LMGL03011231 LIPID_MAPS_STRUCTURE_DATABASE 67 66 0 0 0 0 0 0 0 0999 V2000 19.5730 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8484 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1241 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3995 6.9805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6753 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6753 8.2349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.2671 6.2561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4297 6.2561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7054 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7054 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9811 6.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9509 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5730 8.2342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1645 8.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1645 9.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8889 8.4074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2511 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5210 6.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7910 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0609 6.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3309 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6008 6.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8707 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1407 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4106 6.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6805 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9505 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2204 6.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4903 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7603 6.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0302 5.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3001 6.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2209 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4908 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7608 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0307 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3006 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5706 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8405 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1105 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3804 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6503 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9203 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1902 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4601 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7301 7.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4350 10.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7049 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9749 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2448 10.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5147 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7847 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0546 10.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3246 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5945 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8644 10.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1344 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4043 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6742 10.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9442 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2141 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4840 10.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0239 9.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2938 10.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5638 9.6624 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 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 1 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 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 15 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 64 65 2 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 M END > LMGL03011231 > TG 17:1(9Z)/18:2(9Z,12Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso6] > 1-(9Z-heptadecenoyl)-2-(9Z,12Z-octadecadienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C60H98O6 > 914.74 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(17:1/18:2/22:6)[iso6]; TG(57:9); TG(17:1_18:2_22:6) > - > - > - > - > - > - > - > - > - > 9545192 > - > - > Active (generated by computational methods) > - > https://www.lipidmaps.org/databases/lmsd/LMGL03011231 $$$$