16155630 -OEChem-05142408462D 107142 0 1 0 0 0 0 0999 V2000 10.2467 3.7597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -0.9333 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5774 1.7530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3526 -0.6909 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2187 -1.1909 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6215 2.7520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3524 -1.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4647 2.2143 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2347 1.8506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9786 0.8438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3526 0.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0847 -0.6909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2187 0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0847 0.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4426 -1.1977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2347 -2.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8470 3.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3764 2.0936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3367 2.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8847 0.3299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4426 0.8160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9786 -1.2256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9433 -2.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8316 3.2830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6209 1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4490 1.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8558 0.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2228 -2.3395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4346 -2.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3367 -2.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4346 1.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8847 -0.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8011 4.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8192 2.9829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7925 -0.8628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4095 3.2128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8364 3.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1844 -0.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4212 2.1225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4207 -1.5926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9411 -0.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4010 -3.3718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4037 -2.2630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6139 -3.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9356 5.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9720 0.9279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6613 1.4015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0687 -2.5619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 4.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8961 -0.1164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7403 -1.4736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6182 -4.0678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6352 -3.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9498 5.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8983 4.7373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8134 -3.1633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 0.4656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8572 -5.1106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2256 1.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8731 3.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5438 -4.2652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8845 -2.0206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8548 -4.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6818 -3.6286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1458 -1.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7984 -4.1687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8569 -3.0360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8109 -4.8668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2777 -2.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8419 -3.4006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6865 0.1692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2351 -0.1047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8857 -3.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7676 -0.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4854 -2.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8001 -2.7175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1130 -1.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4578 -1.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6728 0.7944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2376 -0.1753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1129 1.6230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6778 0.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1154 1.5524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3351 -2.6864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3833 -2.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0131 2.0909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1215 1.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0639 -0.3053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8563 3.4927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2916 -3.4981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0629 -2.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8447 1.1517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7281 0.7488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4789 -3.9032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8662 -2.7810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2747 -0.0268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0880 0.0071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9939 -2.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2044 -3.1875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6349 -1.2535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0062 -2.1814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2912 0.8382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9663 -0.7328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3842 2.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0593 0.6095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7683 2.0661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 36 2 0 0 0 0 2 35 2 0 0 0 0 2 73 1 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 15 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 16 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 23 1 0 0 0 0 7 35 1 0 0 0 0 8 26 1 0 0 0 0 8 36 1 0 0 0 0 9 13 1 0 0 0 0 9 19 2 0 0 0 0 10 14 1 0 0 0 0 10 20 2 0 0 0 0 11 13 2 0 0 0 0 11 21 1 0 0 0 0 12 14 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 15 27 2 0 0 0 0 15 29 1 0 0 0 0 16 28 1 0 0 0 0 16 30 2 0 0 0 0 17 24 1 0 0 0 0 17 33 2 0 0 0 0 18 25 1 0 0 0 0 18 34 2 0 0 0 0 19 24 1 0 0 0 0 19 31 1 0 0 0 0 20 25 1 0 0 0 0 20 32 1 0 0 0 0 21 27 1 0 0 0 0 21 31 2 0 0 0 0 22 28 2 0 0 0 0 22 32 1 0 0 0 0 23 56 1 0 0 0 0 23 85 1 0 0 0 0 23 86 1 0 0 0 0 24 37 2 0 0 0 0 25 38 2 0 0 0 0 26 59 1 0 0 0 0 26 87 1 0 0 0 0 26 88 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 29 30 1 0 0 0 0 29 43 2 0 0 0 0 30 44 1 0 0 0 0 31 39 1 0 0 0 0 32 40 2 0 0 0 0 33 34 1 0 0 0 0 33 45 1 0 0 0 0 34 46 1 0 0 0 0 35 89 1 0 0 0 0 36 90 1 0 0 0 0 37 39 1 0 0 0 0 37 49 1 0 0 0 0 38 40 1 0 0 0 0 38 50 1 0 0 0 0 39 47 2 0 0 0 0 40 48 1 0 0 0 0 41 47 1 0 0 0 0 41 51 2 0 0 0 0 42 48 1 0 0 0 0 42 52 2 0 0 0 0 43 51 1 0 0 0 0 43 53 1 0 0 0 0 44 52 1 0 0 0 0 44 53 2 0 0 0 0 45 49 2 0 0 0 0 45 54 1 0 0 0 0 46 50 2 0 0 0 0 46 55 1 0 0 0 0 47 57 1 0 0 0 0 48 58 2 0 0 0 0 49 60 1 0 0 0 0 50 61 1 0 0 0 0 51 62 1 0 0 0 0 52 63 1 0 0 0 0 53 64 1 0 0 0 0 54 55 2 0 0 0 0 54 65 1 0 0 0 0 55 66 1 0 0 0 0 56 71 1 0 0 0 0 56 91 1 0 0 0 0 56 92 1 0 0 0 0 57 60 1 0 0 0 0 57 62 2 0 0 0 0 58 61 1 0 0 0 0 58 63 1 0 0 0 0 59 72 1 0 0 0 0 59 93 1 0 0 0 0 59 94 1 0 0 0 0 60 65 2 0 0 0 0 61 66 2 0 0 0 0 62 67 1 0 0 0 0 63 68 2 0 0 0 0 64 67 2 0 0 0 0 64 68 1 0 0 0 0 65 69 1 0 0 0 0 66 70 1 0 0 0 0 67 69 1 0 0 0 0 68 70 1 0 0 0 0 69 70 2 0 0 0 0 71 74 1 0 0 0 0 71 95 1 0 0 0 0 71 96 1 0 0 0 0 72 75 1 0 0 0 0 72 97 1 0 0 0 0 72 98 1 0 0 0 0 73 80 2 0 0 0 0 73 81 1 0 0 0 0 74 76 2 0 0 0 0 74 77 1 0 0 0 0 75 78 2 0 0 0 0 75 79 1 0 0 0 0 76 78 1 0 0 0 0 76 99 1 0 0 0 0 77 79 2 0 0 0 0 77100 1 0 0 0 0 78101 1 0 0 0 0 79102 1 0 0 0 0 80 82 1 0 0 0 0 80103 1 0 0 0 0 81 83 2 0 0 0 0 81104 1 0 0 0 0 82 84 2 0 0 0 0 82105 1 0 0 0 0 83 84 1 0 0 0 0 83106 1 0 0 0 0 84107 1 0 0 0 0 M END > 16155630 > 1 > 4690 > 2 > 0 > 3 > AAADceB+IAAAAAAAAAAAAAAAGDAAAYMGDBAwYMGDBggAAAABVAAAHgAAAAAADgjhmAYwwMIAAACoAjxzxACCAAAgAgAIiAEgZIgIIDKAkZGAIABggAAIyAcYiMCPwAACAAAQAACAAAQAACAAAQAACAAAAA== > 5-(phenyliminomethyl)pentatriacontacyclo[67.2.2.19,12.05,30.06,30.06,52.07,20.08,51.010,49.011,46.013,17.014,45.015,38.016,24.018,22.021,29.023,27.025,37.026,34.028,32.031,54.033,56.035,57.036,40.039,44.041,58.042,60.043,47.048,61.050,62.053,63.055,64.059,64.059,65.019,74]tetraheptaconta-1(72),7,9(74),10(49),11,13(17),14,16(24),18(22),19,21(29),23(27),25,28(32),31(54),33,35(57),36(40),37,39(44),41(58),42(60),43(47),45,48(61),50,52,55,62,69(73),70-hentriacontaene-65-carbaldehyde > 5-(phenyliminomethyl)-65-pentatriacontacyclo[67.2.2.19,12.05,30.06,30.06,52.07,20.08,51.010,49.011,46.013,17.014,45.015,38.016,24.018,22.021,29.023,27.025,37.026,34.028,32.031,54.033,56.035,57.036,40.039,44.041,58.042,60.043,47.048,61.050,62.053,63.055,64.059,64.059,65.019,74]tetraheptaconta-1(72),7,9(74),10(49),11,13(17),14,16(24),18(22),19,21(29),23(27),25,28(32),31(54),33,35(57),36(40),37,39(44),41(58),42(60),43(47),45,48(61),50,52,55,62,69(73),70-hentriacontaenecarboxaldehyde > 5-(phenyliminomethyl)pentatriacontacyclo[67.2.2.19,12.05,30.06,30.06,52.07,20.08,51.010,49.011,46.013,17.014,45.015,38.016,24.018,22.021,29.023,27.025,37.026,34.028,32.031,54.033,56.035,57.036,40.039,44.041,58.042,60.043,47.048,61.050,62.053,63.055,64.059,64.059,65.019,74]tetraheptaconta-1(72),7,9(74),10(49),11,13(17),14,16(24),18(22),19,21(29),23(27),25,28(32),31(54),33,35(57),36(40),37,39(44),41(58),42(60),43(47),45,48(61),50,52,55,62,69(73),70-hentriacontaene-65-carbaldehyde > 5-(phenyliminomethyl)pentatriacontacyclo[67.2.2.19,12.05,30.06,30.06,52.07,20.08,51.010,49.011,46.013,17.014,45.015,38.016,24.018,22.021,29.023,27.025,37.026,34.028,32.031,54.033,56.035,57.036,40.039,44.041,58.042,60.043,47.048,61.050,62.053,63.055,64.059,64.059,65.019,74]tetraheptaconta-1(72),7,9(74),10(49),11,13(17),14,16(24),18(22),19,21(29),23(27),25,28(32),31(54),33,35(57),36(40),37,39(44),41(58),42(60),43(47),45,48(61),50,52,55,62,69(73),70-hentriacontaene-65-carbaldehyde > 5-(phenyliminomethyl)pentatriacontacyclo[67.2.2.19,12.05,30.06,30.06,52.07,20.08,51.010,49.011,46.013,17.014,45.015,38.016,24.018,22.021,29.023,27.025,37.026,34.028,32.031,54.033,56.035,57.036,40.039,44.041,58.042,60.043,47.048,61.050,62.053,63.055,64.059,64.059,65.019,74]tetraheptaconta-1(72),7,9(74),10(49),11,13(17),14,16(24),18(22),19,21(29),23(27),25,28(32),31(54),33,35(57),36(40),37,39(44),41(58),42(60),43(47),45,48(61),50,52,55,62,69(73),70-hentriacontaene-65-carbaldehyde > 5-(phenyliminomethyl)pentatriacontacyclo[67.2.2.19,12.05,30.06,30.06,52.07,20.08,51.010,49.011,46.013,17.014,45.015,38.016,24.018,22.021,29.023,27.025,37.026,34.028,32.031,54.033,56.035,57.036,40.039,44.041,58.042,60.043,47.048,61.050,62.053,63.055,64.059,64.059,65.019,74]tetraheptaconta-1(72),7,9(74),10(49),11,13(17),14,16(24),18(22),19,21(29),23(27),25,28(32),31(54),33,35(57),36(40),37,39(44),41(58),42(60),43(47),45,48(61),50,52,55,62,69(73),70-hentriacontaene-65-carbaldehyde > InChI=1S/C82H23NO/c84-17-78-15-5-7-19-12-10-18(11-13-19)6-4-14-77(16-83-20-8-2-1-3-9-20)79-69-55-49-38-30-23-21-22-24-29(23)42(49)50-39-31(24)28-33-26(22)35-34-25(21)32-27(30)36-43-51-40(32)45(34)57-58-46(35)41(33)52-44-37(28)48(39)60-64-54(44)66-62(52)72(58)81(78)71(57)61(51)65-53(43)63(59(69)47(36)38)73(79)67-68(76(66)82(78,81)75(65)67)74(64)80(77,79)70(60)56(50)55/h1-3,8-13,16-17H,4-7,14-15H2 > GOXWQBMZGGHMDQ-UHFFFAOYSA-N > 15.8 > 1037.177964357 > C82H23NO > 1038.1 > C1CC2=CC=C(CCCC3(C45C36C7=C8C9=C3C%10=C%11C%12=C%13C%14=C%15C%16=C%13C%13=C%17C%12=C%10C%10=C9C9=C7C7=C%12C%18=C%19C%20=C%21C(=C%16C%16=C%21C%18=C%18C%12%12C9(C%10=C%17C%18=C%16%13)C%12(C1)C=NC1=CC=CC=C1)C1=C%15C9=C%10C%14=C%11C%11=C%10C(=C4C8=C%113)C3=C5C(=C%20C1=C93)C%19=C67)C=O)C=C2 > C1CC2=CC=C(CCCC3(C45C36C7=C8C9=C3C%10=C%11C%12=C%13C%14=C%15C%16=C%13C%13=C%17C%12=C%10C%10=C9C9=C7C7=C%12C%18=C%19C%20=C%21C(=C%16C%16=C%21C%18=C%18C%12%12C9(C%10=C%17C%18=C%16%13)C%12(C1)C=NC1=CC=CC=C1)C1=C%15C9=C%10C%14=C%11C%11=C%10C(=C4C8=C%113)C3=C5C(=C%20C1=C93)C%19=C67)C=O)C=C2 > 29.4 > 1037.177964357 > 0 > 84 > 0 > 3 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 14 8 10 20 8 11 13 8 11 21 8 12 14 8 12 22 8 13 14 8 15 27 8 15 29 8 16 28 8 16 30 8 17 24 8 17 33 8 18 25 8 18 34 8 19 24 8 19 31 8 20 25 8 20 32 8 21 27 8 21 31 8 22 28 8 22 32 8 24 37 8 25 38 8 27 41 8 28 42 8 29 30 8 29 43 8 30 44 8 31 39 8 32 40 8 33 34 8 33 45 8 34 46 8 37 39 8 37 49 8 38 40 8 38 50 8 39 47 8 4 15 3 40 48 8 41 47 8 41 51 8 42 48 8 42 52 8 43 51 8 43 53 8 44 52 8 44 53 8 45 49 8 45 54 8 46 50 8 46 55 8 47 57 8 48 58 8 49 60 8 5 16 3 50 61 8 51 62 8 52 63 8 53 64 8 54 55 8 54 65 8 55 66 8 57 60 8 57 62 8 58 61 8 58 63 8 60 65 8 61 66 8 62 67 8 63 68 8 64 67 8 64 68 8 65 69 8 66 70 8 67 69 8 68 70 8 69 70 8 73 80 8 73 81 8 74 76 8 74 77 8 75 78 8 75 79 8 76 78 8 77 79 8 8 36 3 80 82 8 81 83 8 82 84 8 83 84 8 9 13 8 9 19 8 $$$$