Mrv1652304202021062D 72 71 0 0 1 0 999 V2000 26.0320 -6.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0709 -7.2826 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 24.1097 -6.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.0320 -5.6178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1485 -7.2826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.3208 -8.3926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.8261 -8.4064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4300 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1444 -7.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8589 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5734 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2879 -7.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0024 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7168 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4313 -7.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1458 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8602 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5747 -7.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2892 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0037 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7182 -7.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4327 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1471 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8616 -7.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5761 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2906 -7.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0051 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7195 -7.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4340 -6.8701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4340 -6.0451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4603 -8.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1748 -8.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8892 -8.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6037 -8.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3182 -8.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0327 -8.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7472 -8.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4616 -8.3926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1761 -8.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8906 -8.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6050 -8.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3195 -8.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0340 -8.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7485 -8.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4630 -8.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1774 -8.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8919 -8.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6064 -8.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6064 -9.6301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3135 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0279 -5.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7424 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4569 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1714 -5.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8859 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6003 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3148 -5.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0293 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7437 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4582 -5.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1727 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8872 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6017 -5.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3161 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0306 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7451 -5.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4596 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1741 -5.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8886 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6030 -5.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3175 -5.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3175 -4.3803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 1 1 0 0 0 0 5 3 1 0 0 0 0 2 6 1 6 0 0 0 2 7 1 1 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 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 5 1 0 0 0 0 29 30 2 0 0 0 0 32 31 1 0 0 0 0 33 32 1 0 0 0 0 34 33 2 0 0 0 0 35 34 1 0 0 0 0 36 35 1 0 0 0 0 37 36 2 0 0 0 0 38 37 1 0 0 0 0 39 38 1 0 0 0 0 40 39 2 0 0 0 0 41 40 1 0 0 0 0 42 41 1 0 0 0 0 43 42 1 0 0 0 0 44 43 1 0 0 0 0 45 44 1 0 0 0 0 46 45 1 0 0 0 0 47 46 1 0 0 0 0 48 47 1 0 0 0 0 49 48 2 0 0 0 0 6 48 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 2 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 2 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 2 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 2 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 65 2 0 0 0 0 65 66 1 0 0 0 0 66 67 1 0 0 0 0 67 68 1 0 0 0 0 68 69 1 0 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 71 4 1 0 0 0 0 71 72 2 0 0 0 0 M END > FDB112288 > foodb > [H]C(COC(=O)CCCCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)(COC(=O)CCCCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)OC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC > InChI=1S/C65H100O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-37-39-42-45-48-51-54-57-63(66)69-60-62(71-65(68)59-56-53-50-47-44-41-36-27-24-21-18-15-12-9-6-3)61-70-64(67)58-55-52-49-46-43-40-38-35-33-31-29-26-23-20-17-14-11-8-5-2/h7-12,16-21,25-29,32-36,39-40,42-43,62H,4-6,13-15,22-24,30-31,37-38,41,44-61H2,1-3H3/b10-7-,11-8-,12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,34-32-,35-33-,36-27-,42-39-,43-40- > CJLFAMUPGLSRFA-YWULFENESA-N > C65H100O6 > 977.4859 > 976.751990932 > 3 > 171 > 119.70294470152237 > 0 > 0 > 0 > 0 > 3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propyl (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate > 9.53 > 20.443127457666666 > -8.05 > 0 > 0 > 0 > -6.5658679947858 > 78.9 > 320.2200999999999 > 51 > 0 > 8.79e-06 g/l > 3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propyl (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate > 0 > FDB112288 > TG(22:5(7Z,10Z,13Z,16Z,19Z)/18:3(9Z,12Z,15Z)/22:5(7Z,10Z,13Z,16Z,19Z)) $$$$