LMGL03014043 LIPID_MAPS_STRUCTURE_DATABASE 64 63 0 0 0 0 0 0 0 0999 V2000 19.8882 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1692 6.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4504 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7314 6.9654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0126 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0126 8.2102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5846 6.2465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7537 6.2465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0348 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0348 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3161 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2938 6.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8882 8.2095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4751 8.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4751 9.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1941 8.3813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5917 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8672 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1428 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4183 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6938 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9693 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2448 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5203 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7959 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0714 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3469 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6224 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8979 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1734 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4490 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7245 5.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5694 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8449 6.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1204 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3959 6.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6715 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9470 6.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2225 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4980 6.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7735 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0491 6.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3246 7.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7513 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0268 9.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3023 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5778 9.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8533 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1289 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4044 9.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6799 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9554 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2309 9.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5064 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7820 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0575 9.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3330 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6085 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8840 9.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1595 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4351 9.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7106 10.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9861 9.6267 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 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 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 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 12 34 1 0 0 0 0 34 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 1 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 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 M END > LMGL03014043 > TG 13:0/19:1(9Z)/22:4(7Z,10Z,13Z,16Z) [iso6] > 1-tridecanoyl-2-9Z-nonadecenoyl-3-(7Z,10Z,13Z,16Z-docosatetraenoyl)-sn-glycerol > C57H100O6 > 880.75 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(54:5); TG(13:0_19:1_22:4) > SBJFIDDTDVTAMQ-XEMMJBLJSA-N > InChI=1S/C57H100O6/c1-4-7-10-13-16-19-22-24-26-28-29-30-32-33-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-34-31-27-25-23-20-17-14-11-8-5-2/h16,19,24,26-27,29-31,33,35,54H,4-15,17-18,20-23,25,28,32,34,36-53H2,1-3H3/b19-16-,26-24-,30-29-,31-27-,35-33-/t54-/m1/s1 > C(OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCCCCCCC)=O)COC(CCCCCCCCCCCC)=O > - > - > - > TG 54:5 > - > - > 56937833 > - > - > - > - > - > - > - $$$$