LMGL03012107 LIPID_MAPS_STRUCTURE_DATABASE 72 71 0 0 0 0 0 0 0 0999 V2000 21.7398 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0163 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2930 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5694 6.9777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8461 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8461 8.2304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4344 6.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5982 6.2544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8748 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8748 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1515 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1228 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7398 8.2297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3305 8.8204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3305 9.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0540 8.4026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4226 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6935 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9645 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2354 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5064 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7773 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0483 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3192 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5902 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8611 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1321 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4031 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6740 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9450 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2159 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4869 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7578 5.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0288 6.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3938 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6648 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9357 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2067 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4776 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7486 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0195 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2905 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5614 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8324 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1033 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3743 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6452 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9162 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1871 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4581 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 7.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6020 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8730 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1439 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4149 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6858 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9568 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2278 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4987 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7697 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0406 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3116 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5825 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8535 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1244 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3954 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6663 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9373 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2082 10.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4792 9.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7501 10.0735 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 2 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 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 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 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 1 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 M END > LMGL03012107 > TG 20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z)/22:1(13Z) [iso3] > 1,2-di-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-3-(13Z-docosenoyl)-sn-glycerol > C65H108O6 > 984.81 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(20:4/20:4/22:1)[iso3]; TG(62:9); TG(20:4_20:4_22:1) > DMYYJAVPABXKHA-WEFGPDTLSA-N > InChI=1S/C65H108O6/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/h17-18,20-21,25-30,36,38-39,41,45,47-48,50,62H,4-16,19,22-24,31-35,37,40,42-44,46,49,51-61H2,1-3H3/b20-17-,21-18-,28-25-,29-26-,30-27-,39-36-,41-38-,48-45-,50-47-/t62-/m1/s1 > C(OC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)[C@]([H])(OC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)COC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O > - > HMDB0051737 > - > TG 62:9 > - > SLM:000247086 > 9546068 > - > - > - > - > - > - > - $$$$