LMGL03011761 LIPID_MAPS_STRUCTURE_DATABASE 69 68 0 0 0 0 0 0 0 0999 V2000 21.3880 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6667 6.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9457 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2244 6.9715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5035 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5035 8.2201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0835 6.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2499 6.2504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5289 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5289 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8079 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7824 6.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3880 8.2194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9767 8.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9767 9.6410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6979 8.3918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0812 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3545 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6278 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9010 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1743 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4476 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7208 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9941 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2674 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5406 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8139 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0871 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3604 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6337 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9069 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1802 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4535 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7267 6.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.8336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0557 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3290 6.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6023 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8755 6.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1488 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4221 6.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6953 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9686 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2419 6.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5151 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7884 6.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0616 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3349 6.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6082 7.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2506 10.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5239 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7971 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0704 10.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3437 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6169 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8902 10.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1635 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4367 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7100 10.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9833 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2565 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5298 10.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8031 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0763 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3496 10.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6228 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8961 9.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1694 10.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4426 9.6411 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 1 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 33 34 1 0 0 0 0 34 35 1 0 0 0 0 12 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 2 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 48 49 1 0 0 0 0 15 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 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 M END > LMGL03011761 > TG 16:1(9Z)/21:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso6] > 1-(9Z-hexadecenoyl)-2-heneicosanoyl-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C62H106O6 > 946.80 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(16:1/21:0/22:6)[iso6]; TG(59:7); TG(16:1_21:0_22:6) > LEHDADZUUFGJKL-BNGRJBPKSA-N > InChI=1S/C62H106O6/c1-4-7-10-13-16-19-22-25-27-29-31-33-34-37-40-43-46-49-52-55-61(64)67-58-59(57-66-60(63)54-51-48-45-42-39-36-24-21-18-15-12-9-6-3)68-62(65)56-53-50-47-44-41-38-35-32-30-28-26-23-20-17-14-11-8-5-2/h7,10,16,19,21,24-25,27,31,33,37,40,46,49,59H,4-6,8-9,11-15,17-18,20,22-23,26,28-30,32,34-36,38-39,41-45,47-48,50-58H2,1-3H3/b10-7-,19-16-,24-21-,27-25-,33-31-,40-37-,49-46-/t59-/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(CCCCCCCCCCCCCCCCCCCC)=O)COC(CCCCCCC/C=C\CCCCCC)=O > - > - > - > TG 59:7 > - > SLM:000218947 > 9545722 > - > - > - > - > - > - > - $$$$