LMGL03012094 LIPID_MAPS_STRUCTURE_DATABASE 70 69 0 0 0 0 0 0 0 0999 V2000 20.8431 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1134 6.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3841 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6544 6.9944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9251 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9251 8.2575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5350 6.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6918 6.2649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9624 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9624 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2330 6.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1956 6.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8431 8.2568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4387 8.8525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4387 9.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1682 8.4312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4980 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7628 6.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0276 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2924 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5573 6.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8221 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0869 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3517 6.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6166 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8814 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1462 6.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4110 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6759 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9407 6.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2055 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4703 6.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7352 5.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 6.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4605 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7254 6.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9902 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2550 6.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5198 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7847 6.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0495 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3143 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5792 6.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8440 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1088 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3736 6.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6385 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9033 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1681 6.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4329 7.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7041 10.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9690 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2338 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4986 10.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7634 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0283 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2931 10.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5579 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8227 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0876 10.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3524 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6172 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8820 10.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1469 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4117 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6765 10.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9413 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2062 9.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 10.1161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7358 9.6950 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 2 0 0 0 0 45 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 15 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 2 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 > LMGL03012094 > TG 18:3(9Z,12Z,15Z)/20:4(5Z,8Z,11Z,14Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso6] > 1-(9Z,12Z,15Z-octadecatrienoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C63H96O6 > 948.72 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(18:3/20:4/22:6)[iso6]; TG(60:13); TG(18:3_20:4_22:6) > OWHDLPOTIQFXOJ-MZDQWQRGSA-N > InChI=1S/C63H96O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-34-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16-21,25-29,31,33-34,36,38-39,41,45,47-48,50,60H,4-6,8,11,13-15,22-24,30,32,35,37,40,42-44,46,49,51-59H2,1-3H3/b10-7-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,33-31-,34-27-,39-36-,41-38-,48-45-,50-47-/t60-/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(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)COC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O > - > HMDB10516 > - > TG 60:13 > - > SLM:000220113 > 9546055 > - > - > - > - > - > - > - $$$$