LMGL03013097 LIPID_MAPS_STRUCTURE_DATABASE 68 67 0 0 0 0 0 0 0 0999 V2000 20.2977 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5734 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8494 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1250 6.9798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4010 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4010 8.2338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9919 6.2557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1549 6.2557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4307 5.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4307 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7067 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6769 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2977 8.2331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8890 8.8356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8890 9.6607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6132 8.4062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9770 5.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2472 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5174 5.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7876 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0578 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3280 5.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5981 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8683 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1385 5.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4087 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6789 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9491 5.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2193 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4895 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7597 5.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0298 6.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9472 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2173 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4875 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7577 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0279 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2981 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5683 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8385 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1087 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3789 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6491 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9192 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1894 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4596 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7298 7.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1598 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4300 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7002 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9704 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2405 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5107 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7809 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0511 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3213 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5915 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8617 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1319 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4021 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6723 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9424 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2126 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4828 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7530 10.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0232 9.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2934 10.0788 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 2 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 12 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 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 15 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 52 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 2 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 1 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 M END > LMGL03013097 > TG 18:4(6Z,9Z,12Z,15Z)/18:4(6Z,9Z,12Z,15Z)/22:1(11Z) [iso3] > 1,2-di-(6Z,9Z,12Z,15Z-octadecatetraenoyl)-3-11Z-docosenoyl-sn-glycerol > C61H100O6 > 928.75 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(58:9); TG(18:4_18:4_22:1) > WDFVIUMTBYCNRS-DKTAXDDLSA-N > InChI=1S/C61H100O6/c1-4-7-10-13-16-19-22-25-28-29-30-31-34-36-39-42-45-48-51-54-60(63)66-57-58(67-61(64)55-52-49-46-43-40-37-33-27-24-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-41-38-35-32-26-23-20-17-14-11-8-5-2/h8-9,11-12,17-18,20-21,26-27,29-30,32-33,38,40-41,43,58H,4-7,10,13-16,19,22-25,28,31,34-37,39,42,44-57H2,1-3H3/b11-8-,12-9-,20-17-,21-18-,30-29-,32-26-,33-27-,41-38-,43-40-/t58-/m1/s1 > C(OC(=O)CCCCCCCCC/C=C\CCCCCCCCCC)[C@]([H])(OC(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)=O > - > - > - > TG 58:9 > - > - > 56936887 > - > - > - > - > - > - > - $$$$