60193780 -OEChem-05052423092D 66 71 0 1 0 0 0 0 0999 V2000 6.3966 3.3301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 2.8301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -0.3035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -1.5841 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 1.3301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 1.6348 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 2.8301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -0.1699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5555 -0.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9697 -0.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -3.0841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 0.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 0.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -2.5841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6286 -3.9501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1286 -3.0841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 1.8301 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4503 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 0.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 2.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 1.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 -0.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1397 2.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 0.7387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -1.0419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -0.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 1.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4587 1.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 3.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4587 2.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -0.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -1.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -1.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -0.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2891 -2.4852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -0.2525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 0.4378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -2.4764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0505 -3.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1537 -4.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1036 -4.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7112 -3.2962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2363 -2.4735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 2.1401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8732 2.7225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4746 3.4127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4128 -1.4242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 2.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9471 3.1747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5504 2.3928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 1.2448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4621 0.8552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2592 0.8552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7635 -1.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 3.9501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 0.7101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4348 -0.9602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -1.7803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 -1.4699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9957 1.5201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 3.9501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9957 3.1401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 59 1 0 0 0 0 2 22 2 0 0 0 0 3 28 1 0 0 0 0 3 31 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 5 12 1 0 0 0 0 5 18 1 0 0 0 0 5 22 1 0 0 0 0 6 17 1 0 0 0 0 6 20 1 0 0 0 0 6 24 1 0 0 0 0 7 29 1 0 0 0 0 7 33 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 17 2 0 0 0 0 13 19 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 21 1 6 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 25 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 26 1 0 0 0 0 23 27 2 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 28 2 0 0 0 0 25 55 1 0 0 0 0 26 29 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 29 30 2 0 0 0 0 30 32 1 0 0 0 0 30 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 34 2 0 0 0 0 32 64 1 0 0 0 0 33 34 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 M END > 60193780 > 1 > 754 > 5 > 1 > 6 > AAADcfB7sAAAAAAAAAAAAAAAGABYAWAAAAA8WIAAAAAAAFgB/AAAHgAACAAADyzhngY+xvMMFgCoAzV3VACCiCAxIiAI2CE+bJgOdvrE9ZuUcChmxhnY6AeY2POPoAAAAgACAABAAAAEAAQAAAAAAAAAAA== > 1-[(1R)-1'-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-2-yl]-2-(2-pyridyl)ethanone > 1-[(1R)-1'-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]-2-(2-pyridinyl)ethanone > 1-[(1R)-1'-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methylspiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-2-yl]-2-pyridin-2-ylethanone > 1-[(1R)-1'-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methylspiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-2-yl]-2-pyridin-2-ylethanone > 1-[(1R)-1'-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-2-yl]-2-pyridin-2-yl-ethanone > 1-[(1R)-1'-(cyclopropylmethyl)-7-methoxy-9-methyl-1-methylol-spiro[1,3-dihydro-beta-carboline-4,3'-azetidine]-2-yl]-2-(2-pyridyl)ethanone > InChI=1S/C27H32N4O3/c1-29-22-12-20(34-2)8-9-21(22)25-26(29)23(14-32)31(24(33)11-19-5-3-4-10-28-19)17-27(25)15-30(16-27)13-18-6-7-18/h3-5,8-10,12,18,23,32H,6-7,11,13-17H2,1-2H3/t23-/m0/s1 > GMNZEAGJVUJKFY-QHCPKHFHSA-N > 1.6 > 460.24744090 > C27H32N4O3 > 460.6 > CN1C2=C(C=CC(=C2)OC)C3=C1C(N(CC34CN(C4)CC5CC5)C(=O)CC6=CC=CC=N6)CO > CN1C2=C(C=CC(=C2)OC)C3=C1[C@@H](N(CC34CN(C4)CC5CC5)C(=O)CC6=CC=CC=N6)CO > 70.8 > 460.24744090 > 0 > 34 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 17 8 13 19 8 18 21 6 19 20 8 19 23 8 20 25 8 23 27 8 25 28 8 27 28 8 29 30 8 30 32 8 32 34 8 33 34 8 6 17 8 6 20 8 7 29 8 7 33 8 $$$$