131761525 CDK 0429211258 69 68 0 0 0 0 0 0 0 0999 V2000 13.7963 1.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 2.2688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 2.6813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 -0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 3.5063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 1.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 -2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 -3.5063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 -3.9188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 -4.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9383 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 -5.1564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3659 -5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6515 -6.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0804 -6.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6529 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7949 -5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2239 -5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 -6.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5094 -6.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3674 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7963 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -6.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0832 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7977 2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 2.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 3.5063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 3.9188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2267 4.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 5.1564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5122 5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7977 6.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0832 5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3688 6.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 5.1564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9398 4.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 5.1564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2253 5.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5108 6.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 43 1 0 0 0 0 1 46 1 0 0 0 0 2 44 1 0 0 0 0 2 47 1 0 0 0 0 3 45 1 0 0 0 0 3 50 1 0 0 0 0 4 43 2 0 0 0 0 5 44 2 0 0 0 0 6 50 2 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 17 21 1 0 0 0 0 18 22 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 25 1 0 0 0 0 23 27 1 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 25 29 1 0 0 0 0 26 30 1 0 0 0 0 27 33 1 0 0 0 0 28 34 1 0 0 0 0 29 37 1 0 0 0 0 30 38 1 0 0 0 0 31 43 1 0 0 0 0 32 44 1 0 0 0 0 33 39 1 0 0 0 0 34 40 1 0 0 0 0 35 39 2 0 0 0 0 36 40 2 0 0 0 0 37 41 1 0 0 0 0 38 42 1 0 0 0 0 41 48 1 0 0 0 0 42 49 1 0 0 0 0 45 46 1 0 0 0 0 45 47 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 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 M END > CHEBI:172295 > TG(20:1(11Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:1(11Z)) > 2 > [2-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]oxy-3-[(Z)-icos-11-enoyl]oxypropyl] (Z)-icos-11-enoate > C63H108O6 > 961.551 > 960.81459 > 0 > O(C(=O)CCCCCCCCC/C=C\CCCCCCCC)CC(OC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COC(=O)CCCCCCCCC/C=C\CCCCCCCC > InChI=1S/C63H108O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-61(64)67-58-60(69-63(66)57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)59-68-62(65)56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h9,12,18,21,25-30,36,39,45,48,60H,4-8,10-11,13-17,19-20,22-24,31-35,37-38,40-44,46-47,49-59H2,1-3H3/b12-9-,21-18-,28-25-,29-26-,30-27-,39-36-,48-45- > HOYRPNXXNBFEAZ-ZAMVXBHRSA-N $$$$