5748293 -OEChem-03292406002D 55 59 0 1 0 0 0 0 0999 V2000 6.3981 0.2400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5442 -3.3293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9176 -1.7946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1102 0.7309 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.6660 -0.7600 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5321 -0.2600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5321 0.7400 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4629 -0.3901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4421 -0.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -1.8015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3793 0.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 1.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5749 2.3782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.7400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4501 -1.8084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 -2.3293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2659 3.3293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5968 2.5861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.7947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0574 -2.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9571 1.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8682 -0.2149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0546 -0.2048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0537 -0.8682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6466 -0.1816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0408 -1.6860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4319 -2.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1877 0.9952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7729 0.2766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 1.7149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 1.7149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8929 1.4768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6466 2.2349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2934 1.8258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6636 -2.3905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0601 -1.6976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8133 3.6203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8842 3.8178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0710 2.9147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3645 2.0113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.8946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9541 -0.7969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -0.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5741 0.2769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.0729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7413 -1.7713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5241 -2.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3736 -2.8379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6 1 1 1 0 0 0 1 23 1 0 0 0 0 2 18 2 0 0 0 0 3 21 1 0 0 0 0 3 26 1 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 10 1 1 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 13 1 0 0 0 0 7 27 1 1 0 0 0 8 11 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 17 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 18 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 16 2 0 0 0 0 12 21 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 15 40 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 24 2 0 0 0 0 22 25 2 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 M END > 5748293 > 1 > 576 > 4 > 0 > 4 > AAADceB6MAAAAAAAAAAAAAAAGAAAAAAAAAA8YMEAAAAWAADxAAAAHgAAAAAAD2zBmAYyBoMABACIAqBSAAACCAAgIAAIiAEOCIgOJjKEsRuFMCAkwBGYqAf63fPfgAABAAAYAADQAAaAADQgAAAAAAAAAA== > (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dimethoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one > (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dimethoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one > (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dimethoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one > (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dimethoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one > (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dimethoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one > (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dimethoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one > InChI=1S/C22H29NO3/c1-25-18-5-3-4-16-12-19-22(26-2)9-8-17(24)13-21(22,20(16)18)10-11-23(19)14-15-6-7-15/h3-5,15,19H,6-14H2,1-2H3/t19-,21-,22-/m1/s1 > INUCRGMCKDQKNA-CEMLEFRQSA-N > 2.5 > 355.21474379 > C22H29NO3 > 355.5 > COC1=CC=CC2=C1C34CCN(C(C2)C3(CCC(=O)C4)OC)CC5CC5 > COC1=CC=CC2=C1[C@]34CCN([C@H](C2)[C@@]3(CCC(=O)C4)OC)CC5CC5 > 38.8 > 355.21474379 > 0 > 26 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 6 1 5 12 16 8 12 21 8 16 22 8 21 24 8 22 25 8 24 25 8 5 10 5 7 27 5 $$$$