17749011 -OEChem-04192415392D 128165 0 1 0 0 0 0 0999 V2000 11.4907 -3.8795 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7583 -0.6709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3833 0.6592 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.7798 3.4770 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 11.0386 1.5591 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0729 1.2526 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8243 2.1777 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2068 1.7526 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2749 0.8508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9389 1.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4751 3.5186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0889 0.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 -1.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2068 2.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8262 3.3714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2968 1.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7389 1.7318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8328 1.2179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3840 0.6207 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3211 2.0805 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7389 2.7734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0770 0.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9229 -0.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9389 2.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6554 1.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2997 3.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7114 -2.6672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0729 3.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2306 4.5371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1909 -0.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2552 -0.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8328 3.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2329 4.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2888 0.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5085 -4.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2968 3.2594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3273 -6.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 2.4574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4725 -1.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4316 4.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7090 -2.3409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0889 4.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2364 4.8669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4681 -1.3268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0142 5.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2579 0.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6546 -3.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2888 4.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7012 5.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4894 -0.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6651 -2.4233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1909 4.8219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4412 -3.6414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7953 1.9813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7986 -1.8354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6858 5.7265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9388 5.4373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5945 0.9699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6743 -1.2370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2754 4.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5156 3.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7112 -0.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6906 6.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6696 6.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7387 0.4228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7273 5.8097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0892 2.9091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8731 -0.2073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3699 1.9389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0019 -0.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7798 4.4770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1376 -1.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4928 -1.1293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4852 1.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8933 1.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1604 -2.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5165 -2.1264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7241 0.9743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1039 0.4532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9400 -3.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1358 0.2136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8416 -4.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6161 -1.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0345 -5.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7182 -2.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0976 -4.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1217 -5.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5738 -3.0906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0582 -3.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1024 -4.8349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1621 -5.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1502 -3.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6139 -4.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2178 -5.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3497 -4.8817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9113 -0.0858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1618 2.2056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2311 1.3914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9445 2.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 3.8654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6797 3.2414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5147 -0.5100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3854 -0.6136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4890 0.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3998 4.4770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7798 5.0970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1598 4.4770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7505 -1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -1.0160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1717 2.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3652 0.6607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7770 -2.1574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9130 -2.2684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2858 1.4128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3737 -0.1050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9258 -5.2033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4411 -4.1158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0999 -1.2785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2359 -1.6350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1856 -4.1563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2403 -6.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9951 -2.6357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5108 -3.7688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9355 -4.2378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1234 -6.0957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7191 -3.6581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1576 -4.6822 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 19 1 0 0 0 0 3 25 1 0 0 0 0 3 71 1 0 0 0 0 4 20 1 0 0 0 0 4 26 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 19 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 20 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 7 25 1 0 0 0 0 8 14 1 0 0 0 0 8 16 1 0 0 0 0 8 26 1 0 0 0 0 9 17 1 0 0 0 0 9 23 2 0 0 0 0 10 18 2 0 0 0 0 10 24 1 0 0 0 0 11 21 1 0 0 0 0 11 29 2 0 0 0 0 12 22 1 0 0 0 0 12 30 2 0 0 0 0 13 27 2 0 0 0 0 13 35 1 0 0 0 0 14 28 2 0 0 0 0 14 36 1 0 0 0 0 15 33 1 0 0 0 0 15 37 2 0 0 0 0 16 34 1 0 0 0 0 16 38 2 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 22 1 0 0 0 0 19 69 1 0 0 0 0 19 97 1 1 0 0 0 20 70 1 0 0 0 0 20 98 1 6 0 0 0 21 32 1 0 0 0 0 22 31 2 0 0 0 0 23 27 1 0 0 0 0 23 31 1 0 0 0 0 24 28 1 0 0 0 0 24 32 2 0 0 0 0 25 99 1 0 0 0 0 25100 1 0 0 0 0 26101 1 0 0 0 0 26102 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 29 33 1 0 0 0 0 29 43 1 0 0 0 0 30 34 1 0 0 0 0 30 44 1 0 0 0 0 31 39 1 0 0 0 0 32 40 1 0 0 0 0 33 45 2 0 0 0 0 34 46 2 0 0 0 0 35 37 1 0 0 0 0 35 47 2 0 0 0 0 36 38 1 0 0 0 0 36 48 2 0 0 0 0 37 53 1 0 0 0 0 38 54 1 0 0 0 0 39 41 2 0 0 0 0 39 44 1 0 0 0 0 40 42 2 0 0 0 0 40 43 1 0 0 0 0 41 51 1 0 0 0 0 42 52 1 0 0 0 0 43 49 2 0 0 0 0 44 50 2 0 0 0 0 45 49 1 0 0 0 0 45 57 1 0 0 0 0 46 50 1 0 0 0 0 46 58 1 0 0 0 0 47 51 1 0 0 0 0 47 59 1 0 0 0 0 48 52 1 0 0 0 0 48 60 1 0 0 0 0 49 56 1 0 0 0 0 50 55 1 0 0 0 0 51 55 2 0 0 0 0 52 56 2 0 0 0 0 53 57 2 0 0 0 0 53 61 1 0 0 0 0 54 58 2 0 0 0 0 54 62 1 0 0 0 0 55 63 1 0 0 0 0 56 64 1 0 0 0 0 57 65 1 0 0 0 0 58 66 1 0 0 0 0 59 61 2 0 0 0 0 59 63 1 0 0 0 0 60 62 2 0 0 0 0 60 64 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 67 1 0 0 0 0 66 68 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 > 17749011 > 1 > 3730 > 4 > 0 > 0 > AAADcfB/MAAAAAAAAAAAAAAAAAAAAePGDBgwYMGDAAAAAFgBVAAAHgAAAAAADizhmAYyBsMABACAAiBCAACCCAAgIAAIiAAODIgMJiKEsRuGOCjkwBGIqAeQ0PMP4AACAAAQAADAAAQAACAAAQAACAAAAA== > InChI=1S/C92H32N2O2/c1-93-21-89-79-63-51-39-31-32-36-33-37-45-53(41(33)39)65(63)81(89)69-57(45)49-60-48(37)56-44(36)52-40(32)42-34-35(31)43(51)55-47-38(34)46-54(42)66-64(52)80-68(56)72(60)84-76-61(49)73(69)85-77-75-62-50-58(46)70-74(62)86(78(76)77)92(84)88(94(2)22-90(80,92)82(66)70)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(85,89)83(75)71(59(47)50)67(55)79/h3-18,87-88H,19-22H2,1-2H3/t87-,88-,89?,90?,91?,92?/m1/s1 > PEIIKFOJIXJRJL-SKLBOIESSA-N > 20.5 > 1196.246378268 > C92H32N2O2 > 1197.2 > CN1CC23C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%14=C%10C7=C4C%14=C4C22C1C1=CC=C(C=C1)OCC1=CC=C(C=C1)C1=CC=C(COC7=CC=C(C=C7)C7C%10%14C%15=C%16C%17=C%18C%19=C%20C%21=C%17C%17=C%22C%21=C3C5=C%20C3=C6C8=C5C(=C%193)C3=C6C5=C9C%11=C5C6=C(C%16=C3%18)C%10(C5=C%12C3=C%14C(=C%17%15)C(=C2%22)C4=C%133)CN7C)C=C1 > CN1CC23C4=C5C6=C7C8=C9C%10=C%11C%12=C%13C%14=C%10C7=C4C%14=C4C22[C@H]1C1=CC=C(C=C1)OCC1=CC=C(C=C1)C1=CC=C(COC7=CC=C(C=C7)[C@@H]7C%10%14C%15=C%16C%17=C%18C%19=C%20C%21=C%17C%17=C%22C%21=C3C5=C%20C3=C6C8=C5C(=C%193)C3=C6C5=C9C%11=C5C6=C(C%16=C3%18)C%10(C5=C%12C3=C%14C(=C%17%15)C(=C2%22)C4=C%133)CN7C)C=C1 > 24.9 > 1196.246378268 > 0 > 96 > 2 > 4 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 18 8 10 24 8 11 21 8 11 29 8 12 22 8 12 30 8 13 27 8 13 35 8 14 28 8 14 36 8 15 33 8 15 37 8 16 34 8 16 38 8 17 18 8 17 21 8 18 22 8 19 97 5 20 98 6 21 32 8 22 31 8 23 27 8 23 31 8 24 28 8 24 32 8 27 41 8 28 42 8 29 33 8 29 43 8 30 34 8 30 44 8 31 39 8 32 40 8 33 45 8 34 46 8 35 37 8 35 47 8 36 38 8 36 48 8 37 53 8 38 54 8 39 41 8 39 44 8 40 42 8 40 43 8 41 51 8 42 52 8 43 49 8 44 50 8 45 49 8 45 57 8 46 50 8 46 58 8 47 51 8 47 59 8 48 52 8 48 60 8 49 56 8 5 11 3 50 55 8 51 55 8 52 56 8 53 57 8 53 61 8 54 58 8 54 62 8 55 63 8 56 64 8 57 65 8 58 66 8 59 61 8 59 63 8 6 12 3 60 62 8 60 64 8 61 67 8 62 68 8 63 66 8 64 65 8 65 67 8 66 68 8 67 68 8 69 73 8 69 74 8 7 25 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 26 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 17 8 9 23 8 90 94 8 91 95 8 92 95 8 93 96 8 94 96 8 $$$$