131763497 CDK 0427212326 61 60 0 0 0 0 0 0 0 0999 V2000 10.9383 1.9058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 0.2558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 0.6683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 1.4933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 -0.9818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 2.7308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0832 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7977 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -3.4568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 -3.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -4.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 -2.2193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -4.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 -1.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -5.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 -0.9818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9412 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -5.9319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 1.4933 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2239 0.6683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -6.7569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 -7.1694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -6.7569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -7.1694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -5.9319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -5.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -6.7569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -4.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -4.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.4568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 5.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 6.4434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 5.2059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 1.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 6.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 2.7308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 5.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 7.6809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 3.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 4.3808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 5.2059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 3.9683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 30 1 1 6 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 28 2 0 0 0 0 4 33 1 0 0 0 0 4 38 1 0 0 0 0 5 32 2 0 0 0 0 6 38 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 22 1 0 0 0 0 19 23 1 0 0 0 0 20 27 1 0 0 0 0 21 28 1 0 0 0 0 22 24 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 29 1 0 0 0 0 26 32 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 36 41 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 40 46 1 0 0 0 0 41 44 2 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 43 45 1 0 0 0 0 45 47 1 0 0 0 0 46 48 1 0 0 0 0 47 49 1 0 0 0 0 48 53 2 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 51 54 1 0 0 0 0 52 56 1 0 0 0 0 53 55 1 0 0 0 0 54 57 1 0 0 0 0 55 58 1 0 0 0 0 56 60 2 0 0 0 0 58 61 2 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 M END > CHEBI:171141 > TG(18:3(6Z,9Z,12Z)/14:0/20:2n6) > 2 > [(2R)-3-[(6Z,9Z,12Z)-octadeca-6,9,12-trienoyl]oxy-2-tetradecanoyloxypropyl] (11Z,14Z)-icosa-11,14-dienoate > C55H96O6 > 853.367 > 852.72069 > 0 > O(C(=O)CCCCCCCCCCCCC)[C@H](COC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC > InChI=1S/C55H96O6/c1-4-7-10-13-16-19-22-24-26-27-29-31-34-36-39-42-45-48-54(57)60-51-52(61-55(58)49-46-43-40-37-32-21-18-15-12-9-6-3)50-59-53(56)47-44-41-38-35-33-30-28-25-23-20-17-14-11-8-5-2/h16-17,19-20,24-26,28,33,35,52H,4-15,18,21-23,27,29-32,34,36-51H2,1-3H3/b19-16-,20-17-,26-24-,28-25-,35-33-/t52-/m0/s1 > FWLOAHZIIPEDQA-QLLQDTBKSA-N $$$$