Mrv0541 02231220282D 67 66 0 0 1 0 999 V2000 15.7911 -3.7593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5054 -4.9967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3620 -5.4094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6476 -4.1719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0765 -6.6469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9331 -2.9343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.9357 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6503 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2213 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3647 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5069 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0793 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7924 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7937 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.5083 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0778 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2226 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3633 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.9371 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6489 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.6517 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9345 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.3661 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2199 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.0805 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5054 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0765 -4.1719 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9331 -8.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9331 -7.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2185 -9.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6476 -7.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0765 -4.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2185 -9.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3620 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6476 -6.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5041 -10.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3620 -6.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5041 -11.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7897 -11.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9331 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2185 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0752 -11.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5041 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9317 -9.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3607 -11.5969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6461 -10.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7897 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2173 -10.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6461 -11.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5028 -9.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0752 -3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7883 -10.3594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7883 -5.4094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7883 -6.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0738 -4.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5028 -6.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3607 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3607 -4.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0738 -4.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5028 -7.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6461 -5.4094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2173 -7.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9317 -7.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6461 -6.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3607 -6.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6461 -7.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3607 -7.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 27 1 1 6 0 0 0 2 26 2 0 0 0 0 3 32 1 0 0 0 0 3 37 1 0 0 0 0 4 34 1 0 0 0 0 4 40 1 0 0 0 0 5 37 2 0 0 0 0 6 40 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 32 1 0 0 0 0 27 34 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 30 33 1 0 0 0 0 31 35 1 0 0 0 0 33 36 1 0 0 0 0 35 37 1 0 0 0 0 36 38 1 0 0 0 0 38 39 2 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 41 43 1 0 0 0 0 42 45 1 0 0 0 0 43 47 1 0 0 0 0 44 46 1 0 0 0 0 44 48 1 0 0 0 0 45 49 2 0 0 0 0 46 49 1 0 0 0 0 47 51 1 0 0 0 0 48 50 1 0 0 0 0 50 52 1 0 0 0 0 51 57 2 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 54 56 1 0 0 0 0 55 59 1 0 0 0 0 56 60 1 0 0 0 0 57 58 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 > BMDB0005469 > bmdb > CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC > InChI=1S/C61H106O6/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/h16,18-19,21,25,27-28,32-33,36,42,45,58H,4-15,17,20,22-24,26,29-31,34-35,37-41,43-44,46-57H2,1-3H3/b19-16-,21-18-,28-25-,32-27-,36-33-,45-42-/t58-/m1/s1 > KPXSIVREYDDZCU-DJWBDMARSA-N > C61H106O6 > 935.4907 > 934.798941124 > 3 > 122.58177261628887 > 0 > 0 > 0 > 0 > (2R)-2-(icosanoyloxy)-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate > 10.85 > 21.198304394333334 > -8.12 > 0 > 0 > 0 > -6.565907583667803 > 78.9 > 293.9998999999999 > 54 > 0 > 7.15e-06 g/l > (2R)-2-(icosanoyloxy)-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate > 0 > BMDB0005469 > TG(18:2(9Z,12Z)/20:0/20:4(5Z,8Z,11Z,14Z))[iso6] > 1-linoleoyl-2-arachidonyl-3-arachidonoyl-glycerol; TAG(18:2/20:0/20:4); TAG(18:2n6/20:0/20:4n6); TAG(18:2w6/20:0/20:4w6); TAG(58:6); TG(18:2/20:0/20:4); TG(18:2n6/20:0/20:4n6); TG(18:2w6/20:0/20:4w6); TG(58:6); Tracylglycerol(18:2/20:0/20:4); Tracylglycerol(18:2n6/20:0/20:4n6); Tracylglycerol(18:2w6/20:0/20:4w6); Tracylglycerol(58:6); Triacylglycerol; Triglyceride $$$$