5280581 -OEChem-03282405442D 56 55 0 0 0 0 0 0 0999 V2000 2.5369 2.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 3.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 3.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1316 3.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3346 3.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 3.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 3.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3346 -2.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1316 -2.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7890 -1.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3905 -2.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7206 1.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1191 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 -2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1191 -0.2274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7206 -0.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 -0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 56 1 0 0 0 0 2 16 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 13 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 16 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 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 12 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 15 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 17 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 18 1 0 0 0 0 14 45 1 0 0 0 0 15 19 2 0 0 0 0 15 44 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 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 20 1 0 0 0 0 19 51 1 0 0 0 0 20 22 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 M END > 5280581 > 1 > 327 > 2 > 1 > 15 > AAADcfB4MAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACACAgAACCAAAAgCIACDSCAAAAAAgAAAICAEAAAgAABIAAQAAQAAEgAAIAAOIyKCAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (8Z,11Z,14Z)-icosa-8,11,14-trienoic acid > (8Z,11Z,14Z)-eicosa-8,11,14-trienoic acid > (8Z,11Z,14Z)-icosa-8,11,14-trienoic acid > (8Z,11Z,14Z)-icosa-8,11,14-trienoic acid > (8Z,11Z,14Z)-icosa-8,11,14-trienoic acid > (8Z,11Z,14Z)-eicosa-8,11,14-trienoic acid > InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12- > HOBAELRKJCKHQD-QNEBEIHSSA-N > 7.2 > 306.255880323 > C20H34O2 > 306.5 > CCCCCC=CCC=CCC=CCCCCCCC(=O)O > CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O > 37.3 > 306.255880323 > 0 > 22 > 0 > 0 > 3 > 0 > 0 > 1 > -1 > 1 5 255 $$$$