Mrv0541 02231220272D 67 66 0 0 1 0 999 V2000 15.7908 -3.7538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5051 -4.9913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3617 -5.4038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6474 -4.1663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0763 -6.6412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9329 -2.9288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.9353 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6499 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2208 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3643 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5064 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0787 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7920 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7931 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.5078 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0774 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2221 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3630 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.9366 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6486 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.6511 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9341 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.3655 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2196 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.0800 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5051 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9329 -8.7038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2183 -9.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9329 -7.8788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9316 -11.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 -11.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2183 -9.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9316 -12.4162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3605 -11.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0763 -4.1663 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.6474 -7.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5039 -10.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2172 -12.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0751 -11.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6474 -6.6412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0763 -4.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2172 -13.6538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5039 -11.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7895 -11.5912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3617 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3617 -6.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5027 -14.0662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9329 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2183 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5039 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7895 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0751 -3.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7882 -5.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7882 -6.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3605 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0737 -4.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5027 -6.6412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3605 -4.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0737 -4.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5027 -7.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 -5.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2172 -7.8788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9316 -7.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 -6.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3605 -6.6412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 -7.8788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3605 -7.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 35 1 1 6 0 0 0 2 26 2 0 0 0 0 3 41 1 0 0 0 0 3 46 1 0 0 0 0 4 45 1 0 0 0 0 4 48 1 0 0 0 0 5 46 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 16 1 0 0 0 0 14 15 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 25 1 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 32 1 0 0 0 0 29 36 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 31 34 1 0 0 0 0 32 37 1 0 0 0 0 33 38 1 0 0 0 0 34 39 1 0 0 0 0 35 41 1 0 0 0 0 35 45 1 0 0 0 0 36 40 1 0 0 0 0 37 43 1 0 0 0 0 38 42 1 0 0 0 0 39 44 1 0 0 0 0 40 46 1 0 0 0 0 42 47 1 0 0 0 0 43 44 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 55 2 0 0 0 0 53 54 1 0 0 0 0 53 56 1 0 0 0 0 54 57 1 0 0 0 0 55 58 1 0 0 0 0 56 59 1 0 0 0 0 57 60 1 0 0 0 0 58 61 1 0 0 0 0 60 62 2 0 0 0 0 61 64 2 0 0 0 0 62 63 1 0 0 0 0 63 66 1 0 0 0 0 64 65 1 0 0 0 0 65 67 1 0 0 0 0 66 67 2 0 0 0 0 M END > BMDB0005451 > bmdb > CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC\C=C/CCCCCCCC)COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC > InChI=1S/C61H108O6/c1-4-7-10-13-16-19-22-25-28-30-33-36-39-42-45-48-51-54-60(63)66-57-58(56-65-59(62)53-50-47-44-41-38-35-32-27-24-21-18-15-12-9-6-3)67-61(64)55-52-49-46-43-40-37-34-31-29-26-23-20-17-14-11-8-5-2/h16,19,25,27-28,32-33,36,42,45,58H,4-15,17-18,20-24,26,29-31,34-35,37-41,43-44,46-57H2,1-3H3/b19-16-,28-25-,32-27-,36-33-,45-42-/t58-/m1/s1 > DEFZLHCFQHGRAM-AYLBQGLTSA-N > C61H108O6 > 937.5066 > 936.814591188 > 3 > 123.42417534758127 > 0 > 0 > 0 > 0 > (2R)-2-(icosanoyloxy)-3-[(9Z)-octadec-9-enoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate > 10.90 > 21.560226051 > -8.21 > 0 > 0 > 0 > -6.565907583667803 > 78.9 > 292.8832999999999 > 55 > 0 > 5.76e-06 g/l > (2R)-2-(icosanoyloxy)-3-[(9Z)-octadec-9-enoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate > 0 > BMDB0005451 > TG(18:1(9Z)/20:0/20:4(5Z,8Z,11Z,14Z))[iso6] > 1-oleoyl-2-arachidonyl-3-arachidonoyl-glycerol; TAG(18:1/20:0/20:4); TAG(18:1n9/20:0/20:4n6); TAG(18:1w9/20:0/20:4w6); TAG(58:5); TG(18:1/20:0/20:4); TG(18:1n9/20:0/20:4n6); TG(18:1w9/20:0/20:4w6); TG(58:5); Tracylglycerol(18:1/20:0/20:4); Tracylglycerol(18:1n9/20:0/20:4n6); Tracylglycerol(18:1w9/20:0/20:4w6); Tracylglycerol(58:5); Triacylglycerol; Triglyceride $$$$