131756717 CDK 0429211258 69 68 0 0 0 0 0 0 0 0999 V2000 8.7947 2.0130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2236 3.6630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5092 0.7755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0802 3.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9381 2.4255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3658 4.4880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2223 -4.9995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2223 -4.1745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -5.4120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 -3.7620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -6.2370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 -2.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7934 -6.6495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6513 -2.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7934 -7.4745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6513 -1.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -7.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3658 -1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -8.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3658 -0.4620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -9.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0802 -0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -9.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0802 0.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5105 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2250 3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7960 3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9394 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0815 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -10.3620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6539 3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3671 3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7947 1.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3684 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6526 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5092 3.2505 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5092 2.4255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0828 3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9381 3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7973 4.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5117 4.9005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7973 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7947 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5117 5.7255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2263 6.1380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2263 6.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9407 7.3755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3658 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6513 3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2223 3.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 3.6630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 4.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7934 4.9005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7934 5.7255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 6.1380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 6.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2223 7.3755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 6.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6513 7.3755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6513 8.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 8.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 9.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2223 9.8505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 9.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7934 9.8505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 9.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 8.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 8.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 1 37 1 0 0 0 0 36 2 1 1 0 0 0 2 39 1 0 0 0 0 3 33 2 0 0 0 0 4 43 1 0 0 0 0 4 48 1 0 0 0 0 5 39 2 0 0 0 0 6 48 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 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 23 30 1 0 0 0 0 24 33 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 28 31 1 0 0 0 0 29 32 1 0 0 0 0 31 34 1 0 0 0 0 32 35 1 0 0 0 0 34 38 1 0 0 0 0 35 39 1 0 0 0 0 36 37 1 0 0 0 0 36 43 1 0 0 0 0 38 42 2 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 41 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 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 2 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:172305 > TG(20:0/18:1(11Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) > 2 > [(2S)-3-icosanoyloxy-2-[(Z)-octadec-11-enoyl]oxypropyl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate > C63H108O6 > 961.551 > 960.81459 > 0 > O(C(=O)CCCCCCCCCCCCCCCCCCC)C[C@H](OC(=O)CCCCCCCCC/C=C\CCCCCC)COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC > InChI=1S/C63H108O6/c1-4-7-10-13-16-19-22-25-28-30-31-33-36-38-41-44-47-50-53-56-62(65)68-59-60(69-63(66)57-54-51-48-45-42-39-34-27-24-21-18-15-12-9-6-3)58-67-61(64)55-52-49-46-43-40-37-35-32-29-26-23-20-17-14-11-8-5-2/h7,10,16,19,21,24-25,28,31,33,38,41,47,50,60H,4-6,8-9,11-15,17-18,20,22-23,26-27,29-30,32,34-37,39-40,42-46,48-49,51-59H2,1-3H3/b10-7-,19-16-,24-21-,28-25-,33-31-,41-38-,50-47-/t60-/m0/s1 > GAXJORUXYNNTIZ-ADZJPNINSA-N $$$$