60192294 -OEChem-04182407082D 60 64 0 1 0 0 0 0 0999 V2000 8.9946 -0.1029 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.4587 1.8971 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 3.3971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 -3.0171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -0.2365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -1.5171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 1.3971 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.4503 1.7018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -0.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5555 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9697 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 0.3971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 0.3971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 1.8971 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3966 1.3971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 0.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 1.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 0.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -2.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 2.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 -0.8596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -3.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 0.8057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 1.3971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -0.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -0.1366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -4.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 0.3971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 1.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 1.3971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 -0.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 0.3971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -0.3716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -1.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -1.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -0.3716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -0.1855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 0.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 2.2071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2577 2.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3932 2.3721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5961 2.3721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0505 3.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 2.7894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4128 -1.3573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 -3.1248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -2.4345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 1.3117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7635 -1.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 4.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5086 -4.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -4.6371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7486 -4.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 2.5171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 -0.7229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1296 0.0871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4348 -0.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -1.7133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 -1.4029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 30 1 0 0 0 0 3 20 1 0 0 0 0 3 51 1 0 0 0 0 4 19 2 0 0 0 0 5 26 1 0 0 0 0 5 33 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 19 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 15 1 0 0 0 0 8 18 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 1 0 0 0 14 40 1 0 0 0 0 16 18 2 0 0 0 0 16 21 1 0 0 0 0 17 24 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 23 1 0 0 0 0 19 22 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 25 2 0 0 0 0 21 46 1 0 0 0 0 22 27 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 26 2 0 0 0 0 23 49 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 31 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 32 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 M END > 60192294 > 1 > 721 > 6 > 2 > 5 > AAADceB7MYAAAAAAAAAAAAAAAABYAWAAAAA8YIAAAAAAAFgB9AAAHwAQCAAADizhng4yxvPJlgCoAyVyVACCiCAhIiAImSE+bJgOduLE8ZuUcChm1hnY6AeQ0PMPoAAAAgACAABAAAAEAAQAAAAAAAAAAA== > 1-[(1S)-2-[(2,5-difluorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]propan-1-one > 1-[(1S)-2-[(2,5-difluorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]-1-propanone > 1-[(1S)-2-[(2,5-difluorophenyl)methyl]-1-(hydroxymethyl)-7-methoxyspiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]propan-1-one > 1-[(1S)-2-[(2,5-difluorophenyl)methyl]-1-(hydroxymethyl)-7-methoxyspiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]propan-1-one > 1-[(1S)-2-[[2,5-bis(fluoranyl)phenyl]methyl]-1-(hydroxymethyl)-7-methoxy-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]propan-1-one > 1-[(1S)-2-(2,5-difluorobenzyl)-7-methoxy-1-methylol-spiro[3,9-dihydro-1H-beta-carboline-4,3'-azetidine]-1'-yl]propan-1-one > InChI=1S/C25H27F2N3O3/c1-3-22(32)30-13-25(14-30)12-29(10-15-8-16(26)4-7-19(15)27)21(11-31)24-23(25)18-6-5-17(33-2)9-20(18)28-24/h4-9,21,28,31H,3,10-14H2,1-2H3/t21-/m1/s1 > QQUUFBOXHSZBQJ-OAQYLSRUSA-N > 2.5 > 455.20204806 > C25H27F2N3O3 > 455.5 > CCC(=O)N1CC2(C1)CN(C(C3=C2C4=C(N3)C=C(C=C4)OC)CO)CC5=C(C=CC(=C5)F)F > CCC(=O)N1CC2(C1)CN([C@@H](C3=C2C4=C(N3)C=C(C=C4)OC)CO)CC5=C(C=CC(=C5)F)F > 68.8 > 455.20204806 > 0 > 33 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 15 8 13 16 8 14 20 5 16 18 8 16 21 8 18 23 8 21 25 8 23 26 8 24 28 8 24 29 8 25 26 8 28 31 8 29 30 8 30 32 8 31 32 8 8 15 8 8 18 8 $$$$