 9830079 LPC(a-20:0)-1 26457520 19719424 24368624 21730400 18877694 21972352 21462244 35743444 22233334 24914198 LPC(a-20:0)-2 14736359 10021236 12809521 10895733 8531916 8382808 8207977 10350353 7519222 8575544 LPC(a-20:1)-1 186396800 121372976 159359840 135928688 124515176 145948768 147896016 297390880 148105200 155354368 LPC(a-20:1)-2 19627256 14179544 17758700 14773034 13429055 15240154 16791958 27092020 15113674 16664210 LPC(a-20:2)-1 47916364 31178346 41834752 33549078 31738894 28801776 27713436 66547692 29887568 32808810 LPC(a-20:2)-2 6251162 3844979 4898124 4415912 4335997 3751074 3537478 7116287 3283094 3400274 LPC(a-20:3)-1 43967784 23335880 36652536 29242694 25674770 20214866 18855502 60092176 21496224 33877636 LPC(a-20:3)-2 10549376 7132466 5555775 8137488 7678317 3300653 5119182 14775180 5265169 7829603 LPC(a-20:4)-1 865490820 513396288 687578370 603453630 540349120 586233020 584308990 1174985980 601018620 687018620 LPC(a-20:4)-2 238661808 177741024 224460656 191065952 178406512 195370336 194829904 323194880 199904784 216866416 LPC(a-20:5)-1 8395188 5140102 7079196 6332198 4971948 4642187 6029127 16229265 7159285 7502817 LPC(a-20:5)-2 1131352 898490 1179094 982544 852504 556293 944829 2463585 1138666 1100648 LPC(a-21:0) 5856568 2493207 3941619 3394593 2945255 8205635 7408164 17650046 6796586 7607993 LPC(a-21:1) 1667081 820076 1302244 1055692 862249 1016806 1123038 2260429 935035 1243923 LPC(a-22:0)-1 59623496 35189544 54889112 46189584 35346676 35673288 35286412 82978304 34405104 36208152 LPC(a-22:0)-2 1062324 521660 805624 630132 401403 759632 266563 1697737 306297 645467 LPC(a-22:1)-1 24048016 13584965 17792116 15541901 13610740 15055118 15631391 35753612 14765730 17122258 LPC(a-22:1)-2 5711103 3614879 4950266 4389894 3587064 4076201 3802161 7967576 4039385 4148095 LPC(a-22:2)-1 2081057 1011227 1724868 1627600 1213448 871302 846866 2097611 847594 1053524 LPC(a-22:2)-2 247865 166183 218737 167331 140453 114327 74996 227147 127849 141105 LPC(a-22:3)-1 265888 191609 236844 182633 171367 122857 181494 253336 120562 159029 LPC(a-22:3)-2 1866851 1215415 1580411 1521473 1223878 1158637 1368957 2229863 1169518 1385523 LPC(a-22:4)-1 102444968 59054488 83606992 73631776 62683800 73070056 74564528 180289280 73702168 88869888 LPC(a-22:4)-2 11609183 9169584 10628571 9906610 9369927 9640882 9362924 13844267 9547663 11038630 LPC(a-22:5)-1 5320149 3492621 4104238 4049385 3452775 2936316 3805328 6922738 3772096 5375702 LPC(a-22:5)-2 12138565 8556065 9803542 9776147 8397892 8993437 10083296 20276594 10430730 10973212 LPC(a-22:6)-1 695177340 395409600 511182816 448092000 417876480 462016192 472864768 963734080 496272160 569147010 LPC(a-22:6)-2 175763040 122655104 154151568 132096888 123624432 141146736 144571760 263341536 152046048 163580848 LPC(a-23:0)-1 13036776 9158116 10727004 9915326 8824818 16816534 14762342 23181016 14424370 17468140 LPC(a-23:0)-2 2575490 1282579 2056495 1983227 1281135 2904000 2669046 6527663 2426867 3213264 LPC(a-23:1)-1 2060092 978298 1275693 1272325 916372 4194148 4372793 11988689 4108871 4498133 LPC(a-23:1)-2 1943939 1023820 1409439 1410277 1017002 5221868 4667454 11308458 4051651 4987277 LPC(a-24:0) 287627008 222429632 255043520 235418192 218106352 138333696 115982496 167835296 111500680 151649136 LPC(a-24:1) 40599808 27235816 36963240 32911924 27435500 38289136 38241140 93996896 39039000 43000068 LPC(a-24:2) 2009789 1031220 1400450 1222453 983248 941137 964242 2637646 856343 685047 LPC(a-24:4) 10376599 6080488 8698562 8023005 6191091 5743205 5796631 13193859 5324474 6847003 LPC(a-24:5) 4136856 2559689 3689719 3102665 2685539 2454776 2765905 4884002 2441290 3219962 LPC(a-24:6) 7753815 4305377 5998401 5669949 4515760 4784444 4950687 11673050 5032544 6369687 LPC(a-25:0) 26571188 21567774 25866810 23090386 22998014 27444772 26368198 31290646 24754792 33311900 LPC(a-26:0) 2169679 2028268 1936892 2153474 2083405 1137730 1024477 616857 672822 616650 LPC(a-26:1)-1 22911130 17813408 20967882 18733832 18637906 13949560 14280372 18280908 12937599 18259988 LPC(a-26:1)-2 20840294 17189618 18834030 17664814 17048752 14434815 14389474 20775526 12816612 17666804 LPC(a-28:0) 3313095 2762524 2750080 2114364 2379875 486722 938911 1018028 1067979 746058 LPC(e-16:0) 8564137 5654961 7315655 6758679 6225197 6772708 6319415 11277892 6753725 6123706 LPC(e-18:0) 5017279 3063701 4524907 3578449 3176166 2351434 2447742 4084168 2375038 2610366 LPC(e-18:1)-1 10309006 6622947 8835793 7382212 6828954 7457809 7234172 14332615 7452229 6752580 LPC(e-18:1)-2 6016655 3807474 5355281 4254953 3803494 4723489 4526936 8824159 4269272 4585328 LPC(e-18:2) 4357976 3016780 3928093 3383664 3129879 8541862 8833578 13196654 9016270 8964666 LPC(e-20:0) 590177 444429 508256 486950 451687 517203 428621 941381 399647 469913 MG(a-16:0) 12514329 16070651 12772644 12911670 16422612 11356788 12355470 8682402 11989974 12744831 MG(a-18:0) 43680456 39462600 43248000 35597292 41198232 37219360 42525428 55349108 40791284 44208712 MG(a-18:1) 20645144 17771060 15322952 18940448 18168552 21873756 21539500 34320440 20629428 19770628 MG(a-18:2) 726768 617425 476377 588629 558477 581776 485329 1082786 652613 388982 MG(a-20:2) 242720 210129 212832 276519 287928 141709 194316 391068 152221 149201 MG(a-20:4) 52168288 52837872 52494616 61451320 56488160 47251448 54278420 45533960 51047268 53668360 MG(a-22:4) 3583933 3110947 3253900 3853560 3506916 2766638 3086284 4445823 3129855 3908756 MG(a-22:6) 16013020 14103748 12515434 16670550 16125116 13789876 15390783 14417935 15143616 14700168 MG(a-24:1) 2431410 1988187 1875988 1659954 1631440 467126 527964 709391 567865 309553 MG(e-18:0) 248694 241261 262638 365243 338079 164192 141200 187172 202471 213664 MG(e-18:1) 1482875 1533143 1585434 1592872 1660363 1727102 1537927 1552823 1358363 1103734 MG(e-18:2) 200257 155760 271642 252064 225880 465890 654844 1277178 565517 705032 PC(aa-30:0) 1132702980 1177459970 1106195580 1083955710 1158964350 965969600 1021581820 831472640 1004480900 1015073340 PC(aa-30:1) 526197248 608089220 579351360 612269950 621911940 695894020 742652540 468870016 676814080 629334460 PC(aa-30:2) 7943181 8815232 7900691 7001841 6675377 9132784 9569638 8080385 7561979 7471649 PC(aa-31:0) 116933944 119507384 117247344 117011336 112013968 80393984 81738504 83362752 78021104 75407008 PC(aa-31:1) 6355066 6358558 5950683 5411987 9015955 3924435 4385965 999893 5354281 2344993 PC(aa-31:2) 10194887 10828527 8745980 9187305 8579974 8731267 8742362 10435734 7774652 6479282 PC(aa-32:0) 4528955900 4777976300 4800070100 4728160800 4709080100 4534350300 4511709700 3977488900 4505733600 4447015400 PC(aa-32:1) 3189223420 3423351040 3266196480 3237059070 3393284860 3450772990 3530727420 3083780350 3559415300 3553024510 PC(aa-32:2) 140703152 159401264 140287680 130506224 161046320 203116128 224909440 107747896 194224432 184521168 PC(aa-32:3) 86550176 91812192 87025288 86407040 86632800 73906752 69282240 43351720 60672848 54390700 PC(aa-32:4) 2326667 2133085 1778207 1827578 2109980 4410172 4049617 3474928 3474037 4095100 PC(aa-33:0) 76191488 74236552 73459248 75042016 75573104 41076072 45013232 41866064 44098696 41958500 PC(aa-33:1) 61552456 59099512 58603056 59928608 58706512 59547248 62548612 66578008 63352236 57073796 PC(aa-33:2) 6507804 6935264 5321104 3971200 6216335 4215513 2810062 5206182 5128449 4220723 PC(aa-34:0) 3597790980 3654270720 3550577150 3566861060 3641207040 2521500160 2606299140 2475257090 2629494270 2841591300 PC(aa-34:1) 7198411300 7252651500 7331142100 7153226800 6940206100 7623140400 7565165600 6911543800 7423648300 7088567300 PC(aa-34:2) 1397136000 1375386110 1297410300 1254798850 1280863230 1259159420 1206979070 1180033790 1265080830 1082264450 PC(aa-34:3) 191029712 200400112 169088336 163455536 189859968 155707248 148972016 115286624 164801840 142696688 PC(aa-34:4) 140042352 150885792 141678576 143103264 143266176 141261760 122534320 90235520 112708016 107464536 PC(aa-34:5) 12878455 16909276 13810310 14432412 13467184 15948284 17457138 10196860 14293535 13168922 PC(aa-35:0) 43077212 41343480 40845260 39461100 41584148 27246444 31080804 26532912 31596010 32745512 PC(aa-35:1) 272864704 267229664 264070288 255685504 259705776 284609280 291562624 298237344 305911232 286271008 PC(aa-35:2) 5562897 5265877 6163173 6169774 5399666 6458583 7457066 6157248 8005846 6668142 PC(aa-35:5) 31119532 30392532 30043756 28742092 28376264 34925308 32427748 43197796 26110942 27814032 PC(aa-36:0) 229397952 248933584 246590912 246203040 242586192 101590176 100884032 86409232 100378056 103638752 PC(aa-36:1) 9676529700 9599327200 9750686700 9466534900 9345947600 10316722200 10285004800 10236051500 10030356500 9800636400 PC(aa-36:2) 1824451070 1822157700 1778749180 1813707010 1830325250 1913944700 1945104770 1903022460 1969071620 1762900350 PC(aa-36:3) 469596032 481504128 465963264 464986016 474612800 433093152 457258848 417537696 494645504 468757568 PC(aa-36:4) 3477137410 3537754620 3604614140 3604078340 3519416060 3451811070 3433274110 3214129920 3400895230 3641293820 PC(aa-36:5) 118168848 128961000 123161656 117337680 126781296 102939184 125378800 104439600 140094112 139129008 PC(aa-37:0) 18081886 18141196 18089550 17997444 19400710 11347957 11166742 9143438 11698068 11415612 PC(aa-37:1) 406402144 390078272 396411296 393501536 395019968 559603260 586652800 538862140 587697090 612922560 PC(aa-37:2) 18306612 17698282 18634870 16335132 15353499 28097130 29240384 28326982 32424592 27025280 PC(aa-37:4) 7219904 6275064 7501086 9484580 7209249 4204363 5244624 4910442 5027344 6968027 PC(aa-38:0) 90176560 91961160 96178144 89090224 93601872 15675587 14857132 10675196 14840899 13742639 PC(aa-38:1) 4129097470 4113235710 4156539650 4008800770 3969812220 3182899710 3018010620 2718054660 3005616380 2972686850 PC(aa-38:2) 1090952580 1078607870 1048531520 1092480640 1110414850 1005897860 1006751360 948862400 1035488260 1007030460 PC(aa-38:3) 410044320 431962400 414057344 420077216 429395360 367648384 400751424 394526784 408925408 440788640 PC(aa-38:4) 4300825600 4246855420 4282664190 4303570400 4315471900 4106895870 4096996350 4150572540 4175994370 4328581600 PC(aa-38:5) 930172030 979586300 961170500 1012798980 1043501700 1014263040 1020705220 780907070 1082300290 1043554880 PC(aa-38:6) 6643894300 6502769200 6419896300 6276134400 6357193200 6658134500 6596468200 6328889900 6588119000 7014821900 PC(aa-38:7) 336568992 364508608 342193984 328608576 378979680 420734848 442868224 259115760 406420608 432378240 PC(aa-38:8) 39062464 42707976 39217184 38490980 36279016 39456964 34064336 24531438 36410804 33643864 PC(aa-39:3) 4787236 4830606 4987282 5965247 5893441 7390485 7659589 7163640 8556095 8439613 PC(aa-39:4) 9595003 6938088 10454891 7936924 7691622 11918637 10723082 12339581 11283260 12861811 PC(aa-39:6) 6787816 5741644 8456388 6877403 6180844 5621864 4846443 6090630 6727338 6720302 PC(aa-39:7) 3844943 4518067 3296623 3083068 3521697 2719251 3554498 2232064 3439997 3780354 PC(aa-39:8) 254447 317486 268616 163472 371214 142928 170101 130479 184277 196529 PC(aa-40:0) 67546112 65921060 59766164 58336096 61657320 14100618 14916332 10492393 13869104 15810960 PC(aa-40:1) 3126106370 2855236610 2939131900 2811857920 2880487170 2055252220 1821636990 1651354880 1732805760 1888961020 PC(aa-40:2) 1775040130 1654337020 1640510210 1585994110 1611216000 1510297600 1448683520 1308524160 1429171070 1435237630 PC(aa-40:3) 207915360 214200416 204827712 202484848 204295952 171548816 179512720 159000320 177919584 185067280 PC(aa-40:4) 876025790 878612290 864824130 907858940 889909120 824186690 823143620 833676800 849513340 937511100 PC(aa-40:5) 78922840 88725296 83424816 84516928 91534320 89375792 92729576 77876808 96320336 107760312 PC(aa-40:6) 2080020350 2029822460 2002257540 2010739070 2049694590 1852146690 1980435710 2001716350 2078066180 2128465540 PC(aa-40:7) 591056640 607605890 596037120 607299330 619593340 613950020 645176060 488857056 683860220 658200510 PC(aa-40:8) 343475584 340137120 293653440 272019968 301593184 301597696 274703776 196936560 293662848 273298848 PC(aa-40:9) 77065552 74322296 72590872 71621112 71096632 58019564 54167688 60265848 56680612 57596236 PC(aa-42:0) 6941586 5939295 6548270 4184386 5068055 2964796 2536446 1863155 2434544 3098020 PC(aa-42:1) 3458490110 3194732540 3297452540 3096889860 3175102210 1520987780 1305357700 1198415360 1253767680 1533796990 PC(aa-42:10) 406726976 409251232 385517568 385780640 404419008 418058496 405786752 302962144 421886816 519731104 PC(aa-42:11) 21281042 25335464 22038612 22427056 25185400 25287078 29652868 17394868 31457624 31956416 PC(aa-42:2) 1944529020 1734941700 1851416320 1725501060 1770490240 1561596290 1489479170 1378243460 1383665150 1539895040 PC(aa-42:3) 171193568 161091616 164317888 159748448 162228768 80780736 77502976 74693104 79590992 78521192 PC(aa-42:4) 357076736 364519232 379347424 383555968 365020640 264251136 272246528 253307760 268802784 299357952 PC(aa-42:5) 277755872 266657280 265686320 280899008 280390208 240645536 232857696 206629600 241665616 276167648 PC(aa-42:6) 71985224 75683128 72420320 83620768 78091440 62752584 60575216 61999496 72282808 72670368 PC(aa-42:7) 66007196 64008664 62183584 62868652 63154216 72568936 76620088 58516824 72527280 73470128 PC(aa-42:8) 12156310 12862809 11747070 12919030 12320818 12658514 11729111 9611588 12781048 15572059 PC(aa-42:9) 18686714 21309400 20729146 24379378 23363002 16121818 18426420 13320300 22242960 22031836 PC(aa-44:1) 237721360 220429792 226654832 213306528 211876848 71822984 59599348 58122308 60654772 84779088 PC(aa-44:10) 4372325 5057236 4667486 4774494 4304192 4099521 4507618 3906011 5772933 7214278 PC(aa-44:11) 1284984 1397658 1361433 1242849 1712836 1004340 1210697 761368 1795621 1990519 PC(aa-44:12) 360539584 364675168 339615200 333590624 360361472 430907552 446263296 293993248 459470272 542547780 PC(aa-44:2) 326048480 304260096 312678720 294772576 298495904 181314944 176251520 159912624 167047440 194787776 PC(aa-44:6) 47891360 47606832 46633752 47306100 49370712 25564522 21949734 23705252 23975468 23620088 PC(aa-44:7) 29076570 28014804 28777172 28930098 28560994 25203980 21663810 18156222 24164296 22518174 PC(ae-32:0) 196543856 201180272 194583856 190784640 195396272 141319824 151724640 154688672 146718768 140830768 PC(ae-34:0) 850476930 855516540 850993470 844526720 889811520 457928416 457962880 447900960 474770528 521280416 PC(ae-34:1) 871132220 884150400 889080320 883505600 905208770 753971010 777953220 830406590 808627460 684626370 PC(ae-34:2) 92640048 93035072 93298880 90589160 89347648 99788608 105507888 100715008 104267456 89195512 PC(ae-34:5) 2115359 2254735 1808945 1891494 2040336 2347592 2506202 1138377 2018346 2219205 PC(ae-36:0) 76741288 84343408 79820976 81362536 86627608 36539736 34549700 30175466 34290620 36404080 PC(ae-36:1) 332761216 314968000 331526400 314712544 329095424 238201392 224622672 211441584 246246048 223848768 PC(ae-36:2) 416332544 393994176 420315200 394443424 410106496 483239808 497997248 487582560 492932576 478476736 PC(ae-36:3) 24409814 23788722 24192164 22472652 21958060 74961928 86778672 73610848 81969616 76376080 PC(ae-36:4) 4486548 4768087 6133284 6287157 5792417 4833009 5184048 4109264 4014100 4044345 PC(ae-36:7) 1208202 1418758 1142011 821207 1154961 1114425 1804224 605565 1254945 1236285 PC(ae-38:0) 13321743 12011652 12489142 12195572 11763588 5391783 4982174 4753920 4968127 4923382 PC(ae-38:2) 143121456 130601576 133065576 117565272 129369912 196924416 186114640 180975136 184816304 184014832 PC(ae-38:4) 20050786 21080440 23325712 20374646 21112336 16814100 15830096 17576792 18078948 17870552 PC(ae-38:5) 6436022 5622323 5918262 4870301 5554835 4645157 4119508 2563771 4913908 4136827 PC(ae-38:6) 8068376 7707390 6859855 6578079 6477220 4558217 6034239 7361487 7795445 6203166 PC(ae-38:7) 2461709 2969357 2784831 3549529 2474355 2250722 3422774 998485 2607680 3176919 PC(ae-40:6) 8152511 10668472 11252225 9713678 10175010 13240230 13525338 12854170 14910784 12710536 SM(12:0) 1033999 998776 1113719 1081347 1041627 1078864 1166132 1052159 1209377 1081081 SM(13:0) 1107983 1339408 1071351 1140971 1109452 1685418 1572426 1392411 1474608 1620021 SM(14:0) 526138592 524322208 522163040 508097760 539696580 667649540 675770370 632385860 679375740 656010690 SM(14:1) 7064960 6457161 6625688 6073702 6669240 10191706 9833899 9074900 9878340 9410929 SM(15:0) 30882380 37297348 33451192 30847928 35394800 72942552 73487992 36070000 64361916 61190920 SM(15:1) 2567329 2846363 2309644 2305485 2231531 3233317 2865829 2399909 2775691 2886802 SM(16:0) 798245060 834749570 795144960 753048380 783152260 1240700670 1256534780 1018334780 1191982590 1225118590 SM(16:1) 1376176380 1554809730 1427335300 1449364100 1478016380 1827492860 1759378050 1508544260 1788243970 1786935680 SM(17:0) 15911384 18204354 19164130 17994006 16872540 18371072 20639128 22223294 20383078 19457358 SM(17:1) 5086054 5432534 4747516 4592725 5393475 5131236 5738211 3548451 5922625 5075145 SM(18:0) 1469586560 1516022400 1580911360 1571732990 1528092670 1497656060 1519688830 1477689980 1529431810 1586898690 SM(18:1) 1700044290 1792879870 1715512450 1625544450 1774571260 1640023420 1725677060 1602222590 1729074430 1765249540 SM(18:2) 30999310 36534480 33418188 32160732 38312936 44069968 44903072 26630476 36134908 37854136 SM(19:0) 16603186 17382782 15443891 16183772 15228750 15045887 15614472 16634431 13896480 14030314 SM(19:1) 1011472 1913497 121600 1551454 1695013 3046682 2914401 1040458 1942305 1993137 SM(20:0) 333206464 336360480 323941824 325808352 327116224 321452896 311708192 318178368 316068800 337314400 SM(20:1) 5616599 6142258 5131335 5502043 5696181 6671805 5875460 5401033 6623818 6939433 SM(21:0) 50979312 51696860 49232068 52517156 52727720 78179296 70964504 75414000 76790072 72335104 SM(21:2) 26205424 20956298 25768248 18262920 17669694 19097482 21377904 21395716 19829524 17899596 SM(22:0) 1062998460 1083284480 1087009790 1029796100 1058214660 826058690 752520320 752226940 771300740 795887940 SM(22:1) 88176432 95149280 92345968 90134880 91613800 127873232 120379016 137710480 121103344 115333896 SM(23:0) 439756992 417435392 403259168 390162496 420698976 535648160 533176000 495254400 512443392 560095740 SM(23:1) 205838208 211936768 230598064 224181264 229634560 466707328 498150976 495402464 482741632 495798464 SM(23:2) 5428927 3705393 5646557 4399586 3765910 3510834 3368744 4113824 2752450 3626785 SM(24:0) 1744352000 1665938050 1671535360 1553406590 1656839420 1126376700 1102389250 1055749820 1091719550 1182752260 SM(24:1) 8971877400 8603785200 8816145400 8415159300 8675750900 10957705200 10724646900 11083716600 10268477400 10854614000 SM(24:2) 215242720 209858672 202369920 214057536 210820096 243068480 240581584 264688592 256640896 271093888 SM(24:3) 4218882 4713495 4887770 3807553 3970387 3358758 3129205 3839827 4533559 4130587 SM(25:0) 26731534 24926540 23352488 21701024 23612630 23460202 21879942 20583090 22951934 25245266 SM(25:1) 100413504 93553672 91916472 89843656 94094272 305799136 318840608 327613920 306232864 324308416 SM(25:2) 4947648 5628800 5054108 5028716 5444841 10755521 11186414 12358487 12080597 13645936 SM(26:0) 6278306 5917738 5529205 5746277 5529585 4021116 3933942 3264164 3863546 3783214 SM(26:1) 56177552 54203328 53594040 48898908 52392596 62267116 63586008 67270328 62296440 67648792 SM(26:2) 19708978 18536586 17669982 18044194 17722980 14855424 16349126 13518878 14962588 18496244 Sphinganine-phosphate 1312804 1267127 1439270 1114924 1317319 1336520 1337793 879957 1012418 1248582 TG(aaa-48:0) 7913342 7455557 8812841 8672599 8264132 7741144 9059103 6876849 7969675 6963544 TG(aaa-48:1) 26777104 31971312 29880300 30835148 31788382 35101720 37232192 28101752 33169492 36514540 TG(aaa-48:2) 9609391 13732423 11406509 11097763 10303981 13361920 12692424 9781811 11749802 14626885 TG(aaa-48:3) 2755961 3668825 2947231 3506504 2547598 3266608 1940243 1716431 2249639 3547062 TG(aaa-50:1) 148817712 167981648 160107888 148445952 145444144 159436656 161184592 106828272 142863344 130868080 TG(aaa-50:2) 77788448 93254192 84954400 76991352 82847864 96709512 88577400 65041852 77933216 82106376 TG(aaa-50:3) 21202256 31690968 25108626 24464552 20588416 33589220 22824860 17209788 22283436 26196286 TG(aaa-50:4) 6947689 9529767 7501171 6756684 7122781 8516644 5834458 4267387 5599555 6707186 TG(aaa-51:1) 2534794 3504283 2905346 2757901 2757751 2821180 2081702 1197179 1471622 1856561 TG(aaa-51:2) 4115684 5683299 4283235 2717817 2556079 6722790 5348358 3644867 4624366 4733151 TG(aaa-51:3) 1587686 1131726 1827549 1730767 1551704 2510793 1930463 1279263 697160 1067940 TG(aaa-51:4) 689649 1032369 391396 794601 991790 509402 437376 442776 284604 459749 TG(aaa-52:1) 35996252 36207844 43902496 37173368 39888636 36198016 35611748 21953766 27390712 24918042 TG(aaa-52:2) 197737808 225558816 201127632 192228752 215203360 292582848 279228512 169540896 240675888 219375360 TG(aaa-52:3) 106922896 142096352 111186472 102456736 106217888 150474464 119174480 89076000 103642032 109367408 TG(aaa-52:4) 116784040 143885712 125834280 127527888 120077344 131864040 100067920 77755408 94083384 105827856 TG(aaa-52:5) 20964948 30474610 24538456 24344552 21849296 30986258 23009242 16523906 22713450 23381104 TG(aaa-52:6) 25909312 30489724 27407068 26891494 29475828 24492996 24246020 16677542 25879480 25213416 TG(aaa-52:7) 4119641 4470937 4000138 3994452 3696181 4095306 4084279 2561081 3797868 3637348 TG(aaa-52:8) 3829470 3861781 3715771 3722558 3473269 3743199 3236707 4262747 3247919 3047329 TG(aaa-52:9) 926858 923811 920795 468229 834594 440632 377919 1182922 625682 462549 TG(aaa-53:10) 737835 620400 507544 237747 269514 528842 263083 380889 484815 821578 TG(aaa-53:3) 920011 2008707 1700987 1059235 726499 2658247 1613385 1589864 1615221 1475127 TG(aaa-53:6) 2643059 3043949 3079615 1698156 3243910 2287747 2049583 1919755 1930507 1965059 TG(aaa-54:1) 848553 1095031 1385348 1406941 1174681 1329354 1531565 1039875 994741 1257324 TG(aaa-54:2) 33868308 36272040 35611664 28799966 31163744 56133100 51886532 28368190 43302292 43563024 TG(aaa-54:3) 59750664 58461328 61871624 52368400 49668836 91633008 73723616 43269096 61323392 66433324 TG(aaa-54:4) 163422688 182292272 168974560 165415248 170828416 205979200 158974576 98812576 143431376 147067680 TG(aaa-54:5) 186968368 212353440 196985200 176983200 190148096 234656784 192750112 121751584 174757040 179856000 TG(aaa-54:6) 446432032 476825216 445219392 440297696 474201056 381811520 359158944 261368240 364849664 387506752 TG(aaa-54:7) 74477120 84166008 86543048 76266592 76528272 88224992 79570008 60907896 84128824 88187248 TG(aaa-54:8) 6218114 8827307 7099506 7722748 7173004 7526058 6626990 5100298 6480364 6054105 TG(aaa-54:9) 1662379 2798846 2415921 2311965 2456547 1598589 2000232 976254 1309880 1838146 TG(aaa-55:4) 1500208 1187775 1327461 1251490 1012589 1364728 1024494 582955 954206 1251944 TG(aaa-55:5) 2055459 1926004 1253679 1762081 1247435 1928230 1837843 480094 1796813 1349928 TG(aaa-55:6) 5168414 5368522 5102950 4849522 5131093 3362290 3335627 2367470 3504722 3298587 TG(aaa-55:7) 5592929 5433721 4622781 4417402 5433458 5197020 4313430 2789202 4060027 4085581 TG(aaa-56:1) 265739 306255 333384 444109 375694 432745 582041 183635 401144 397323 TG(aaa-56:10) 4412734 5207420 4992615 4675528 4574001 3807237 3238591 2524553 3884314 3667395 TG(aaa-56:11) 594519 546423 857561 821719 882046 408471 369582 303405 535560 454011 TG(aaa-56:2) 2193998 2240616 2463306 2238143 2281560 3132100 3278383 1986565 2463193 2791661 TG(aaa-56:3) 4610385 6283480 5216917 4765534 5065298 9024410 8522344 4515456 6575764 6815592 TG(aaa-56:4) 39346244 49411864 44173800 40501264 45725992 45586256 44940236 24764658 37248228 39704652 TG(aaa-56:5) 133935424 128099008 138330608 115143824 126402728 136450912 131728520 68339976 118018080 115904840 TG(aaa-56:6) 81936816 80177176 75064712 61926332 69098152 56326612 49617944 31515394 49611128 63373060 TG(aaa-56:7) 575818370 653101630 595975170 573591940 648503420 667621060 630340740 417253248 591648960 578613630 TG(aaa-56:8) 167464112 193107616 167809680 153058960 167640848 169629984 147982736 114530872 148616800 141317984 TG(aaa-56:9) 16361432 20172860 19178234 16955178 16318599 15368771 12628627 11466424 14656094 12718389 TG(aaa-57:11) 707029 681925 555038 746645 734629 705274 688971 839581 687104 675470 TG(aaa-57:7) 3816233 3971623 3235266 2881500 3319249 4137689 3356241 2258258 3377083 3777490 TG(aaa-58:10) 203547936 213656928 212940064 198916832 216571104 188426384 166721936 119867264 179116544 199953888 TG(aaa-58:11) 15118140 17688076 17923938 20803476 18057300 12962284 13462662 10154972 16394341 14703362 TG(aaa-58:12) 13444275 15269006 13240377 14297389 14618065 11717432 11750828 8178323 12907648 12481560 TG(aaa-58:4) 1338973 2145708 2364002 1784180 2271743 2495170 2655336 972613 2239600 2226880 TG(aaa-58:5) 8691272 9291636 10590551 8641299 9915167 13065859 13817980 7173813 11109983 11533390 TG(aaa-58:6) 21938386 22906014 21540428 20717310 23244836 22934268 24109584 13326162 22691584 21486700 TG(aaa-58:7) 76355312 79962712 78238064 66230064 75776640 83685856 82158864 47747956 80300640 76161208 TG(aaa-58:8) 72109184 73140984 76625760 71501464 78009488 81431240 82333400 52943964 72108520 67354768 TG(aaa-58:9) 100858440 112927808 100206408 97206168 109369088 96255504 88323968 66287004 91465296 94690480 TG(aaa-60:10) 211646464 206704896 225416896 193917536 206955136 164898304 156433536 97996272 154056784 168228592 TG(aaa-60:11) 48194744 49376680 47687232 36041104 42147676 46465444 38077060 27348232 40980096 46365592 TG(aaa-60:12) 438395872 425363424 453462528 392274048 448633536 381347648 356596480 251500960 373287552 421464384 TG(aaa-60:13) 21587922 24115972 25031806 27226074 25603444 23571180 22772048 16853474 24395810 23946858 TG(aaa-60:7) 3560407 4078562 3395699 2567208 4096397 4864872 4712673 2514014 4145681 3565267 TG(aaa-60:8) 9806671 9121789 9951939 8425736 9568400 11673868 11040287 7337504 10126225 9940997 TG(aaa-60:9) 41125548 42051464 43794060 35861056 39879008 34288108 32332268 18894104 31252958 37515752 TG(aaa-62:10) 12132673 12442178 12364064 11066956 12390949 10853104 10249481 5952974 10069129 11389559 TG(aaa-62:11) 12418329 13918415 12737506 11139225 13137644 12468068 13320669 7442523 12651596 12522965 TG(aaa-62:13) 45197848 50494220 46856804 40880232 48496832 50544348 49474648 33006006 46068496 47037456 TG(aaa-62:14) 10987205 10089200 12611776 11553022 11516172 9179206 9074428 5715511 9572181 8863210 TG(aaa-62:9) 1123640 806878 1064452 820977 811157 801501 785054 458995 550651 890684 TG(aaa-64:14) 632482 1451766 2062803 1474896 2433574 2040561 965104 293143 1289548 1831037 TG(aaa-64:16) 12622372 14455880 13888851 12818163 14632724 13343263 12314973 6789735 11964529 13458494 TG(aaa-66:16) 4071291 3115848 5135739 3766478 4313966 2549182 2674727 1429700 2549575 4078809 TG(aaa-66:18) 8011537 9828312 7848569 9527615 10343498 7523325 8736432 4439325 7713835 9217449 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name rtimes ObsMass ObsMZ PeakID Ion Acylcarnitine(C10:0) 5.4 315.241 316.248 Pos_007544 M+H Acylcarnitine(C10:0-OH) 4.7 331.236 332.243 Pos_007864 M+H Acylcarnitine(C10:1) 5 313.225 314.233 Pos_007478 M+H Acylcarnitine(C12:0) 6.2 343.272 344.279 Pos_008230 M+H Acylcarnitine(C12:0-OH) 5.7 359.267 360.274 Pos_100213 M+H Acylcarnitine(C12:1) 5.8 341.256 342.263 Pos_008185 M+H Acylcarnitine(C12:1-OH) 5.2 357.251 358.259 Pos_099376 M+H Acylcarnitine(C13:0) 6.5 357.287 358.295 Pos_008497 M+H Acylcarnitine(C13:1) 6.2 355.272 356.279 Pos_008444 M+H Acylcarnitine(C14:0) 6.9 371.303 372.31 Pos_008836 M+H Acylcarnitine(C14:0-OH) 6.5 387.298 388.305 Pos_009174 M+H Acylcarnitine(C14:1) 6.6 369.288 370.295 Pos_008774 M+H Acylcarnitine(C14:1-OH) 6.1 385.282 386.289 Pos_009120 M+H Acylcarnitine(C14:2) 6.2 367.272 368.279 Pos_008704 M+H Acylcarnitine(C14:2-OH) 5.8 383.267 384.274 Pos_109360 M+H Acylcarnitine(C15:0) 7.2 385.319 386.326 Pos_009128 M+H Acylcarnitine(C15:1) 6.9 383.303 384.31 Pos_009073 M+H Acylcarnitine(C16:0) 7.5 399.335 400.342 Pos_009477 M+H Acylcarnitine(C16:0-OH) 7.1 415.329 416.336 Pos_009868 M+H Acylcarnitine(C16:1) 7.1 397.319 398.326 Pos_009430 M+H Acylcarnitine(C16:1-OH) 6.7 413.313 414.321 Pos_009815 M+H Acylcarnitine(C16:2-OH) 6.4 411.298 412.305 Pos_009762 M+H Acylcarnitine(C17:0) 7.8 413.35 414.357 Pos_009816 M+H Acylcarnitine(C17:1) 7.4 411.335 412.342 Pos_009764 M+H Acylcarnitine(C18:0) 8 427.366 428.373 Pos_010147 M+H Acylcarnitine(C18:1) 7.7 425.35 426.357 Pos_010100 M+H Acylcarnitine(C18:1-OH) 7.3 441.345 442.352 Pos_010466 M+H Acylcarnitine(C18:2) 7.3 423.334 424.341 Pos_010031 M+H Acylcarnitine(C18:2-OH) 7 439.329 440.336 Pos_010413 M+H Acylcarnitine(C18:3) 7.1 421.319 422.326 Pos_009988 M+H Acylcarnitine(C18:3-OH) 6.7 437.314 438.321 Pos_010359 M+H Acylcarnitine(C19:1) 7.9 439.365 440.373 Pos_010421 M+H Acylcarnitine(C20:0) 8.5 455.397 456.404 Pos_010789 M+H Acylcarnitine(C20:1) 8.1 453.382 454.389 Pos_010732 M+H Acylcarnitine(C20:2) 7.9 451.366 452.373 Pos_010686 M+H Acylcarnitine(C20:2-OH) 7.5 467.36 468.368 Pos_011056 M+H Acylcarnitine(C20:3) 7.6 449.35 450.357 Pos_010665 M+H Acylcarnitine(C20:4) 7.4 447.334 448.341 Pos_010619 M+H Acylcarnitine(C20:5) 7.1 445.319 446.326 Pos_010574 M+H Acylcarnitine(C22:1) 8.6 481.413 482.42 Pos_011349 M+H Acylcarnitine(C22:5) 7.5 473.35 474.357 Pos_145392 M+H Acylcarnitine(C22:6) 7.4 471.335 472.342 Pos_011135 M+H Acylcarnitine(C5:0) 2.5 245.163 246.17 Pos_006455 M+H Acylcarnitine(C6:0) 3 259.178 260.186 Pos_006582 M+H Acylcarnitine(C7:1) 2.9 271.178 272.185 Pos_066862 M+H Acylcarnitine(C8:0) 4.3 287.21 288.217 Pos_006961 M+H Acylcarnitine(C8:0-OH) 3.3 303.205 304.212 Pos_007277 M+H Acylcarnitine(C8:1) 3.7 285.194 286.201 Pos_006936 M+H Acylcarnitine(C9:1) 4.3 299.209 300.217 Pos_076614 M+H AcylCoA(C16:0) 7.3 1005.343 1006.351 Pos_325108 M+H AcylCoA(C18:1) 7.3 1031.359 1032.367 Pos_028714 M+H AcylCoA(C20:4) 7.3 1053.344 1054.351 Pos_029335 M+H CE(a-18:2) 11.3 648.585 671.574 Pos_016729 M+Na CE(a-20:4) 11.3 672.584 695.573 Pos_017493 M+Na CE(a-22:6) 11.3 696.584 719.574 Pos_018179 M+Na Cholesterol 9.5 386.355 369.351 Pos_008747 M+H-H2O Coenzyme Q10 11.2 862.685 880.718 Pos_023780 M+NH4 Coenzyme Q10 (Reductive) 11 864.698 882.732 Pos_023845 M+NH4 Coenzyme Q4 7.4 454.308 472.342 Pos_011135 M+NH4 Coenzyme Q4 (Reductive) 7.5 456.324 474.357 Pos_145392 M+NH4 Coenzyme Q6 9.4 590.431 608.464 Pos_014587 M+NH4 Coenzyme Q8 (Reductive) 10.2 728.572 746.605 Pos_018993 M+NH4 Coenzyme Q9 11 794.621 812.655 Pos_021301 M+NH4 Coenzyme Q9 (Reductive) 10.8 796.636 814.67 Pos_021379 M+NH4 DG(aa-34:0) 10.6 596.537 614.571 Pos_014826 M+NH4 DG(aa-34:1) 10.4 594.522 612.555 Pos_014756 M+NH4 DG(aa-34:2) 10.3 592.506 610.54 Pos_014678 M+NH4 DG(aa-36:1) 10.6 622.553 640.587 Pos_015701 M+NH4 DG(aa-36:2) 10.5 620.537 638.571 Pos_015645 M+NH4 DG(aa-36:3) 10.4 618.521 636.555 Pos_015584 M+NH4 DG(aa-36:4) 10.2 616.506 634.54 Pos_015523 M+NH4 DG(aa-37:1) 10.7 636.569 654.603 Pos_016203 M+NH4 DG(aa-38:1) 10.8 650.585 668.618 Pos_016647 M+NH4 DG(aa-38:2) 10.7 648.569 666.603 Pos_016585 M+NH4 DG(aa-38:3) 10.6 646.552 664.586 Pos_016525 M+NH4 DG(aa-38:4) 10.4 644.537 662.571 Pos_016454 M+NH4 DG(aa-38:5) 10.3 642.521 660.555 Pos_016384 M+NH4 DG(aa-38:6) 10.3 640.505 658.539 Pos_016325 M+NH4 DG(aa-39:1) 10.9 664.6 682.634 Pos_017074 M+NH4 DG(aa-39:2) 10.8 662.585 680.619 Pos_017023 M+NH4 DG(aa-39:4) 10.6 658.552 676.586 Pos_226968 M+NH4 DG(aa-40:1) 10.9 678.615 696.649 Pos_017518 M+NH4 DG(aa-40:2) 10.8 676.6 694.634 Pos_017475 M+NH4 DG(aa-40:3) 10.7 674.584 692.618 Pos_017420 M+NH4 DG(aa-40:4) 10.6 672.568 690.602 Pos_017361 M+NH4 DG(aa-40:5) 10.5 670.553 688.587 Pos_017301 M+NH4 DG(aa-40:6) 10.4 668.538 686.571 Pos_230539 M+NH4 DG(aa-42:1) 11.1 706.647 724.681 Pos_018324 M+NH4 DG(aa-42:2) 11 704.632 722.665 Pos_018267 M+NH4 DG(aa-42:3) 10.9 702.615 720.649 Pos_018214 M+NH4 DG(aa-42:4) 10.8 700.599 718.633 Pos_018158 M+NH4 DG(aa-42:5) 10.7 698.584 716.618 Pos_018094 M+NH4 DG(aa-44:2) 11.1 732.662 750.696 Pos_019109 M+NH4 DG(aa-44:4) 11 728.631 746.665 Pos_018999 M+NH4 DG(aa-44:5) 10.8 726.616 744.65 Pos_018925 M+NH4 DG(ae-34:1) 10.6 580.542 598.576 Pos_014262 M+NH4 DG(ae-34:2) 10.6 578.527 596.561 Pos_014212 M+NH4 DG(ae-36:1) 10.8 608.573 626.607 Pos_015223 M+NH4 DG(ae-36:2)-1 10.8 606.557 624.591 Pos_015160 M+NH4 DG(ae-36:2)-2 10.7 606.557 624.591 Pos_015159 M+NH4 DG(ae-36:3) 10.6 604.543 622.577 Pos_015104 M+NH4 DG(ae-38:1) 10.9 636.605 654.639 Pos_016206 M+NH4 DG(ae-38:2)-1 10.9 634.589 652.623 Pos_016154 M+NH4 DG(ae-38:2)-2 10.8 634.589 652.623 Pos_016153 M+NH4 DG(ae-38:3) 10.8 632.575 650.609 Pos_016086 M+NH4 DG(ae-38:5) 10.6 628.542 646.576 Pos_015906 M+NH4 DG(ae-38:6) 10.5 626.525 644.559 Pos_215425 M+NH4 DG(ae-40:2) 11 662.621 680.655 Pos_017025 M+NH4 DG(ae-40:3)-1 10.9 660.606 678.64 Pos_016955 M+NH4 DG(ae-40:3)-2 10.9 660.606 678.64 Pos_016954 M+NH4 DG(ae-40:4) 10.8 658.591 676.625 Pos_016893 M+NH4 DG(ae-40:5) 10.8 656.573 674.607 Pos_016832 M+NH4 DG(ae-40:6) 10.6 654.559 672.592 Pos_016763 M+NH4 DG(ae-40:7) 10.6 652.544 670.578 Pos_224729 M+NH4 DG(ae-42:5) 10.9 684.605 702.638 Pos_017702 M+NH4 DG(ae-42:6) 10.8 682.589 700.623 Pos_017630 M+NH4 DHSM(14:0) 9.6 676.553 677.56 Pos_016912 M+H DHSM(15:0) 9.7 690.566 691.574 Pos_017393 M+H DHSM(16:0) 9.9 704.583 705.59 Pos_017794 M+H DHSM(18:0) 10.1 732.614 733.621 Pos_018606 M+H DHSM(20:0) 10.3 760.644 761.651 Pos_019513 M+H DHSM(21:0) 10.4 774.662 775.669 Pos_261100 M+H DHSM(22:0) 10.5 788.677 789.685 Pos_020510 M+H Dolichol-16 11.7 1109.03 1127.064 Pos_031063 M+NH4 Dolichol-17 11.8 1177.092 1195.126 Pos_032483 M+NH4 Dolichol-18 11.9 1245.154 1263.188 Pos_033781 M+NH4 Dolichol-19 11.9 1313.218 1331.252 Pos_034830 M+NH4 Dolichol-20 12 1381.282 1399.316 Pos_035833 M+NH4 LPC(a-14:0)-1 7.1 467.301 468.308 Pos_011055 M+H LPC(a-14:0)-2 7 467.301 468.308 Pos_011054 M+H LPC(a-16:0)-1 7.7 495.331 496.338 Pos_011624 M+H LPC(a-16:0)-2 7.6 495.331 496.339 Pos_011623 M+H LPC(a-16:1)-1 7.3 493.316 494.323 Pos_011581 M+H LPC(a-16:1)-2 7.2 493.316 494.323 Pos_011580 M+H LPC(a-17:0)-1 7.9 509.348 510.355 Pos_161555 M+H LPC(a-17:0)-2 8 509.347 510.355 Pos_011916 M+H LPC(a-17:1)-1 7.5 507.333 508.34 Pos_160710 M+H LPC(a-17:1)-2 7.6 507.332 508.339 Pos_011867 M+H LPC(a-18:0)-1 8.2 523.362 524.369 Pos_012248 M+H LPC(a-18:0)-2 8.1 523.362 524.369 Pos_012247 M+H LPC(a-18:1)-1 7.8 521.347 522.354 Pos_012183 M+H LPC(a-18:1)-2 7.7 521.347 522.354 Pos_012182 M+H LPC(a-18:2)-1 7.5 519.331 520.338 Pos_012114 M+H LPC(a-18:2)-2 7.4 519.331 520.338 Pos_012113 M+H LPC(a-18:3) 7.2 517.315 518.323 Pos_164616 M+H LPC(a-19:0)-1 8.4 537.378 538.386 Pos_012629 M+H LPC(a-19:0)-2 8.3 537.378 538.386 Pos_012628 M+H LPC(a-19:1)-1 8 535.365 536.372 Pos_172377 M+H LPC(a-19:1)-2 8.1 535.363 536.371 Pos_012555 M+H LPC(a-20:0)-1 8.6 551.394 552.401 Pos_013030 M+H LPC(a-20:0)-2 8.5 551.394 552.401 Pos_013029 M+H LPC(a-20:1)-1 8.3 549.378 550.385 Pos_012962 M+H LPC(a-20:1)-2 8.2 549.378 550.385 Pos_012961 M+H LPC(a-20:2)-1 8 547.362 548.37 Pos_012905 M+H LPC(a-20:2)-2 7.9 547.362 548.37 Pos_012904 M+H LPC(a-20:3)-1 7.7 545.347 546.354 Pos_012841 M+H LPC(a-20:3)-2 7.6 545.347 546.355 Pos_012840 M+H LPC(a-20:4)-1 7.5 543.331 544.338 Pos_012782 M+H LPC(a-20:4)-2 7.4 543.331 544.338 Pos_012781 M+H LPC(a-20:5)-1 7.2 541.315 542.322 Pos_012727 M+H LPC(a-20:5)-2 7.1 541.315 542.322 Pos_012726 M+H LPC(a-21:0) 8.8 565.409 566.417 Pos_013403 M+H LPC(a-21:1) 8.5 563.392 564.4 Pos_013337 M+H LPC(a-22:0)-1 9 579.426 580.433 Pos_013792 M+H LPC(a-22:0)-2 8.8 579.424 580.431 Pos_013791 M+H LPC(a-22:1)-1 8.7 577.41 578.417 Pos_013742 M+H LPC(a-22:1)-2 8.6 577.41 578.417 Pos_013741 M+H LPC(a-22:2)-1 8.4 575.393 576.4 Pos_188800 M+H LPC(a-22:2)-2 8.3 575.393 576.4 Pos_188799 M+H LPC(a-22:3)-1 8.1 573.379 574.386 Pos_187982 M+H LPC(a-22:3)-2 8.2 573.377 574.384 Pos_187980 M+H LPC(a-22:4)-1 7.9 571.362 572.37 Pos_013571 M+H LPC(a-22:4)-2 7.9 571.362 572.37 Pos_013570 M+H LPC(a-22:5)-1 7.8 569.347 570.355 Pos_013511 M+H LPC(a-22:5)-2 7.7 569.347 570.354 Pos_013510 M+H LPC(a-22:6)-1 7.5 567.331 568.338 Pos_013448 M+H LPC(a-22:6)-2 7.4 567.331 568.338 Pos_013447 M+H LPC(a-23:0)-1 9.2 593.441 594.449 Pos_014156 M+H LPC(a-23:0)-2 9.1 593.442 594.449 Pos_014155 M+H LPC(a-23:1)-1 8.9 591.425 592.433 Pos_014088 M+H LPC(a-23:1)-2 8.8 591.426 592.433 Pos_014087 M+H LPC(a-24:0) 9.4 607.457 608.464 Pos_014587 M+H LPC(a-24:1) 9.1 605.441 606.448 Pos_014535 M+H LPC(a-24:2) 8.8 603.425 604.433 Pos_199880 M+H LPC(a-24:4) 8.3 599.394 600.401 Pos_014310 M+H LPC(a-24:5) 8.1 597.379 598.386 Pos_197478 M+H LPC(a-24:6) 7.9 595.361 596.368 Pos_014202 M+H LPC(a-25:0) 9.5 621.472 622.479 Pos_015096 M+H LPC(a-26:0) 9.6 635.489 636.496 Pos_212556 M+H LPC(a-26:1)-1 9.4 633.473 634.48 Pos_211802 M+H LPC(a-26:1)-2 9.4 633.472 634.48 Pos_015519 M+H LPC(a-28:0) 9.6 663.52 664.527 Pos_016518 M+H LPC(e-16:0) 7.9 481.351 482.359 Pos_011342 M+H LPC(e-18:0) 8.4 509.383 510.39 Pos_011922 M+H LPC(e-18:1)-1 8 507.368 508.375 Pos_011871 M+H LPC(e-18:1)-2 8.4 507.367 508.374 Pos_011870 M+H LPC(e-18:2) 8 505.352 506.359 Pos_011834 M+H LPC(e-20:0) 8.8 537.414 538.422 Pos_012630 M+H MG(a-16:0) 8.2 330.277 353.266 Pos_008394 M+Na MG(a-18:0) 8.7 358.308 381.297 Pos_009004 M+Na MG(a-18:1) 8.3 356.292 379.281 Pos_008959 M+Na MG(a-18:2) 8 354.276 377.266 Pos_008932 M+Na MG(a-20:2) 8.5 382.308 405.297 Pos_009600 M+Na MG(a-20:4) 8 378.277 401.266 Pos_009493 M+Na MG(a-22:4) 8.4 406.308 429.297 Pos_010176 M+Na MG(a-22:6) 8 402.277 425.266 Pos_010061 M+Na MG(a-24:1) 9.5 440.385 463.375 Pos_140197 M+Na MG(e-18:0) 8.9 344.328 367.317 Pos_102715 M+Na MG(e-18:1) 8.6 342.313 365.302 Pos_008639 M+Na MG(e-18:2) 8.6 340.297 363.286 Pos_101278 M+Na PC(aa-30:0) 9.8 705.53 706.537 Pos_017826 M+H PC(aa-30:1) 9.6 703.515 704.522 Pos_017754 M+H PC(aa-30:2) 9.4 701.5 702.508 Pos_017695 M+H PC(aa-31:0) 9.9 719.547 720.554 Pos_018206 M+H PC(aa-31:1) 9.7 717.531 718.538 Pos_018152 M+H PC(aa-31:2) 9.5 715.514 716.522 Pos_018081 M+H PC(aa-32:0) 10 733.562 734.569 Pos_018634 M+H PC(aa-32:1) 9.8 731.546 732.553 Pos_018565 M+H PC(aa-32:2) 9.7 729.53 730.537 Pos_018501 M+H PC(aa-32:3) 9.5 727.514 728.521 Pos_018435 M+H PC(aa-32:4) 9.4 725.5 726.507 Pos_018369 M+H PC(aa-33:0) 10.1 747.578 748.585 Pos_019047 M+H PC(aa-33:1) 10 745.563 746.57 Pos_018988 M+H PC(aa-33:2) 9.8 743.547 744.554 Pos_018920 M+H PC(aa-34:0) 10.3 761.593 762.6 Pos_019568 M+H PC(aa-34:1) 10.1 759.577 760.584 Pos_019475 M+H PC(aa-34:2) 9.9 757.56 758.568 Pos_019370 M+H PC(aa-34:3) 9.7 755.546 756.553 Pos_019288 M+H PC(aa-34:4) 9.5 753.53 754.537 Pos_019228 M+H PC(aa-34:5) 9.5 751.514 752.521 Pos_019158 M+H PC(aa-35:0) 10.4 775.609 776.616 Pos_020040 M+H PC(aa-35:1) 10.2 773.593 774.601 Pos_019958 M+H PC(aa-35:2) 10 771.577 772.584 Pos_019887 M+H PC(aa-35:5) 9.5 765.53 766.538 Pos_019699 M+H PC(aa-36:0) 10.4 789.623 790.631 Pos_020546 M+H PC(aa-36:1) 10.3 787.608 788.615 Pos_020471 M+H PC(aa-36:2) 10.2 785.593 786.6 Pos_020390 M+H PC(aa-36:3) 10 783.576 784.583 Pos_020313 M+H PC(aa-36:4) 9.9 781.56 782.568 Pos_020241 M+H PC(aa-36:5) 9.8 779.545 780.552 Pos_020178 M+H PC(aa-37:0) 10.6 803.642 804.649 Pos_021011 M+H PC(aa-37:1) 10.4 801.624 802.631 Pos_020930 M+H PC(aa-37:2) 10.3 799.608 800.615 Pos_020866 M+H PC(aa-37:4) 10 795.577 796.584 Pos_020734 M+H PC(aa-38:0) 10.6 817.657 818.664 Pos_021555 M+H PC(aa-38:1) 10.5 815.638 816.646 Pos_021463 M+H PC(aa-38:2) 10.4 813.624 814.631 Pos_021376 M+H PC(aa-38:3) 10.2 811.606 812.614 Pos_021298 M+H PC(aa-38:4) 10.2 809.591 810.598 Pos_021223 M+H PC(aa-38:5) 10 807.575 808.583 Pos_021151 M+H PC(aa-38:6) 9.9 805.56 806.567 Pos_021073 M+H PC(aa-38:7) 9.7 803.545 804.552 Pos_020994 M+H PC(aa-38:8) 9.6 801.529 802.537 Pos_020919 M+H PC(aa-39:3) 10.4 825.622 826.629 Pos_021848 M+H PC(aa-39:4) 10.3 823.608 824.615 Pos_021778 M+H PC(aa-39:6) 10 819.576 820.584 Pos_021616 M+H PC(aa-39:7) 9.9 817.56 818.568 Pos_021544 M+H PC(aa-39:8) 9.7 815.545 816.552 Pos_021455 M+H PC(aa-40:0) 10.8 845.687 846.694 Pos_022611 M+H PC(aa-40:1) 10.7 843.671 844.679 Pos_022535 M+H PC(aa-40:2) 10.5 841.653 842.661 Pos_022471 M+H PC(aa-40:3) 10.4 839.638 840.645 Pos_022397 M+H PC(aa-40:4) 10.3 837.622 838.629 Pos_022324 M+H PC(aa-40:5) 10.2 835.607 836.614 Pos_281341 M+H PC(aa-40:6) 10.1 833.592 834.599 Pos_022147 M+H PC(aa-40:7) 10 831.576 832.583 Pos_022065 M+H PC(aa-40:8) 9.8 829.561 830.568 Pos_021985 M+H PC(aa-40:9) 9.7 827.544 828.551 Pos_021910 M+H PC(aa-42:0) 10.9 873.718 874.726 Pos_023575 M+H PC(aa-42:1) 10.8 871.702 872.709 Pos_023471 M+H PC(aa-42:10) 9.8 853.561 854.569 Pos_022897 M+H PC(aa-42:11) 9.6 851.546 852.553 Pos_022833 M+H PC(aa-42:2) 10.7 869.686 870.693 Pos_023394 M+H PC(aa-42:3) 10.6 867.67 868.677 Pos_023329 M+H PC(aa-42:4) 10.5 865.653 866.661 Pos_023266 M+H PC(aa-42:5) 10.4 863.639 864.646 Pos_023205 M+H PC(aa-42:6) 10.3 861.623 862.63 Pos_023144 M+H PC(aa-42:7) 10.2 859.608 860.615 Pos_023080 M+H PC(aa-42:8) 10 857.593 858.6 Pos_023024 M+H PC(aa-42:9) 9.9 855.578 856.585 Pos_022957 M+H PC(aa-44:1) 11 899.735 900.742 Pos_024436 M+H PC(aa-44:10) 10 881.594 882.602 Pos_294248 M+H PC(aa-44:11) 9.9 879.578 880.585 Pos_293729 M+H PC(aa-44:12) 9.7 877.561 878.568 Pos_023706 M+H PC(aa-44:2) 10.8 897.716 898.724 Pos_024362 M+H PC(aa-44:6) 10.6 889.655 890.662 Pos_024093 M+H PC(aa-44:7) 10.4 887.64 888.648 Pos_024029 M+H PC(ae-32:0) 10.2 719.583 720.591 Pos_018210 M+H PC(ae-34:0) 10.4 747.614 748.621 Pos_019051 M+H PC(ae-34:1) 10.2 745.598 746.605 Pos_018993 M+H PC(ae-34:2) 10.2 743.583 744.59 Pos_018923 M+H PC(ae-34:5) 9.7 737.535 738.542 Pos_018754 M+H PC(ae-36:0) 10.6 775.644 776.652 Pos_020041 M+H PC(ae-36:1) 10.4 773.629 774.636 Pos_019960 M+H PC(ae-36:2) 10.4 771.614 772.622 Pos_019892 M+H PC(ae-36:3) 10.2 769.598 770.605 Pos_019832 M+H PC(ae-36:4) 10.1 767.582 768.589 Pos_019767 M+H PC(ae-36:7) 9.7 761.536 762.543 Pos_019562 M+H PC(ae-38:0) 10.7 803.675 804.682 Pos_021013 M+H PC(ae-38:2) 10.6 799.645 800.653 Pos_020871 M+H PC(ae-38:4) 10.3 795.614 796.621 Pos_020739 M+H PC(ae-38:5) 10.1 793.598 794.605 Pos_020685 M+H PC(ae-38:6) 10.1 791.581 792.589 Pos_020613 M+H PC(ae-38:7) 10 789.565 790.573 Pos_020536 M+H PC(ae-40:6) 10.3 819.613 820.62 Pos_021620 M+H SM(12:0) 9.2 646.503 647.511 Pos_216527 M+H SM(13:0) 9.3 660.518 661.525 Pos_016419 M+H SM(14:0) 9.5 674.536 675.543 Pos_016853 M+H SM(14:1) 9.3 672.519 673.526 Pos_016794 M+H SM(15:0) 9.6 688.551 689.558 Pos_017334 M+H SM(15:1) 9.4 686.536 687.543 Pos_017258 M+H SM(16:0) 9.8 702.566 703.573 Pos_017728 M+H SM(16:1) 9.5 700.551 701.558 Pos_017663 M+H SM(17:0) 9.9 716.582 717.59 Pos_018121 M+H SM(17:1) 9.7 714.567 715.574 Pos_018059 M+H SM(18:0) 10 730.598 731.606 Pos_018529 M+H SM(18:1) 9.8 728.583 729.59 Pos_018468 M+H SM(18:2) 9.6 726.567 727.574 Pos_018405 M+H SM(19:0) 10.1 744.615 745.622 Pos_018952 M+H SM(19:1) 10 742.6 743.607 Pos_018888 M+H SM(20:0) 10.3 758.63 759.637 Pos_019419 M+H SM(20:1) 10.1 756.615 757.622 Pos_019319 M+H SM(21:0) 10.4 772.646 773.654 Pos_019915 M+H SM(21:2) 10.1 768.616 769.623 Pos_259066 M+H SM(22:0) 10.4 786.661 787.668 Pos_020428 M+H SM(22:1) 10.3 784.646 785.653 Pos_020352 M+H SM(23:0) 10.5 800.676 801.683 Pos_020897 M+H SM(23:1) 10.4 798.661 799.668 Pos_020838 M+H SM(23:2) 10.2 796.645 797.652 Pos_268585 M+H SM(24:0) 10.6 814.69 815.698 Pos_021420 M+H SM(24:1) 10.5 812.674 813.682 Pos_021335 M+H SM(24:2) 10.3 810.659 811.667 Pos_021266 M+H SM(24:3) 10.2 808.644 809.651 Pos_021185 M+H SM(25:0) 10.7 828.708 829.715 Pos_021948 M+H SM(25:1) 10.6 826.692 827.699 Pos_278501 M+H SM(25:2) 10.4 824.675 825.683 Pos_277808 M+H SM(26:0) 10.8 842.722 843.73 Pos_022498 M+H SM(26:1) 10.6 840.707 841.715 Pos_283005 M+H SM(26:2) 10.5 838.69 839.697 Pos_022365 M+H Sphinganine-phosphate 7.4 381.264 382.272 Pos_108555 M+H TG(aaa-48:0) 11.4 806.734 824.767 Pos_021789 M+NH4 TG(aaa-48:1) 11.4 804.721 822.755 Pos_021711 M+NH4 TG(aaa-48:2) 11.3 802.705 820.739 Pos_021628 M+NH4 TG(aaa-48:3) 11.2 800.689 818.723 Pos_021556 M+NH4 TG(aaa-50:1) 11.4 832.75 850.784 Pos_022763 M+NH4 TG(aaa-50:2) 11.4 830.737 848.77 Pos_022683 M+NH4 TG(aaa-50:3) 11.3 828.719 846.753 Pos_022613 M+NH4 TG(aaa-50:4) 11.2 826.704 844.738 Pos_022540 M+NH4 TG(aaa-51:1) 11.5 846.768 864.802 Pos_023218 M+NH4 TG(aaa-51:2) 11.4 844.752 862.786 Pos_023154 M+NH4 TG(aaa-51:3) 11.3 842.736 860.77 Pos_023091 M+NH4 TG(aaa-51:4) 11.3 840.721 858.754 Pos_023032 M+NH4 TG(aaa-52:1) 11.5 860.783 878.817 Pos_023727 M+NH4 TG(aaa-52:2) 11.5 858.768 876.802 Pos_023660 M+NH4 TG(aaa-52:3) 11.4 856.751 874.785 Pos_023579 M+NH4 TG(aaa-52:4) 11.3 854.736 872.77 Pos_023474 M+NH4 TG(aaa-52:5) 11.2 852.719 870.753 Pos_023398 M+NH4 TG(aaa-52:6) 11.2 850.704 868.737 Pos_023331 M+NH4 TG(aaa-52:7) 11.1 848.688 866.722 Pos_023270 M+NH4 TG(aaa-52:8) 11.1 846.674 864.707 Pos_023211 M+NH4 TG(aaa-52:9) 11 844.658 862.692 Pos_023149 M+NH4 TG(aaa-53:10) 11.3 856.658 874.692 Pos_292264 M+NH4 TG(aaa-53:3) 11.4 870.767 888.801 Pos_024037 M+NH4 TG(aaa-53:6) 11.2 864.72 882.754 Pos_023846 M+NH4 TG(aaa-54:1) 11.6 888.816 906.85 Pos_024678 M+NH4 TG(aaa-54:2) 11.5 886.799 904.832 Pos_024594 M+NH4 TG(aaa-54:3) 11.5 884.781 902.815 Pos_024520 M+NH4 TG(aaa-54:4) 11.4 882.765 900.799 Pos_024437 M+NH4 TG(aaa-54:5) 11.3 880.749 898.783 Pos_024367 M+NH4 TG(aaa-54:6) 11.3 878.734 896.768 Pos_024296 M+NH4 TG(aaa-54:7) 11.2 876.719 894.753 Pos_024219 M+NH4 TG(aaa-54:8) 11.2 874.704 892.738 Pos_024151 M+NH4 TG(aaa-54:9) 11.1 872.688 890.722 Pos_024095 M+NH4 TG(aaa-55:4) 11.4 896.782 914.816 Pos_024957 M+NH4 TG(aaa-55:5) 11.4 894.766 912.8 Pos_024890 M+NH4 TG(aaa-55:6) 11.3 892.75 910.784 Pos_024822 M+NH4 TG(aaa-55:7) 11.3 890.735 908.768 Pos_024758 M+NH4 TG(aaa-56:1) 11.6 916.842 934.876 Pos_307747 M+NH4 TG(aaa-56:10) 11.1 898.705 916.738 Pos_025021 M+NH4 TG(aaa-56:11) 11.1 896.689 914.723 Pos_024952 M+NH4 TG(aaa-56:2) 11.6 914.831 932.865 Pos_025604 M+NH4 TG(aaa-56:3) 11.5 912.815 930.848 Pos_025529 M+NH4 TG(aaa-56:4) 11.5 910.797 928.831 Pos_025439 M+NH4 TG(aaa-56:5) 11.4 908.78 926.814 Pos_025370 M+NH4 TG(aaa-56:6) 11.4 906.767 924.801 Pos_305108 M+NH4 TG(aaa-56:7) 11.3 904.75 922.784 Pos_025214 M+NH4 TG(aaa-56:8) 11.3 902.734 920.768 Pos_025153 M+NH4 TG(aaa-56:9) 11.2 900.72 918.754 Pos_025089 M+NH4 TG(aaa-57:11) 11.1 910.705 928.739 Pos_306208 M+NH4 TG(aaa-57:7) 11.4 918.767 936.8 Pos_025718 M+NH4 TG(aaa-58:10) 11.2 926.734 944.768 Pos_025970 M+NH4 TG(aaa-58:11) 11.2 924.72 942.753 Pos_025899 M+NH4 TG(aaa-58:12) 11.1 922.704 940.738 Pos_025840 M+NH4 TG(aaa-58:4) 11.6 938.83 956.863 Pos_026370 M+NH4 TG(aaa-58:5) 11.5 936.813 954.847 Pos_026305 M+NH4 TG(aaa-58:6) 11.5 934.798 952.831 Pos_026240 M+NH4 TG(aaa-58:7) 11.4 932.779 950.813 Pos_026162 M+NH4 TG(aaa-58:8) 11.3 930.763 948.797 Pos_026096 M+NH4 TG(aaa-58:9) 11.3 928.749 946.783 Pos_026027 M+NH4 TG(aaa-60:10) 11.3 954.767 972.8 Pos_026849 M+NH4 TG(aaa-60:11) 11.3 952.75 970.784 Pos_316328 M+NH4 TG(aaa-60:12) 11.2 950.735 968.769 Pos_026734 M+NH4 TG(aaa-60:13) 11.2 948.72 966.754 Pos_026658 M+NH4 TG(aaa-60:7) 11.5 960.814 978.848 Pos_027039 M+NH4 TG(aaa-60:8) 11.4 958.797 976.831 Pos_026977 M+NH4 TG(aaa-60:9) 11.4 956.78 974.814 Pos_026921 M+NH4 TG(aaa-62:10) 11.4 982.798 1000.832 Pos_027772 M+NH4 TG(aaa-62:11) 11.4 980.781 998.815 Pos_027693 M+NH4 TG(aaa-62:13) 11.2 976.751 994.784 Pos_027566 M+NH4 TG(aaa-62:14) 11.2 974.735 992.769 Pos_027516 M+NH4 TG(aaa-62:9) 11.5 984.815 1002.849 Pos_324292 M+NH4 TG(aaa-64:14) 11.3 1002.767 1020.801 Pos_028369 M+NH4 TG(aaa-64:16) 11.2 998.736 1016.77 Pos_028274 M+NH4 TG(aaa-66:16) 11.2 1026.768 1044.802 Pos_029083 M+NH4 TG(aaa-66:18) 11.2 1022.737 1040.771 Pos_028956 M+NH4 METABOLITES_END #END