LMGL03011841 LIPID_MAPS_STRUCTURE_DATABASE 70 69 0 0 0 0 0 0 0 0999 V2000 21.8479 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1196 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3917 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6634 6.9905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9355 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9355 8.2512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5404 6.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6988 6.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9708 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9708 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.2428 6.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2074 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8479 8.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.4423 8.8451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4423 9.6858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1705 8.4246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5092 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7754 6.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0417 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3079 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5742 6.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8404 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1067 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3729 6.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6392 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9054 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1717 6.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4379 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7042 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9704 6.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2367 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5029 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7692 6.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0354 5.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4738 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7400 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0063 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2725 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5388 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8050 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0713 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3375 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6038 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8700 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1363 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4025 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6688 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2013 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4675 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7338 7.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.9905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7092 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9754 9.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2417 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5079 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7742 9.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0404 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3067 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5729 9.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8391 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1054 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3716 9.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6379 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9041 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1704 9.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4366 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7029 10.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9691 9.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2354 10.1062 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 2 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 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 2 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 2 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 2 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 67 68 2 0 0 0 0 68 69 1 0 0 0 0 69 70 1 0 0 0 0 M END > LMGL03011841 > TG 20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z) [iso3] > 1-(11Z,14Z-eicosadienoyl)-2,3-di-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycerol > C63H98O6 > 950.74 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(20:2/20:5/20:5)[iso3]; TG(60:12); TG(20:2_20:5_20:5) > XGTYDUCKGKNUMU-QOHVUHRCSA-N > InChI=1S/C63H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-61(64)67-58-60(69-63(66)57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-30,34,36-37,39,43,45-46,48,60H,4-6,8,11,13-15,22-24,31-33,35,38,40-42,44,47,49-59H2,1-3H3/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,37-34-,39-36-,46-43-,48-45-/t60-/m0/s1 > C(OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)[C@]([H])(OC(CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCCCCCCCC/C=C\C/C=C\CCCCC)=O > - > - > - > TG 60:12 > - > SLM:000221683 > 9545802 > - > - > - > - > - > - > - $$$$