LMGL03011617 LIPID_MAPS_STRUCTURE_DATABASE 69 68 0 0 0 0 0 0 0 0999 V2000 20.7235 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9993 6.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2755 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5513 6.9793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8275 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8275 8.2329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4178 6.2554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5809 6.2554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8570 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8570 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1331 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1035 6.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7235 8.2322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3146 8.8234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3146 9.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0386 8.4053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4036 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6740 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9443 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2147 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4851 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7555 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0259 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2962 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5666 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8370 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1074 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3777 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6481 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9185 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1889 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4592 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7296 6.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.8369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3740 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6444 6.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9148 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1851 6.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4555 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7259 6.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9963 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2667 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5370 6.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8074 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0778 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3482 6.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6185 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8889 6.9793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1593 7.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5856 10.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8559 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1263 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3967 10.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6671 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9374 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2078 10.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4782 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7486 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0190 10.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2893 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5597 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8301 10.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1005 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3708 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6412 10.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9116 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1820 9.6596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4523 10.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7227 9.6596 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 2 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 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 2 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 > LMGL03011617 > TG 17:2(9Z,12Z)/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso6] > 1-(9Z,12Z-heptadecadienoyl)-2-(11Z-eicosenoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C62H102O6 > 942.77 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(17:2/20:1/22:6)[iso6]; TG(59:9); TG(17:2_20:1_22:6) > WDLBNXAXDZZRRD-BAXFFKCOSA-N > InChI=1S/C62H102O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-34-37-40-43-46-49-52-55-61(64)67-58-59(57-66-60(63)54-51-48-45-42-39-36-27-24-21-18-15-12-9-6-3)68-62(65)56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h7,10,15-16,18-19,24-29,31,33,37,40,46,49,59H,4-6,8-9,11-14,17,20-23,30,32,34-36,38-39,41-45,47-48,50-58H2,1-3H3/b10-7-,18-15-,19-16-,27-24-,28-25-,29-26-,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(CCCCCCCCC/C=C\CCCCCCCC)=O)COC(CCCCCCC/C=C\C/C=C\CCCC)=O > - > - > - > TG 59:9 > - > - > 9545578 > - > - > - > - > - > - > - $$$$