LMGL03011688 LIPID_MAPS_STRUCTURE_DATABASE 68 67 0 0 0 0 0 0 0 0999 V2000 20.8238 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0950 6.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3666 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6378 6.9919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9093 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9093 8.2536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5161 6.2634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6740 6.2634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9454 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9454 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2169 6.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1808 6.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8238 8.2529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4187 8.8478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4187 9.6892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1474 8.4270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4827 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7485 6.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0142 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2799 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5456 6.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8113 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0771 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3428 6.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6085 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8742 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1400 6.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4057 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6714 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9371 6.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2028 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4686 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7343 6.2634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4466 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7123 6.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9780 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2438 6.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5095 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7752 6.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0409 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3066 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5724 6.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8381 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1038 6.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3695 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6352 6.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 7.4115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6850 10.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9507 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2165 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4822 10.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7479 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0136 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2793 10.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5451 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8108 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0765 10.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3422 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6079 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8737 10.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1394 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4051 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6708 10.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9366 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2023 9.6893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 10.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7337 9.6893 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 2 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 2 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 2 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 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 2 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 2 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 2 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 M END > LMGL03011688 > TG 16:1(9Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso6] > 1-(9Z-hexadecenoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C61H94O6 > 922.71 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(16:1/20:5/22:6)[iso6]; TG(58:12); TG(16:1_20:5_22:6) > HNCPGOHTEDAEBH-HSEHMXJJSA-N > InChI=1S/C61H94O6/c1-4-7-10-13-16-19-22-25-27-29-30-32-33-36-39-42-45-48-51-54-60(63)66-57-58(56-65-59(62)53-50-47-44-41-38-35-24-21-18-15-12-9-6-3)67-61(64)55-52-49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h7-8,10-11,16-17,19-21,24-28,30,32,34,36-37,39,43,45-46,48,58H,4-6,9,12-15,18,22-23,29,31,33,35,38,40-42,44,47,49-57H2,1-3H3/b10-7-,11-8-,19-16-,20-17-,24-21-,27-25-,28-26-,32-30-,37-34-,39-36-,46-43-,48-45-/t58-/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(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCCCCCC/C=C\CCCCCC)=O > - > - > - > TG 58:12 > - > SLM:000200435 > 9545649 > - > - > - > - > - > - > - $$$$