444899 -OEChem-09272320492D 54 53 0 0 0 0 0 0 0999 V2000 3.7320 -1.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 0.2151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 0.2151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 1.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 1.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 0.2151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 0.2151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.7269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.6531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -2.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -2.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7162 -0.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3176 -0.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3176 1.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7162 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 54 1 0 0 0 0 2 22 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 8 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 11 2 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 14 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 16 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 22 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 17 2 0 0 0 0 14 44 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 19 2 0 0 0 0 16 48 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 M END > 444899 > 1 > 362 > 2 > 1 > 14 > AAADcfB4MAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACACAgAACCAAAAgCIACDSCAAAAAAgAAAICAEAAAgAABIAAQAAQAAEgAAIAAOIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid > (5Z,8Z,11Z,14Z)-eicosa-5,8,11,14-tetraenoic acid > (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid > (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid > (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid > (5Z,8Z,11Z,14Z)-eicosa-5,8,11,14-tetraenoic acid > InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15- > YZXBAPSDXZZRGB-DOFZRALJSA-N > 6.3 > 304.240230259 > C20H32O2 > 304.5 > CCCCCC=CCC=CCC=CCC=CCCCC(=O)O > CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O > 37.3 > 304.240230259 > 0 > 22 > 0 > 0 > 4 > 0 > 0 > 1 > -1 > 1 5 255 $$$$