LMGL03013351 LIPID_MAPS_STRUCTURE_DATABASE 56 55 0 0 0 0 0 0 0 0999 V2000 17.6446 7.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9295 6.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2147 7.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4997 6.9545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7849 7.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7849 8.1924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3427 6.2396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5163 6.2396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8015 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8015 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0867 6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0700 6.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6446 8.1917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2283 8.7865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2283 9.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9433 8.3627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3663 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6458 6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9253 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2048 6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4844 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7639 6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0434 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3229 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6024 6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8819 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1615 6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7205 6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3496 7.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6291 6.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9086 7.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1882 6.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4677 7.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7472 6.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0267 7.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3062 6.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5857 7.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8653 6.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5084 10.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7879 9.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0674 10.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3470 9.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6265 10.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9060 9.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1855 10.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4650 10.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7445 9.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0241 10.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3036 9.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5831 10.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8626 9.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1421 10.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4216 9.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7011 10.0139 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 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 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 12 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 34 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 15 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 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 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 M END > LMGL03013351 > TG 12:0/16:1(9Z)/18:1(9Z) [iso6] > 1-dodecanoyl-2-(9Z-hexadecenoyl)-3-(9Z-octadecenoyl)-sn-glycerol > C49H90O6 > 774.67 > Glycerolipids [GL] > Triradylglycerols [GL03] > Triacylglycerols [GL0301] > - > TG(46:2); TG(12:0_16:1_18:1) > MIEULIUWCBAVBF-XXVKYOKDSA-N > InChI=1S/C49H90O6/c1-4-7-10-13-16-19-21-23-24-26-27-30-33-36-39-42-48(51)54-45-46(44-53-47(50)41-38-35-32-29-18-15-12-9-6-3)55-49(52)43-40-37-34-31-28-25-22-20-17-14-11-8-5-2/h20,22-24,46H,4-19,21,25-45H2,1-3H3/b22-20-,24-23-/t46-/m1/s1 > C(OC(=O)CCCCCCC/C=C\CCCCCCCC)[C@]([H])(OC(CCCCCCC/C=C\CCCCCC)=O)COC(CCCCCCCCCCC)=O > - > - > - > TG 46:2 > - > SLM:000131225 > 56937141 > - > - > - > - > - > - > - $$$$