69942765 -OEChem-04232403372D 138137 0 1 0 0 0 0 0999 V2000 7.0321 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 9.8504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0321 4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1254 10.8504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2594 12.3504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7642 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 15.8504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 14.3504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8982 5.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3982 7.0388 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 10.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 10.8504 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3312 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 10.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0632 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 10.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 10.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7953 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6613 10.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 10.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1972 15.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3312 15.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0632 15.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 15.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9292 15.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5991 15.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7953 15.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5273 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 15.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6613 15.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 15.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3933 10.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5273 15.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 10.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 15.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6302 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3933 15.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2594 11.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7642 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8982 4.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4962 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1302 3.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1302 5.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 15.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0891 6.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7072 6.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0321 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3982 7.0388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8982 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1661 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8982 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1661 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0321 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9976 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2006 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0666 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8637 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 10.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7297 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9326 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7987 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5957 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4617 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6647 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6025 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5307 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3278 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1938 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3967 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2628 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0598 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8705 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6675 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5957 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7987 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9326 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7297 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6647 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4617 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8637 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0666 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3278 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5307 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2006 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9976 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3967 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1938 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9258 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1288 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 9.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8015 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0044 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1316 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3346 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0598 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2628 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9948 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7919 10.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1288 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9258 14.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 11.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 10.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 10.3135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6025 16.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7033 15.3135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9303 16.1604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0833 16.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8982 3.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8062 4.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0332 5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1862 5.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5933 3.3240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4402 3.0970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6671 3.9440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6671 5.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8202 5.9030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5933 5.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6623 11.1604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4995 5.8962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2968 5.8962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 15.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0337 7.5404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4351 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6292 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4351 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6292 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 57 1 0 0 0 0 2 13 1 0 0 0 0 2 99 1 0 0 0 0 3 44 1 0 0 0 0 3 51 1 0 0 0 0 4 42 1 0 0 0 0 4130 1 0 0 0 0 5 42 2 0 0 0 0 6 43 2 0 0 0 0 7 48 1 0 0 0 0 7133 1 0 0 0 0 8 48 2 0 0 0 0 9 44 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 50 2 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 58 1 0 0 0 0 11 59 1 0 0 0 0 12 14 1 0 0 0 0 12 60 1 0 0 0 0 12 61 1 0 0 0 0 13 16 1 0 0 0 0 13 62 1 0 0 0 0 14 15 1 0 0 0 0 14 63 1 0 0 0 0 14 64 1 0 0 0 0 15 17 1 0 0 0 0 15 65 1 0 0 0 0 15 66 1 0 0 0 0 16 18 1 0 0 0 0 16 67 1 0 0 0 0 16 68 1 0 0 0 0 17 19 1 0 0 0 0 17 69 1 0 0 0 0 17 70 1 0 0 0 0 18 20 1 0 0 0 0 18 71 1 0 0 0 0 18 72 1 0 0 0 0 19 21 1 0 0 0 0 19 73 1 0 0 0 0 19 74 1 0 0 0 0 20 23 1 0 0 0 0 20 75 1 0 0 0 0 20 76 1 0 0 0 0 21 22 1 0 0 0 0 21 77 1 0 0 0 0 21 78 1 0 0 0 0 22 31 1 0 0 0 0 22 79 1 0 0 0 0 22 80 1 0 0 0 0 23 32 1 0 0 0 0 23 81 1 0 0 0 0 23 82 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 83 1 0 0 0 0 24 84 1 0 0 0 0 25 27 1 0 0 0 0 25 85 1 0 0 0 0 25 86 1 0 0 0 0 26 28 1 0 0 0 0 26 87 1 0 0 0 0 26 88 1 0 0 0 0 27 29 1 0 0 0 0 27 89 1 0 0 0 0 27 90 1 0 0 0 0 28 30 1 0 0 0 0 28 91 1 0 0 0 0 28 92 1 0 0 0 0 29 33 1 0 0 0 0 29 93 1 0 0 0 0 29 94 1 0 0 0 0 30 34 1 0 0 0 0 30 95 1 0 0 0 0 30 96 1 0 0 0 0 31 36 1 0 0 0 0 31 97 1 0 0 0 0 31 98 1 0 0 0 0 32 38 1 0 0 0 0 32100 1 0 0 0 0 32101 1 0 0 0 0 33 35 1 0 0 0 0 33102 1 0 0 0 0 33103 1 0 0 0 0 34 37 1 0 0 0 0 34104 1 0 0 0 0 34105 1 0 0 0 0 35 39 1 0 0 0 0 35106 1 0 0 0 0 35107 1 0 0 0 0 36 42 1 0 0 0 0 36108 1 0 0 0 0 36109 1 0 0 0 0 37 41 1 0 0 0 0 37110 1 0 0 0 0 37111 1 0 0 0 0 38112 1 0 0 0 0 38113 1 0 0 0 0 38114 1 0 0 0 0 39 48 1 0 0 0 0 39115 1 0 0 0 0 39116 1 0 0 0 0 40 43 1 0 0 0 0 40 45 1 0 0 0 0 40 46 1 0 0 0 0 40 47 1 0 0 0 0 41117 1 0 0 0 0 41118 1 0 0 0 0 41119 1 0 0 0 0 43 44 1 0 0 0 0 44120 1 0 0 0 0 45121 1 0 0 0 0 45122 1 0 0 0 0 45123 1 0 0 0 0 46124 1 0 0 0 0 46125 1 0 0 0 0 46126 1 0 0 0 0 47127 1 0 0 0 0 47128 1 0 0 0 0 47129 1 0 0 0 0 49 52 2 0 0 0 0 49131 1 0 0 0 0 50132 1 0 0 0 0 51 53 2 0 0 0 0 51 54 1 0 0 0 0 52134 1 0 0 0 0 53 55 1 0 0 0 0 53135 1 0 0 0 0 54 56 2 0 0 0 0 54136 1 0 0 0 0 55 57 2 0 0 0 0 55137 1 0 0 0 0 56 57 1 0 0 0 0 56138 1 0 0 0 0 M END > 69942765 > 1 > 719 > 8 > 3 > 33 > AAADcfB/OAAEAAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAAABwAAAHgIACAAADhbhkiY/npcMFgCoALD3bAICiC0xN6AJyAHeOoiMfjKFuz6eeCCswBOIqCeIyKCJACAAAAAAAAAAQAAAAAAAAAAAAAAAAA== > 1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethyl-butan-2-one;12-hydroxyoctadecanoic acid;tetradecanoic acid > 1-(4-chlorophenoxy)-1-(1-imidazolyl)-3,3-dimethyl-2-butanone;12-hydroxyoctadecanoic acid;tetradecanoic acid > 1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one;12-hydroxyoctadecanoic acid;tetradecanoic acid > 1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-one;12-hydroxyoctadecanoic acid;tetradecanoic acid > 1-(4-chloranylphenoxy)-1-imidazol-1-yl-3,3-dimethyl-butan-2-one;12-oxidanyloctadecanoic acid;tetradecanoic acid > 1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethyl-butan-2-one;12-hydroxystearic acid;myristic acid > InChI=1S/C18H36O3.C15H17ClN2O2.C14H28O2/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21;1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12;1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h17,19H,2-16H2,1H3,(H,20,21);4-10,14H,1-3H3;2-13H2,1H3,(H,15,16) > KKOKNOQHGLGZOC-UHFFFAOYSA-N > 820.5732306 > C47H81ClN2O7 > 821.6 > CCCCCCCCCCCCCC(=O)O.CCCCCCC(CCCCCCCCCCC(=O)O)O.CC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl > CCCCCCCCCCCCCC(=O)O.CCCCCCC(CCCCCCCCCCC(=O)O)O.CC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl > 139 > 820.5732306 > 0 > 57 > 0 > 2 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 10 50 8 10 52 8 13 2 3 44 43 3 49 52 8 51 53 8 51 54 8 53 55 8 54 56 8 55 57 8 56 57 8 9 49 8 9 50 8 $$$$