LMGL03012097 LIPID_MAPS_STRUCTURE_DATABASE 72 71 0 0 0 0 0 0 0 0999 V2000 21.7084 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9861 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2642 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5420 6.9740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8201 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8201 8.2243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4035 6.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5688 6.2520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8468 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8468 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1249 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0981 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7084 8.2236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.2979 8.8132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2979 9.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0200 8.3962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3973 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6697 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9420 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2143 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4866 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7590 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0313 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3036 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5759 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8482 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1206 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3929 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6652 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9375 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2099 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4822 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7545 6.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0268 5.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3705 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6428 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9152 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1875 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4598 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7321 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0044 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2768 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5491 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8214 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0937 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3661 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6384 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9107 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1830 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4554 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7277 6.9740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 7.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5708 10.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8431 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1155 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3878 10.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6601 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9324 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2048 10.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4771 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7494 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0217 10.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2940 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5664 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8387 10.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1110 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3833 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6557 10.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9280 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2003 9.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4726 10.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 9.6471 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 1 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 1 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 2 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 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 2 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 2 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 2 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 2 0 0 0 0 64 65 1 0 0 0 0 65 66 1 0 0 0 0 66 67 2 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 2 0 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 M END > LMGL03012097 > TG 20:1(11Z)/20:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z) [iso3] > 1,2-di-(11Z-eicosenoyl)-3-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycerol > C65H110O6 > 986.83 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(20:1/20:1/22:6)[iso3]; TG(62:8); TG(20:1_20:1_22:6) > OCBKCICVFBXZPA-OMHGWUAPSA-N > InChI=1S/C65H110O6/c1-4-7-10-13-16-19-22-25-28-31-32-35-37-40-43-46-49-52-55-58-64(67)70-61-62(71-65(68)59-56-53-50-47-44-41-38-34-30-27-24-21-18-15-12-9-6-3)60-69-63(66)57-54-51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h7,10,16,19,25-30,32,35,40,43,49,52,62H,4-6,8-9,11-15,17-18,20-24,31,33-34,36-39,41-42,44-48,50-51,53-61H2,1-3H3/b10-7-,19-16-,28-25-,29-26-,30-27-,35-32-,43-40-,52-49-/t62-/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(CCCCCCCCC/C=C\CCCCCCCC)=O)COC(CCCCCCCCC/C=C\CCCCCCCC)=O > - > - > - > TG 62:8 > - > SLM:000248945 > 9546058 > - > - > - > - > - > - > - $$$$