LMGL03016053 LIPID_MAPS_STRUCTURE_DATABASE 69 68 0 0 0 0 0 0 0 0999 V2000 20.6302 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9104 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1908 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4709 6.9676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7514 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7514 8.2138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3263 6.2479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4944 6.2479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7748 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7748 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0552 6.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0317 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6302 8.2131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2178 8.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2178 9.6318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9376 8.3851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3300 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6047 6.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8794 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1541 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4288 6.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7035 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9782 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2530 6.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5277 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8024 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0771 6.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3518 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6265 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9012 6.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1759 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4506 6.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7253 5.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3065 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5813 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8560 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1307 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4054 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6801 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9548 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2295 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5042 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7789 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0536 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3283 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6030 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8777 7.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1524 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4931 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7678 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0425 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3172 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5919 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8666 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1413 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4160 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6907 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9655 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2402 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5149 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7896 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0643 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3390 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6137 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8884 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1631 10.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4378 9.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7125 10.0473 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 2 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 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 1 0 0 0 0 52 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 2 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 1 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 M END > LMGL03016053 > TG 17:1(9Z)/20:4(5Z,8Z,11Z,14Z)/22:1(11Z) [iso6] > 1-(9Z-heptadecenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-3-11Z-docosenoyl-sn-glycerol > C62H108O6 > 948.81 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(59:6); TG(17:1_20:4_22:1) > RPMWQLGOUBVXEN-TWXJQWGTSA-N > InChI=1S/C62H108O6/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/h17,20,24,26-27,29-31,35,38,44,47,59H,4-16,18-19,21-23,25,28,32-34,36-37,39-43,45-46,48-58H2,1-3H3/b20-17-,27-24-,29-26-,31-30-,38-35-,47-44-/t59-/m1/s1 > C(OC(=O)CCCCCCCCC/C=C\CCCCCCCCCC)[C@]([H])(OC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)COC(CCCCCCC/C=C\CCCCCCC)=O > - > - > - > TG 59:6 > - > - > 56939835 > - > - > - > - > - > - > - $$$$