LMGL03013176 LIPID_MAPS_STRUCTURE_DATABASE 76 75 0 0 0 0 0 0 0 0999 V2000 23.3116 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5835 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8557 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1276 6.9901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3998 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3998 8.2506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.0042 6.2622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.1628 6.2622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4349 5.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4349 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7071 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6719 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3116 8.2498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9059 8.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9059 9.6848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6339 8.4239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9736 5.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2400 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5064 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7728 5.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0392 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3056 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5720 5.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8384 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1048 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3712 5.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6376 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9040 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1704 5.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4368 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7032 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9696 5.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2360 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5024 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7688 5.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0352 6.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9384 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2048 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4712 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7376 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0040 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2704 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5368 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8032 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0696 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3360 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6024 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8688 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1352 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4016 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6680 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9344 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2008 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4672 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7336 6.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 7.4093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1729 10.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4393 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7057 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9721 10.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2385 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5049 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7713 10.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0377 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3041 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5705 10.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8369 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1033 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3697 10.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6361 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9025 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1689 10.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4353 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7017 9.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9681 10.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2345 9.6850 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 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 12 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 45 46 2 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 49 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 15 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 70 71 2 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 2 0 0 0 0 74 75 1 0 0 0 0 75 76 1 0 0 0 0 M END > LMGL03013176 > TG 22:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso3] > 1-11Z-docosenoyl-2,3-di-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C69H108O6 > 1032.81 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(66:13); TG(22:1_22:6_22:6) > VGSXUHNWXAHLEL-JEPVMFCFSA-N > InChI=1S/C69H108O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h7,9-10,12,16,18-19,21,25,27-28,30,32,34-37,39,43,45-46,48,52,54-55,57,66H,4-6,8,11,13-15,17,20,22-24,26,29,31,33,38,40-42,44,47,49-51,53,56,58-65H2,1-3H3/b10-7-,12-9-,19-16-,21-18-,28-25-,30-27-,35-32-,37-34-,39-36-,46-43-,48-45-,55-52-,57-54-/t66-/m0/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(CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COC(CCCCCCCCC/C=C\CCCCCCCCCC)=O > - > - > - > TG 66:13 > - > - > 56936966 > - > - > - > - > - > - > - $$$$