72674797 -OEChem-04162401022D 81 86 0 1 0 0 0 0 0999 V2000 6.6115 0.2716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8186 -0.8873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6774 -4.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2991 4.2526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2789 2.9757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1938 -1.9014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9856 1.3260 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.0363 -3.0663 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3186 -0.4355 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6115 0.2716 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0598 -1.4014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9942 1.1955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4526 -2.8674 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2846 -0.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2455 -2.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1115 -1.5944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3795 -1.5944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1115 -0.5944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3795 -0.5944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6425 -2.2615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2455 -0.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0476 -3.1693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4185 -3.1262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7455 -3.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3683 2.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5944 0.5326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7041 -3.8106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4695 -0.0876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6144 -2.1383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2616 0.9471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4527 -4.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3598 2.3804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4614 0.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3635 1.4748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -3.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7425 3.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9685 1.5870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7339 3.4348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9600 1.7176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3427 2.6414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2520 3.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4791 0.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2671 0.7871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2203 -2.0003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6798 -1.4014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0212 1.8149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3889 1.3297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8537 -2.7069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4450 -0.7756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8834 -0.0162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1241 0.4222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8015 -1.1314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6485 -0.9044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0362 -3.0722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4726 -2.5086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3071 -3.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3071 -4.0129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1839 -4.0129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3954 2.8693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7630 2.3841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1025 0.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9718 0.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0863 0.9101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2427 -4.2246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1182 -4.2720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1656 -3.3965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9362 -0.4038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3683 -1.5692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 1.2508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7119 -4.5800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9233 1.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3836 -2.9052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3659 2.0948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0599 -4.4207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2762 -4.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3650 3.7962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7313 1.0142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3374 1.2257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8701 3.9210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3651 4.5790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 18 1 0 0 0 0 2 16 2 0 0 0 0 3 23 1 0 0 0 0 3 76 1 0 0 0 0 4 39 1 0 0 0 0 4 42 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 11 1 0 0 0 0 6 13 1 0 0 0 0 6 16 1 0 0 0 0 7 12 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 15 1 0 0 0 0 8 22 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 43 1 0 0 0 0 10 12 1 0 0 0 0 10 44 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 13 49 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 21 1 0 0 0 0 19 28 2 0 0 0 0 20 22 1 0 0 0 0 20 29 2 0 0 0 0 21 30 2 0 0 0 0 22 31 2 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 32 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 27 67 1 0 0 0 0 28 33 1 0 0 0 0 28 68 1 0 0 0 0 29 34 1 0 0 0 0 29 69 1 0 0 0 0 30 35 1 0 0 0 0 30 70 1 0 0 0 0 31 36 1 0 0 0 0 31 71 1 0 0 0 0 32 37 2 0 0 0 0 32 38 1 0 0 0 0 33 35 2 0 0 0 0 33 72 1 0 0 0 0 34 36 2 0 0 0 0 34 73 1 0 0 0 0 35 74 1 0 0 0 0 36 75 1 0 0 0 0 37 39 1 0 0 0 0 37 77 1 0 0 0 0 38 40 2 0 0 0 0 38 78 1 0 0 0 0 39 41 2 0 0 0 0 40 41 1 0 0 0 0 40 79 1 0 0 0 0 42 80 1 0 0 0 0 42 81 1 0 0 0 0 M END > 72674797 > 1 > 906 > 6 > 1 > 6 > AAADcfB/OAAAAAAAAAAAAAAAAAAAAWJAAAAwYMAAAAAAAFgB9AAAHgAACAAADTzhngcyzvMMFgCoAyVyVACCiCAnIiAI2CG+7NgfdvLEtbu3cSpmxhHe6Qe42fOeoAABAAASQABAAAIAACSAAAAAAAAAAA== > 10-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-13-(2-hydroxy-1-methyl-ethyl)-11,16-dimethyl-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-14-one > 10-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-13-(1-hydroxypropan-2-yl)-11,16-dimethyl-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-14-one > 10-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-13-(1-hydroxypropan-2-yl)-11,16-dimethyl-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-14-one > 10-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-13-(1-hydroxypropan-2-yl)-11,16-dimethyl-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-14-one > 10-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-11,16-dimethyl-13-(1-oxidanylpropan-2-yl)-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-14-one > 13-(2-hydroxy-1-methyl-ethyl)-11,16-dimethyl-10-[[methyl(piperonyl)amino]methyl]-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-14-one > InChI=1S/C34H39N3O5/c1-22-16-37(23(2)19-38)34(39)33-32(27-11-7-8-12-28(27)36(33)4)26-10-6-5-9-25(26)20-40-31(22)18-35(3)17-24-13-14-29-30(15-24)42-21-41-29/h5-15,22-23,31,38H,16-21H2,1-4H3 > RQFWHIVKBRAAON-UHFFFAOYSA-N > 4.8 > 569.28897135 > C34H39N3O5 > 569.7 > CC1CN(C(=O)C2=C(C3=CC=CC=C3COC1CN(C)CC4=CC5=C(C=C4)OCO5)C6=CC=CC=C6N2C)C(C)CO > CC1CN(C(=O)C2=C(C3=CC=CC=C3COC1CN(C)CC4=CC5=C(C=C4)OCO5)C6=CC=CC=C6N2C)C(C)CO > 76.4 > 569.28897135 > 0 > 42 > 0 > 3 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 12 3 13 24 3 15 17 8 17 20 8 19 21 8 19 28 8 20 22 8 20 29 8 21 30 8 22 31 8 28 33 8 29 34 8 30 35 8 31 36 8 32 37 8 32 38 8 33 35 8 34 36 8 37 39 8 38 40 8 39 41 8 40 41 8 8 15 8 8 22 8 9 14 3 $$$$