60193802 -OEChem-04192418012D 67 72 0 1 0 0 0 0 0999 V2000 6.3966 -3.0841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 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 11.5927 0.3301 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 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 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 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 1 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 7.2626 -2.5841 0.0000 C 0 0 0 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 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 4.8667 0.8301 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 7.2626 2.8301 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 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 10.7267 1.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 0.3301 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 11.5927 1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 -0.1699 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 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 8.3406 -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 7.7995 2.1401 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 8.1537 -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 7.8732 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 9.8606 1.9501 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 11.1252 2.3051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3281 2.3051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2501 0.4378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6486 -0.2525 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 12.2033 1.2225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8048 1.9127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3281 -0.6448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1252 -0.6448 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 1 17 2 0 0 0 0 2 23 1 0 0 0 0 2 60 1 0 0 0 0 3 22 2 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 31 1 0 0 0 0 5 34 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 7 12 1 0 0 0 0 7 15 1 0 0 0 0 7 22 1 0 0 0 0 8 14 1 0 0 0 0 8 21 1 0 0 0 0 8 26 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 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 23 1 1 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 0 0 0 0 16 42 1 0 0 0 0 18 21 2 0 0 0 0 18 25 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 27 1 0 0 0 0 22 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 28 1 0 0 0 0 24 29 1 0 0 0 0 24 49 1 0 0 0 0 25 30 2 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 31 2 0 0 0 0 27 54 1 0 0 0 0 28 32 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 33 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 M END > 60193802 > 1 > 806 > 5 > 1 > 4 > AAADcfB7OAAAAAAAAAAAAAAAGABYAWAAAAA8SIAAAAAAAFgB8AAAHgAACAAADyzhngYyxvMMFgCoAyVyVACCiCAhIiAI2CE+bJgOdvLE8ZuWcChmxhnY6Aey0PMPoAAAAgACAABAAAAEAAQAAAAAAAAAAA== > cyclopropyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-(tetrahydropyran-4-carbonyl)spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclopropyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-[4-oxanyl(oxo)methyl]-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanone > cyclopropyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-(oxane-4-carbonyl)spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclopropyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-(oxane-4-carbonyl)spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclopropyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-(oxan-4-ylcarbonyl)spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclopropyl-[(1S)-7-methoxy-9-methyl-1-methylol-2-(tetrahydropyran-4-carbonyl)spiro[1,3-dihydro-beta-carboline-4,3'-azetidine]-1'-yl]methanone > InChI=1S/C26H33N3O5/c1-27-20-11-18(33-2)5-6-19(20)22-23(27)21(12-30)29(25(32)17-7-9-34-10-8-17)15-26(22)13-28(14-26)24(31)16-3-4-16/h5-6,11,16-17,21,30H,3-4,7-10,12-15H2,1-2H3/t21-/m1/s1 > YMQYBVIJFUHAAV-OAQYLSRUSA-N > 0.5 > 467.24202116 > C26H33N3O5 > 467.6 > CN1C2=C(C=CC(=C2)OC)C3=C1C(N(CC34CN(C4)C(=O)C5CC5)C(=O)C6CCOCC6)CO > CN1C2=C(C=CC(=C2)OC)C3=C1[C@H](N(CC34CN(C4)C(=O)C5CC5)C(=O)C6CCOCC6)CO > 84.2 > 467.24202116 > 0 > 34 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 14 8 13 18 8 15 23 5 18 21 8 18 25 8 21 27 8 25 30 8 27 31 8 30 31 8 8 14 8 8 21 8 $$$$