LMGL03013438 LIPID_MAPS_STRUCTURE_DATABASE 61 60 0 0 0 0 0 0 0 0999 V2000 18.9417 7.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2206 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4998 7.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7787 6.9710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0579 7.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0579 8.2193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6372 6.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8039 6.2501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0830 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0830 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3622 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3370 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9417 8.2186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5303 8.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5303 9.6398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2512 8.3909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6358 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9092 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1827 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4562 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7296 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0031 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2765 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5500 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8234 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0969 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3704 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6438 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9173 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1907 6.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4642 5.8334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6105 7.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8840 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1575 7.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4309 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7044 7.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9778 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2513 7.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5247 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7982 7.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0717 6.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8043 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0778 9.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3512 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6247 9.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8981 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1716 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4451 9.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7185 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9920 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2654 9.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5389 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8123 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0858 9.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3593 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6327 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9062 9.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1796 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4531 9.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7265 10.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 9.6399 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 2 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 12 32 1 0 0 0 0 32 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 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 15 42 1 0 0 0 0 42 43 1 0 0 0 0 43 44 1 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 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 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 M END > LMGL03013438 > TG 12:0/17:2(9Z,12Z)/22:4(7Z,10Z,13Z,16Z) [iso6] > 1-dodecanoyl-2-(9Z,12Z-heptadecadienoyl)-3-(7Z,10Z,13Z,16Z-docosatetraenoyl)-sn-glycerol > C54H92O6 > 836.69 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(51:6); TG(12:0_17:2_22:4) > NONQDLLXGCCXDO-LURQGMSCSA-N > InChI=1S/C54H92O6/c1-4-7-10-13-16-19-21-23-25-26-27-28-29-31-32-35-38-41-44-47-53(56)59-50-51(49-58-52(55)46-43-40-37-34-18-15-12-9-6-3)60-54(57)48-45-42-39-36-33-30-24-22-20-17-14-11-8-5-2/h14,16-17,19,22-25,27-28,31-32,51H,4-13,15,18,20-21,26,29-30,33-50H2,1-3H3/b17-14-,19-16-,24-22-,25-23-,28-27-,32-31-/t51-/m1/s1 > C(OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)[C@]([H])(OC(CCCCCCC/C=C\C/C=C\CCCC)=O)COC(CCCCCCCCCCC)=O > - > - > - > TG 51:6 > - > - > 56937228 > - > - > - > - > - > - > - $$$$