Mrv0541 02231220232D 63 62 0 0 1 0 999 V2000 16.3956 -13.0351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8246 -11.3850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1101 -14.2724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6811 -11.7974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5389 -12.6226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9667 -10.5601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5376 -18.8099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5376 -17.9850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8232 -19.2224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2522 -17.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8232 -20.0474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2522 -16.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1088 -20.4599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9667 -16.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1088 -21.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9667 -15.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3944 -21.6974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6811 -15.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3944 -22.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6811 -14.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6797 -22.9349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3956 -13.8600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3969 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6824 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1113 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9679 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8258 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1101 -11.7974 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 17.1101 -12.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2535 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5401 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5389 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3956 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2547 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9692 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9692 -10.5601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9667 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2522 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9692 -8.0851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9692 -8.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6836 -10.1476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5376 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2547 -7.6724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6836 -9.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2547 -6.8476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8232 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5401 -6.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 -13.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 -13.8600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1088 -11.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1075 -12.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5366 -14.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3944 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1075 -11.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5366 -15.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3944 -12.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2509 -15.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9654 -15.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6797 -13.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6797 -15.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3944 -14.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6797 -13.8600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3944 -15.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 29 1 0 0 0 0 28 2 1 6 0 0 0 2 32 1 0 0 0 0 3 22 2 0 0 0 0 4 33 1 0 0 0 0 4 37 1 0 0 0 0 5 32 2 0 0 0 0 6 37 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 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 30 1 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 30 32 1 0 0 0 0 31 34 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 38 42 1 0 0 0 0 39 40 1 0 0 0 0 39 43 1 0 0 0 0 40 44 1 0 0 0 0 41 44 2 0 0 0 0 42 46 1 0 0 0 0 43 45 1 0 0 0 0 45 47 1 0 0 0 0 46 50 1 0 0 0 0 48 49 1 0 0 0 0 48 51 1 0 0 0 0 49 52 1 0 0 0 0 50 53 2 0 0 0 0 51 54 1 0 0 0 0 52 55 1 0 0 0 0 53 56 1 0 0 0 0 55 57 2 0 0 0 0 56 59 1 0 0 0 0 57 58 1 0 0 0 0 58 60 1 0 0 0 0 59 62 2 0 0 0 0 60 63 2 0 0 0 0 61 62 1 0 0 0 0 61 63 1 0 0 0 0 M END > BMDB0005391 > bmdb > CCCCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC > InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-27-28-30-32-35-38-41-44-47-50-56(59)62-53-54(52-61-55(58)49-46-43-40-37-34-31-24-21-18-15-12-9-6-3)63-57(60)51-48-45-42-39-36-33-29-26-23-20-17-14-11-8-5-2/h16-17,19-20,25-27,29-30,32,38,41,54H,4-15,18,21-24,28,31,33-37,39-40,42-53H2,1-3H3/b19-16-,20-17-,27-25-,29-26-,32-30-,41-38-/t54-/m1/s1 > NIQCHCDUIPSWDJ-DODJOXOJSA-N > C57H98O6 > 879.3844 > 878.736340868 > 3 > 113.97448164810908 > 0 > 0 > 0 > 0 > (2R)-3-(hexadecanoyloxy)-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate > 10.71 > 19.420029734333333 > -8.02 > 0 > 0 > 0 > -6.565907583667802 > 78.9 > 275.5959 > 50 > 0 > 8.36e-06 g/l > (2R)-3-(hexadecanoyloxy)-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate > 0 > BMDB0005391 > TG(16:0/18:2(9Z,12Z)/20:4(5Z,8Z,11Z,14Z))[iso6] > 1-palmitoyl-2-linoleoyl-3-arachidonoyl-glycerol; TAG(16:0/18:2/20:4); TAG(16:0/18:2n6/20:4n6); TAG(16:0/18:2w6/20:4w6); TAG(54:6); TG(16:0/18:2/20:4); TG(16:0/18:2n6/20:4n6); TG(16:0/18:2w6/20:4w6); TG(54:6); Tracylglycerol(16:0/18:2/20:4); Tracylglycerol(16:0/18:2n6/20:4n6); Tracylglycerol(16:0/18:2w6/20:4w6); Tracylglycerol(54:6); Triacylglycerol; Triglyceride $$$$