LMGL03012106 LIPID_MAPS_STRUCTURE_DATABASE 72 71 0 0 0 0 0 0 0 0999 V2000 21.7401 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0165 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2932 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5696 6.9778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8463 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8463 8.2304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4346 6.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5984 6.2544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8750 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8750 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1517 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1229 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7401 8.2297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3307 8.8205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3307 9.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0542 8.4027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4228 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6937 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9646 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2356 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5065 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7775 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0484 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3194 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5903 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8612 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1322 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4031 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6741 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9450 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4869 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7578 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0288 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3940 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6649 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9359 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2068 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4777 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7487 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0196 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2906 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5615 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8325 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1034 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3743 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6453 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9162 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1872 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4581 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7291 6.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6023 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8732 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1441 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4151 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6860 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9570 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2279 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4989 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7698 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0407 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3117 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5826 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8536 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1245 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3955 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6664 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9373 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2083 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4792 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7502 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 6 0 0 0 2 7 1 1 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 1 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 11 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 12 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 2 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 2 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 15 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 2 0 0 0 0 64 65 1 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 M END > LMGL03012106 > TG 20:3(8Z,11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:1(13Z) [iso6] > 1-(8Z,11Z,14Z-eicosatrienoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(13Z-docosenoyl)-sn-glycerol > C65H108O6 > 984.81 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(20:3/20:5/22:1)[iso6]; TG(62:9); TG(20:3_20:5_22:1) > KBZBXHUOEHHGBE-DLKWIREBSA-N > InChI=1S/C65H108O6/c1-4-7-10-13-16-19-22-25-28-31-32-35-37-40-43-46-49-52-55-58-64(67)70-61-62(71-65(68)59-56-53-50-47-44-41-38-34-30-27-24-21-18-15-12-9-6-3)60-69-63(66)57-54-51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h9,12,17-18,20-21,25-30,36,38-39,41,47,50,62H,4-8,10-11,13-16,19,22-24,31-35,37,40,42-46,48-49,51-61H2,1-3H3/b12-9-,20-17-,21-18-,28-25-,29-26-,30-27-,39-36-,41-38-,50-47-/t62-/m1/s1 > C(OC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)[C@]([H])(OC(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCCCCC/C=C\C/C=C\C/C=C\CCCCC)=O > - > HMDB0051855 > - > TG 62:9 > - > SLM:000247046 > 9546067 > - > - > - > - > - > - > - $$$$