Mrv0541 02231220242D 67 66 0 0 1 0 999 V2000 18.9956 -12.4576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7102 -13.6952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4247 -10.8076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2812 -11.2201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1391 -12.0451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5668 -9.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4233 -18.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1378 -18.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4233 -19.4702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1378 -17.4076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7090 -19.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8523 -16.9951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7090 -20.7076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8523 -16.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9944 -21.1201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5668 -15.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9944 -21.9451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5668 -14.9326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2799 -22.3576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2812 -14.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2799 -23.1826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2812 -13.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5655 -23.5951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9956 -13.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7102 -12.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7102 -11.2201 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 18.9956 -10.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1391 -11.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8536 -10.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5680 -11.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5668 -10.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8523 -11.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2826 -10.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1378 -10.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4233 -11.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9970 -11.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9970 -4.6202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2826 -5.0327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4220 -12.4576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4220 -13.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9970 -3.7951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7075 -12.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2826 -5.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1366 -13.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7090 -10.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7115 -10.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7115 -3.3826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7075 -11.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5680 -6.2701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1366 -14.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7115 -9.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9944 -11.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9944 -12.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5680 -7.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8510 -14.9326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2826 -7.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4260 -9.5701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5655 -14.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2799 -12.4576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4260 -8.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7115 -8.3326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9970 -7.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2799 -14.9326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9944 -13.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7115 -7.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2799 -13.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9944 -14.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 24 2 0 0 0 0 26 3 1 6 0 0 0 3 28 1 0 0 0 0 4 27 1 0 0 0 0 4 31 1 0 0 0 0 5 28 2 0 0 0 0 6 31 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 25 26 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 32 34 1 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 35 45 1 0 0 0 0 36 46 2 0 0 0 0 37 38 1 0 0 0 0 37 41 1 0 0 0 0 38 43 1 0 0 0 0 39 40 1 0 0 0 0 39 42 1 0 0 0 0 40 44 1 0 0 0 0 41 47 1 0 0 0 0 42 48 1 0 0 0 0 43 49 1 0 0 0 0 44 50 1 0 0 0 0 45 52 2 0 0 0 0 46 51 1 0 0 0 0 49 54 2 0 0 0 0 50 55 2 0 0 0 0 51 57 1 0 0 0 0 52 53 1 0 0 0 0 53 59 1 0 0 0 0 54 56 1 0 0 0 0 55 58 1 0 0 0 0 56 62 1 0 0 0 0 57 60 2 0 0 0 0 58 63 1 0 0 0 0 59 66 2 0 0 0 0 60 61 1 0 0 0 0 61 65 1 0 0 0 0 62 65 2 0 0 0 0 63 67 2 0 0 0 0 64 66 1 0 0 0 0 64 67 1 0 0 0 0 M END > BMDB0005413 > bmdb > CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC > InChI=1S/C61H102O6/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/h16-17,19-20,25-26,28-29,33-34,36-37,42-43,45-46,58H,4-15,18,21-24,27,30-32,35,38-41,44,47-57H2,1-3H3/b19-16-,20-17-,28-25-,29-26-,36-33-,37-34-,45-42-,46-43-/t58-/m1/s1 > KWIGMCRWEINBIR-HUPVKWKYSA-N > C61H102O6 > 931.459 > 930.767640996 > 3 > 119.66207425615946 > 0 > 0 > 0 > 0 > (2R)-1-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-3-(octadecanoyloxy)propan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate > 10.70 > 20.474461081 > -8.28 > 0 > 0 > 0 > -6.56594601817926 > 78.9 > 296.2330999999998 > 52 > 0 > 4.91e-06 g/l > (2R)-1-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-3-(octadecanoyloxy)propan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate > 0 > BMDB0005413 > TG(18:0/20:4(5Z,8Z,11Z,14Z)/20:4(5Z,8Z,11Z,14Z))[iso3] > 1-stearoyl-2-arachidonoyl-3-arachidonoyl-glycerol; TAG(18:0/20:4/20:4); TAG(18:0/20:4n6/20:4n6); TAG(18:0/20:4w6/20:4w6); TAG(58:8); TG(18:0/20:4/20:4); TG(18:0/20:4n6/20:4n6); TG(18:0/20:4w6/20:4w6); TG(58:8); Tracylglycerol(18:0/20:4/20:4); Tracylglycerol(18:0/20:4n6/20:4n6); Tracylglycerol(18:0/20:4w6/20:4w6); Tracylglycerol(58:8); Triacylglycerol; Triglyceride $$$$