LMGL03012296 LIPID_MAPS_STRUCTURE_DATABASE 72 71 0 0 0 0 0 0 0 0999 V2000 21.8360 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1082 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3808 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6531 6.9891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9256 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9256 8.2489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5287 6.2616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6877 6.2616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9602 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9602 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.2328 6.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1981 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8360 8.2482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.4300 8.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4300 9.6825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1576 8.4222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4996 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7664 6.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0332 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2999 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5667 6.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8335 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1002 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3670 6.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6338 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9005 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1673 6.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4341 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7008 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9676 6.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2344 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5011 6.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7679 5.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0347 6.2616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4650 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7317 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9985 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2653 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5320 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7988 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0656 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3323 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5991 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8659 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1326 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3994 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6662 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9329 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1997 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4665 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7332 7.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6974 10.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9641 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2309 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4977 10.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7644 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0312 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2980 10.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5647 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8315 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0983 10.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3650 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6318 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8986 10.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1653 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4321 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6989 10.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9656 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2324 9.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4992 10.1026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7659 9.6826 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 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 2 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 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 15 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 2 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 2 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 2 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 2 0 0 0 0 64 65 1 0 0 0 0 65 66 1 0 0 0 0 66 67 2 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 2 0 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 M END > LMGL03012296 > TG 20:2(11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso6] > 1-(11Z,14Z-eicosadienoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C65H102O6 > 978.77 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(20:2/20:4/22:6)[iso6]; TG(62:12); TG(20:2_20:4_22:6) > WJUAWPOIGFVUDB-PGCFIPJPSA-N > InChI=1S/C65H102O6/c1-4-7-10-13-16-19-22-25-28-31-32-35-37-40-43-46-49-52-55-58-64(67)70-61-62(71-65(68)59-56-53-50-47-44-41-38-34-30-27-24-21-18-15-12-9-6-3)60-69-63(66)57-54-51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h7,10,16-21,25-30,32,35,38,40-41,43,47,49-50,52,62H,4-6,8-9,11-15,22-24,31,33-34,36-37,39,42,44-46,48,51,53-61H2,1-3H3/b10-7-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,35-32-,41-38-,43-40-,50-47-,52-49-/t62-/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\CCCCC)=O)COC(CCCCCCCCC/C=C\C/C=C\CCCCC)=O > - > - > - > TG 62:12 > - > SLM:000242046 > 9546256 > - > - > - > - > - > - > - $$$$