LMGL03012517 LIPID_MAPS_STRUCTURE_DATABASE 74 73 0 0 0 0 0 0 0 0999 V2000 22.2881 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5595 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8313 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1027 6.9914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3744 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3744 8.2528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9805 6.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1386 6.2631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4102 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4102 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6819 6.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6460 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2881 8.2521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.8829 8.8469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8829 9.6880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6113 8.4262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9479 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2138 6.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4797 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7456 6.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0115 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2774 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5433 6.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8092 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0751 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3410 6.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6069 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8728 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1387 6.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4046 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6705 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9364 6.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2023 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4682 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7341 6.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.8421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9120 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1779 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4438 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7097 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9756 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2415 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5074 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7733 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0392 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3051 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5710 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8369 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1028 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3687 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6346 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9005 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1664 6.9914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4323 7.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1494 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4153 9.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6812 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9471 9.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2130 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4789 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7448 9.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0107 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2766 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5425 9.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8084 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0743 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3402 9.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6061 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8720 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1379 9.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4038 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6697 10.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9356 9.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2015 10.1086 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 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 12 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 1 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 2 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 2 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 52 53 1 0 0 0 0 53 54 1 0 0 0 0 15 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 2 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 2 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 65 66 2 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 68 69 2 0 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 71 72 2 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 M END > LMGL03012517 > TG 20:3(8Z,11Z,14Z)/22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z) [iso3] > 1-(8Z,11Z,14Z-eicosatrienoyl)-2,3-di-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycerol > C67H104O6 > 1004.78 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(20:3/22:5/22:5)[iso3]; TG(64:13); TG(20:3_22:5_22:5) > QXXPDTYSISXVIP-YSCVZYEFSA-N > InChI=1S/C67H104O6/c1-4-7-10-13-16-19-22-25-28-31-33-36-39-42-45-48-51-54-57-60-66(69)72-63-64(62-71-65(68)59-56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)73-67(70)61-58-55-52-49-46-43-40-37-34-32-29-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-21,25-30,33-34,36-38,41-43,45-46,64H,4-6,9,12-15,22-24,31-32,35,39-40,44,47-63H2,1-3H3/b10-7-,11-8-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,36-33-,37-34-,41-38-,45-42-,46-43-/t64-/m1/s1 > C(OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)[C@]([H])(OC(CCCCC/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 > - > - > - > TG 64:13 > - > SLM:000258835 > 9546475 > - > - > - > - > - > - > - $$$$