16156545 -OEChem-05261303172D 128165 0 1 0 0 0 0 0999 V2000 15.9605 2.3884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3101 -3.0340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4966 4.0926 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.7798 2.4143 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 11.2329 3.1714 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0729 0.1898 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8262 2.3086 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2068 0.6898 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2306 3.4743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9389 0.6898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0142 4.2027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0889 -0.8517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7503 1.2643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2068 1.6898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7312 2.8189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2968 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9942 4.5426 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.3211 1.0177 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.4751 2.4558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9389 1.6898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2364 3.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8328 0.1552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0386 0.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0729 2.1898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7012 4.8435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0770 -0.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3790 2.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2997 2.1847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 -2.8845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2968 2.1967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9388 4.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1909 -1.3794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7389 1.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8328 2.2245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5085 -5.1168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 1.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8168 3.8544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2888 -0.8586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4316 3.1337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7389 0.6690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2749 -0.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0889 3.2313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6858 4.6637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2552 -1.9910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9229 -1.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1909 3.7591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7114 -3.7299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2888 3.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8581 4.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4681 -2.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6906 4.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4725 -2.6871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2579 -0.8823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6546 -4.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7953 0.9185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7090 -3.4037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2754 3.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7273 4.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4894 -1.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6743 -2.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5945 -0.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6651 -3.4861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5156 2.7822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0892 1.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7986 -2.8982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7112 -1.6552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7387 -0.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9484 4.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3082 0.0632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3206 4.6592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2798 3.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5437 3.7137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8703 4.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0854 -0.5646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5179 -0.8680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4217 3.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7091 3.8127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5256 -1.4615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9385 -1.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4188 3.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5471 -2.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3044 1.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1856 -3.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4316 0.5519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1256 -3.5803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7353 -0.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3351 -0.3978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8702 -2.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0785 -3.5230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4057 -1.1078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0202 -1.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8261 -2.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9918 -3.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5042 -2.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8155 -2.7630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6738 5.3299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1576 1.1683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4216 1.9102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9990 2.5268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 2.8027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6797 2.1786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6719 4.1484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8315 5.0106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9693 5.1701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8168 2.9703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5898 3.8172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7429 3.5903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1373 3.2456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1003 4.8440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5699 -0.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9332 -1.0742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2503 2.6411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0668 4.3191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1280 -1.3148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4178 -2.0615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8946 1.3078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7039 1.3439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7178 -3.8211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3643 -2.8205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2079 0.1614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9403 -0.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5662 -2.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1880 -4.1332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7901 -1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5775 -1.5706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7781 -2.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2403 -3.8134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 81 1 0 0 0 0 1 83 1 0 0 0 0 2 82 1 0 0 0 0 2 84 1 0 0 0 0 3 17 1 0 0 0 0 3 27 1 0 0 0 0 3 71 1 0 0 0 0 4 18 1 0 0 0 0 4 28 1 0 0 0 0 4 72 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 17 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 6 18 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 7 27 1 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 8 28 1 0 0 0 0 9 19 1 0 0 0 0 9 21 2 0 0 0 0 10 20 1 0 0 0 0 10 22 2 0 0 0 0 11 25 2 0 0 0 0 11 31 1 0 0 0 0 12 26 1 0 0 0 0 12 32 2 0 0 0 0 13 23 2 0 0 0 0 13 29 1 0 0 0 0 14 24 2 0 0 0 0 14 30 1 0 0 0 0 15 35 1 0 0 0 0 15 37 2 0 0 0 0 16 36 2 0 0 0 0 16 38 1 0 0 0 0 17 69 1 0 0 0 0 17 97 1 1 0 0 0 18 70 1 0 0 0 0 18 98 1 1 0 0 0 19 23 1 0 0 0 0 19 33 2 0 0 0 0 20 24 1 0 0 0 0 20 34 2 0 0 0 0 21 25 1 0 0 0 0 21 39 1 0 0 0 0 22 26 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 2 0 0 0 0 27 99 1 0 0 0 0 27100 1 0 0 0 0 28101 1 0 0 0 0 28102 1 0 0 0 0 29 35 2 0 0 0 0 29 47 1 0 0 0 0 30 36 1 0 0 0 0 30 48 2 0 0 0 0 31 37 1 0 0 0 0 31 49 2 0 0 0 0 32 38 1 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 33 40 1 0 0 0 0 34 39 1 0 0 0 0 35 55 1 0 0 0 0 36 56 1 0 0 0 0 37 53 1 0 0 0 0 38 54 2 0 0 0 0 39 42 2 0 0 0 0 40 41 2 0 0 0 0 41 45 1 0 0 0 0 42 46 1 0 0 0 0 43 46 2 0 0 0 0 43 51 1 0 0 0 0 44 45 1 0 0 0 0 44 52 1 0 0 0 0 45 47 2 0 0 0 0 46 48 1 0 0 0 0 47 57 1 0 0 0 0 48 58 1 0 0 0 0 49 51 1 0 0 0 0 49 59 1 0 0 0 0 50 52 1 0 0 0 0 50 60 2 0 0 0 0 51 58 2 0 0 0 0 52 57 2 0 0 0 0 53 59 2 0 0 0 0 53 61 1 0 0 0 0 54 60 1 0 0 0 0 54 62 1 0 0 0 0 55 61 2 0 0 0 0 55 63 1 0 0 0 0 56 62 2 0 0 0 0 56 64 1 0 0 0 0 57 63 1 0 0 0 0 58 64 1 0 0 0 0 59 65 1 0 0 0 0 60 66 1 0 0 0 0 61 67 1 0 0 0 0 62 68 1 0 0 0 0 63 66 2 0 0 0 0 64 65 2 0 0 0 0 65 68 1 0 0 0 0 66 67 1 0 0 0 0 67 68 2 0 0 0 0 69 73 2 0 0 0 0 69 74 1 0 0 0 0 70 75 2 0 0 0 0 70 76 1 0 0 0 0 71103 1 0 0 0 0 71104 1 0 0 0 0 71105 1 0 0 0 0 72106 1 0 0 0 0 72107 1 0 0 0 0 72108 1 0 0 0 0 73 77 1 0 0 0 0 73109 1 0 0 0 0 74 78 2 0 0 0 0 74110 1 0 0 0 0 75 79 1 0 0 0 0 75111 1 0 0 0 0 76 80 2 0 0 0 0 76112 1 0 0 0 0 77 81 2 0 0 0 0 77113 1 0 0 0 0 78 81 1 0 0 0 0 78114 1 0 0 0 0 79 82 2 0 0 0 0 79115 1 0 0 0 0 80 82 1 0 0 0 0 80116 1 0 0 0 0 83 85 1 0 0 0 0 83117 1 0 0 0 0 83118 1 0 0 0 0 84 86 1 0 0 0 0 84119 1 0 0 0 0 84120 1 0 0 0 0 85 87 2 0 0 0 0 85 88 1 0 0 0 0 86 89 2 0 0 0 0 86 90 1 0 0 0 0 87 91 1 0 0 0 0 87121 1 0 0 0 0 88 92 2 0 0 0 0 88122 1 0 0 0 0 89 93 1 0 0 0 0 89123 1 0 0 0 0 90 94 2 0 0 0 0 90124 1 0 0 0 0 91 95 2 0 0 0 0 91125 1 0 0 0 0 92 95 1 0 0 0 0 92126 1 0 0 0 0 93 96 2 0 0 0 0 93127 1 0 0 0 0 94 96 1 0 0 0 0 94128 1 0 0 0 0 95 96 1 0 0 0 0 M END > 16156545 > 0 > 5340 > 4 > 0 > 0 > AAADcfB/MAAAAAAAAAAAAAAAAAAAAePECBAwYMGDAAAAAFgBVAAAHgAAAAAADizhmAYyBsMABACAAiBCAACCCAAgIAAIiAAODIgMJiKEsRuGOCjkwBGIqAeQ0PMP4AACAAAQAADAAAQAACAAAQAACAAAAA== > InChI=1S/C92H32N2O2/c1-93-21-89-79-63-47-35-33-31-32-34-36-38-43-53-41(34)51(39(31)47)67(79)71(53)83-75-55(43)46-50(38)66-64-48(36)40(32)52-42(33)54-44-37(35)49-45-56(44)76-78-60-57(45)69(81(89)65(49)63)73-61(60)62-59-58(46)70-74(62)86(78)92-84(76)72(54)68(52)80(64)90(92,82(66)70)22-94(2)88(92)28-13-17-30(18-14-28)96-20-24-5-9-26(10-6-24)25-7-3-23(4-8-25)19-95-29-15-11-27(12-16-29)87(93)91(83,89)85(73)77(59)75/h3-18,87-88H,19-22H2,1-2H3/t87-,88+,89?,90?,91?,92? > NXUIZZANJDOIQH-JMRDTMIESA-N > 19.9 > 1196.246378 > C92H32N2O2 > 1197.25068 > CN1CC23C4=C5C6=C7C8=C9C%10=C%11C7=C5C5=C7C%11=C%11C%10=C%10C%12=C%13C%14=C%15C(=C9%12)C8=C8C6=C6C4=C4C2=C2C9=C%12C%16=C2C2=C7C7=C%11C%11=C%10C%13%10CN(C(C%10%10C%13=C%14C%14=C%15C8=C6C6=C%14C(=C%13C%12=C%10C%11=C7%16)C9=C64)C4=CC=C(C=C4)OCC4=CC=C(C=C4)C4=CC=C(COC6=CC=C(C1C352)C=C6)C=C4)C > CN1CC23C4=C5C6=C7C8=C9C%10=C%11C7=C5C5=C7C%11=C%11C%10=C%10C%12=C%13C%14=C%15C(=C9%12)C8=C8C6=C6C4=C4C2=C2C9=C%12C%16=C2C2=C7C7=C%11C%11=C%10C%13%10CN([C@@H](C%10%10C%13=C%14C%14=C%15C8=C6C6=C%14C(=C%13C%12=C%10C%11=C7%16)C9=C64)C4=CC=C(C=C4)OCC4=CC=C(C=C4)C4=CC=C(COC6=CC=C([C@H]1C352)C=C6)C=C4)C > 24.9 > 1196.246378 > 0 > 96 > 2 > 4 > 0 > 0 > 0 > 1 > 1 > 1 5 255 > 10 20 8 10 22 8 11 25 8 11 31 8 12 26 8 12 32 8 13 23 8 13 29 8 14 24 8 14 30 8 15 35 8 15 37 8 16 36 8 16 38 8 17 97 5 18 98 5 19 23 8 19 33 8 20 24 8 20 34 8 21 25 8 21 39 8 22 26 8 22 40 8 23 41 8 24 42 8 25 43 8 26 44 8 29 35 8 29 47 8 30 36 8 30 48 8 31 37 8 31 49 8 32 38 8 32 50 8 33 34 8 33 40 8 34 39 8 35 55 8 36 56 8 37 53 8 38 54 8 39 42 8 40 41 8 41 45 8 42 46 8 43 46 8 43 51 8 44 45 8 44 52 8 45 47 8 46 48 8 47 57 8 48 58 8 49 51 8 49 59 8 5 11 3 50 52 8 50 60 8 51 58 8 52 57 8 53 59 8 53 61 8 54 60 8 54 62 8 55 61 8 55 63 8 56 62 8 56 64 8 57 63 8 58 64 8 59 65 8 6 12 3 60 66 8 61 67 8 62 68 8 63 66 8 64 65 8 65 68 8 66 67 8 67 68 8 69 73 8 69 74 8 7 27 3 70 75 8 70 76 8 73 77 8 74 78 8 75 79 8 76 80 8 77 81 8 78 81 8 79 82 8 8 28 3 80 82 8 85 87 8 85 88 8 86 89 8 86 90 8 87 91 8 88 92 8 89 93 8 9 19 8 9 21 8 90 94 8 91 95 8 92 95 8 93 96 8 94 96 8 $$$$