1-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-2-(15Z-tetracosenoyl)-3-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycerol TG(22:5(4Z,7Z,10Z,13Z,16Z)/24:1(15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) Mrv1652304062010292D 78 77 0 0 1 0 999 V2000 24.1443 -6.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1832 -7.0352 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.2219 -6.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1442 -5.3703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2606 -7.0352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.4330 -8.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9384 -8.1590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4298 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4298 -4.1865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.7156 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0015 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2873 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4623 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7482 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0341 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2091 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4949 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7807 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9557 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2416 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5275 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7025 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9883 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2742 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4491 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7350 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0209 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3067 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5926 -5.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8785 -4.9579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7185 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7185 -9.3292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0044 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2902 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5761 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8620 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1478 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4337 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7196 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0054 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2913 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5771 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8630 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1489 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4347 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7206 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8956 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1814 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4673 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7531 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3249 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6108 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8966 -8.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1825 -8.5577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5462 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5462 -5.8512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8320 -7.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1179 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4038 -7.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6897 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9755 -7.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2614 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4363 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7222 -7.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0081 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1831 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4689 -7.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7548 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9297 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2156 -7.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5015 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6765 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9623 -7.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2482 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4232 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 -7.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9949 -6.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 1 0 0 0 3 2 1 0 0 0 0 4 1 1 0 0 0 0 4 8 1 0 0 0 0 5 3 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 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 31 6 1 0 0 0 0 31 32 2 0 0 0 0 31 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 40 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 2 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 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 56 5 1 0 0 0 0 56 57 2 0 0 0 0 56 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 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 72 73 2 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 76 2 0 0 0 0 76 77 1 0 0 0 0 77 78 1 0 0 0 0 M END > BMDB0108717 > bmdb > [H][C@@](COC(=O)CCCCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)(COC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCCC)OC(=O)CCCCCCCCCCCCC\C=C/CCCCCCCC > InChI=1S/C71H116O6/c1-4-7-10-13-16-19-22-25-28-31-34-35-38-41-44-47-50-53-56-59-62-65-71(74)77-68(66-75-69(72)63-60-57-54-51-48-45-42-39-36-32-29-26-23-20-17-14-11-8-5-2)67-76-70(73)64-61-58-55-52-49-46-43-40-37-33-30-27-24-21-18-15-12-9-6-3/h8,11,17-18,20-21,25-30,36-37,39-40,45-46,48-49,55,58,68H,4-7,9-10,12-16,19,22-24,31-35,38,41-44,47,50-54,56-57,59-67H2,1-3H3/b11-8-,20-17-,21-18-,28-25-,29-26-,30-27-,39-36-,40-37-,48-45-,49-46-,58-55-/t68-/m1/s1 > BPWHLXQWPNLECB-HVYIPWGNSA-N > C71H116O6 > 1065.703 > 1064.877191455 > 3 > 193 > 136.1056465757635 > 0 > 0 > 0 > 0 > (2R)-1-[(4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoyloxy]-3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]propan-2-yl (15Z)-tetracos-15-enoate > 10.63 > 23.834382761 > -8.33 > 0 > 0 > 0 > -6.567013933320472 > 78.9 > 345.59289999999976 > 59 > 0 > 4.94e-06 g/l > (2R)-1-[(4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoyloxy]-3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]propan-2-yl (15Z)-tetracos-15-enoate > 0 > BMDB0108717 > TG(22:5(4Z,7Z,10Z,13Z,16Z)/24:1(15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) $$$$