LMGL03013626 LIPID_MAPS_STRUCTURE_DATABASE 64 63 0 0 0 0 0 0 0 0999 V2000 20.7464 7.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0212 6.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2963 7.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5711 6.9822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8462 7.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8462 8.2377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4403 6.2572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6022 6.2572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8772 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8772 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1523 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1212 6.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7464 8.2369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3384 8.8402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3384 9.6663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0635 8.4103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4217 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6910 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9603 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2296 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4989 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7683 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0376 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3069 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5762 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8455 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1148 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3841 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6534 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9228 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1921 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4614 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7307 6.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3906 7.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6599 6.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9292 7.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1986 6.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4679 7.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7372 6.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0065 7.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2758 6.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5451 7.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8144 6.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6083 10.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8776 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1469 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4163 10.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6856 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9549 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2242 10.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4935 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7628 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0321 10.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3014 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5707 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8401 10.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1094 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3787 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6480 10.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9173 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1866 9.6664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4559 10.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7252 9.6664 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 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 1 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 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 15 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 2 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 2 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 2 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 2 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 2 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 M END > LMGL03013626 > TG 12:0/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso6] > 1-dodecanoyl-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C57H92O6 > 872.69 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(54:9); TG(12:0_20:3_22:6) > QXHGADYOPFNRIJ-MFFJXUEPSA-N > InChI=1S/C57H92O6/c1-4-7-10-13-16-19-21-23-25-27-28-30-31-33-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-34-32-29-26-24-22-20-17-14-11-8-5-2/h7,10,16-17,19-20,23-26,28,30,32-35,41,44,54H,4-6,8-9,11-15,18,21-22,27,29,31,36-40,42-43,45-53H2,1-3H3/b10-7-,19-16-,20-17-,25-23-,26-24-,30-28-,34-32-,35-33-,44-41-/t54-/m1/s1 > C(OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)[C@]([H])(OC(CCCCCC/C=C\C/C=C\C/C=C\CCCCC)=O)COC(CCCCCCCCCCC)=O > - > - > - > TG 54:9 > - > SLM:000165964 > 56937416 > - > - > - > - > - > - > - $$$$