52921899 -OEChem-04192410442D 56 56 0 1 0 0 0 0 0999 V2000 10.2942 -0.9610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7942 -0.0950 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7942 -0.0950 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6603 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5263 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4050 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3923 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3923 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2583 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2583 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1244 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1244 4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2326 -0.5334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3558 -0.5334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0588 0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2617 0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5263 -0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9292 0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1803 1.9876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7817 1.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4704 1.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8689 2.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0463 3.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6477 2.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3364 2.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7349 3.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7444 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1244 5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5044 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -1.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -3.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 11 1 0 0 0 0 2 45 1 0 0 0 0 3 24 1 0 0 0 0 3 56 1 0 0 0 0 4 24 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 6 0 0 0 5 25 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 10 2 0 0 0 0 8 29 1 0 0 0 0 9 12 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 15 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 18 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 21 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 22 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 M END > 52921899 > 1 > 425 > 4 > 2 > 14 > AAADcfB4OAAAAAAAAAAAAAAAEgAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACBSggAICCAAABgCIACDSCAAAAAAgAAAICAEAAAgAFBIAIQACUAAEwAAIMAOIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > (5Z,9E)-8-hydroxy-10-[(3S)-3-[(Z)-oct-2-enyl]oxiran-2-yl]deca-5,9-dienoic acid > (5Z,9E)-8-hydroxy-10-[(3S)-3-[(Z)-oct-2-enyl]-2-oxiranyl]deca-5,9-dienoic acid > (5Z,9E)-8-hydroxy-10-[(3S)-3-[(Z)-oct-2-enyl]oxiran-2-yl]deca-5,9-dienoic acid > (5Z,9E)-8-hydroxy-10-[(3S)-3-[(Z)-oct-2-enyl]oxiran-2-yl]deca-5,9-dienoic acid > (5Z,9E)-10-[(3S)-3-[(Z)-oct-2-enyl]oxiran-2-yl]-8-oxidanyl-deca-5,9-dienoic acid > (5Z,9E)-8-hydroxy-10-[(3S)-3-[(Z)-oct-2-enyl]oxiran-2-yl]deca-5,9-dienoic acid > InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18-19(24-18)16-15-17(21)12-9-7-8-11-14-20(22)23/h6-7,9-10,15-19,21H,2-5,8,11-14H2,1H3,(H,22,23)/b9-7-,10-6-,16-15+/t17?,18-,19?/m0/s1 > SGTUOBURCVMACZ-UIKNIFMXSA-N > 4.1 > 336.23005950 > C20H32O4 > 336.5 > CCCCCC=CCC1C(O1)C=CC(CC=CCCCC(=O)O)O > CCCCC/C=C\C[C@H]1C(O1)/C=C/C(C/C=C\CCCC(=O)O)O > 70.1 > 336.23005950 > 0 > 24 > 1 > 2 > 3 > 0 > 0 > 1 > -1 > 1 5 255 > 11 2 3 5 7 6 6 8 3 $$$$