LMGL03014091 LIPID_MAPS_STRUCTURE_DATABASE 65 64 0 0 0 0 0 0 0 0999 V2000 20.7415 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0165 6.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2918 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5669 6.9816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8422 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8422 8.2366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4354 6.2568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5976 6.2568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8728 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8728 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1482 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1174 6.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7415 8.2359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.3333 8.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3333 9.6648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0582 8.4092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4178 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6873 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9569 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2264 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4960 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7655 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0351 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3046 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5741 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8437 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1132 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3828 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6523 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9218 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1914 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4609 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7305 6.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3870 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6566 6.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9261 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1957 6.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4652 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7348 6.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0043 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2738 6.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5434 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8129 6.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0825 7.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6034 10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8730 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1425 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4120 10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6816 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9511 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2207 10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4902 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7597 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0293 10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2988 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5684 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8379 10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1075 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3770 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6465 10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9161 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1856 9.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4552 10.0833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7247 9.6649 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 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 1 0 0 0 0 44 45 1 0 0 0 0 15 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 2 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 2 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 2 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 2 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 2 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 2 0 0 0 0 63 64 1 0 0 0 0 64 65 1 0 0 0 0 M END > LMGL03014091 > TG 13:0/20:3(8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso6] > 1-tridecanoyl-2-(8Z,11Z,14Z-eicosatrienoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C58H94O6 > 886.71 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(55:9); TG(13:0_20:3_22:6) > MQJSRJLYYUXOOK-XSUKWBRQSA-N > InChI=1S/C58H94O6/c1-4-7-10-13-16-19-22-24-26-28-29-31-32-34-36-39-42-45-48-51-57(60)63-54-55(53-62-56(59)50-47-44-41-38-21-18-15-12-9-6-3)64-58(61)52-49-46-43-40-37-35-33-30-27-25-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,24-27,29,31,33-36,42,45,55H,4-6,8-9,11-15,18,21-23,28,30,32,37-41,43-44,46-54H2,1-3H3/b10-7-,19-16-,20-17-,26-24-,27-25-,31-29-,35-33-,36-34-,45-42-/t55-/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(CCCCCC/C=C\C/C=C\C/C=C\CCCCC)=O)COC(CCCCCCCCCCCC)=O > - > - > - > TG 55:9 > - > SLM:000174910 > 56937881 > - > - > - > - > - > - > - $$$$