60183913 -OEChem-04242423382D 81 85 0 1 0 0 0 0 0999 V2000 11.1927 4.2264 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.4993 4.7676 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.0405 3.4610 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6115 -0.2434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8186 -1.4023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6774 -4.6071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1938 -2.4164 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9856 0.8110 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.0363 -3.5812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3186 -0.9505 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6115 -0.2434 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0598 -1.9164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9942 0.6805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4526 -3.3824 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.2846 -0.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2455 -2.6094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1115 -2.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3795 -2.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1115 -1.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3795 -1.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6425 -2.7765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2455 -0.6094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0476 -3.6843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4185 -3.6412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7455 -4.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3683 1.7349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5944 0.0176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7041 -4.3256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4695 -0.6026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6144 -2.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2616 0.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4527 -4.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3598 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4614 0.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3635 0.9598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -4.4324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7425 2.7893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9685 1.0721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7339 2.9198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9600 1.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3427 2.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1166 3.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4791 -0.3516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2671 0.2721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2203 -2.5153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6798 -1.9164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0212 1.2999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3889 0.8147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8537 -3.2219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4450 -1.2906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8834 -0.5312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1241 -0.0928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8015 -1.6464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6485 -1.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0362 -3.5871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4726 -3.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3071 -3.6511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3071 -4.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1839 -4.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3954 2.3543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7630 1.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1025 -0.3598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9718 -0.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0863 0.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2427 -4.7396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1182 -4.7870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1656 -3.9115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9362 -0.9188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3683 -2.0842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 0.7358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7119 -5.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9233 0.7469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3836 -3.4202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3659 1.5798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0599 -4.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2762 -4.7676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3650 3.2812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7313 0.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3374 0.7107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9574 2.2074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 43 1 0 0 0 0 2 43 1 0 0 0 0 3 43 1 0 0 0 0 4 11 1 0 0 0 0 4 19 1 0 0 0 0 5 17 2 0 0 0 0 6 24 1 0 0 0 0 6 77 1 0 0 0 0 7 12 1 0 0 0 0 7 14 1 0 0 0 0 7 17 1 0 0 0 0 8 13 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 16 1 0 0 0 0 9 23 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 1 0 0 0 10 44 1 0 0 0 0 11 13 1 1 0 0 0 11 45 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 6 0 0 0 14 50 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 22 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 22 1 0 0 0 0 20 29 2 0 0 0 0 21 23 1 0 0 0 0 21 30 2 0 0 0 0 22 31 2 0 0 0 0 23 32 2 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 33 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 66 1 0 0 0 0 28 67 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 1 0 0 0 0 32 72 1 0 0 0 0 33 38 2 0 0 0 0 33 39 1 0 0 0 0 34 36 2 0 0 0 0 34 73 1 0 0 0 0 35 37 2 0 0 0 0 35 74 1 0 0 0 0 36 75 1 0 0 0 0 37 76 1 0 0 0 0 38 40 1 0 0 0 0 38 78 1 0 0 0 0 39 41 2 0 0 0 0 39 79 1 0 0 0 0 40 42 2 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 41 80 1 0 0 0 0 42 81 1 0 0 0 0 M END > 60183913 > 1 > 921 > 7 > 1 > 6 > AAADcfB/MYAAAAAAAAAAAAAAAAAAAWAAAAAwYMAAAAAAAFgB9AAAHwAACAAADTzhnhYywPMMFgCoAyVyVACCgCAnAiAI2CG4bNgKdvLAtbmXcQhmxgHY6QeY2fOegAACAAASAAAAAAQAACQAAAAAAAAAAA== > (10R,11S)-13-[(1S)-2-hydroxy-1-methyl-ethyl]-11,16-dimethyl-10-[[methyl-[[3-(trifluoromethyl)phenyl]methyl]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 > (10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-10-[[methyl-[[3-(trifluoromethyl)phenyl]methyl]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 > (10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-10-[[methyl-[[3-(trifluoromethyl)phenyl]methyl]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 > (10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-10-[[methyl-[[3-(trifluoromethyl)phenyl]methyl]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 > (10R,11S)-11,16-dimethyl-10-[[methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]methyl]-13-[(2S)-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 > (10R,11S)-13-[(1S)-2-hydroxy-1-methyl-ethyl]-11,16-dimethyl-10-[[methyl-[3-(trifluoromethyl)benzyl]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/C34H38F3N3O3/c1-22-17-40(23(2)20-41)33(42)32-31(28-14-7-8-15-29(28)39(32)4)27-13-6-5-11-25(27)21-43-30(22)19-38(3)18-24-10-9-12-26(16-24)34(35,36)37/h5-16,22-23,30,41H,17-21H2,1-4H3/t22-,23-,30-/m0/s1 > ZWEDFXZUTGJBMW-ZRLASMASSA-N > 5.9 > 593.28652657 > C34H38F3N3O3 > 593.7 > CC1CN(C(=O)C2=C(C3=CC=CC=C3COC1CN(C)CC4=CC(=CC=C4)C(F)(F)F)C5=CC=CC=C5N2C)C(C)CO > C[C@H]1CN(C(=O)C2=C(C3=CC=CC=C3CO[C@H]1CN(C)CC4=CC(=CC=C4)C(F)(F)F)C5=CC=CC=C5N2C)[C@@H](C)CO > 57.9 > 593.28652657 > 0 > 43 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 15 5 11 13 5 14 25 6 16 18 8 18 21 8 20 22 8 20 29 8 21 23 8 21 30 8 22 31 8 23 32 8 29 34 8 30 35 8 31 36 8 32 37 8 33 38 8 33 39 8 34 36 8 35 37 8 38 40 8 39 41 8 40 42 8 41 42 8 9 16 8 9 23 8 $$$$