60193940 -OEChem-05072406062D 63 67 0 1 0 0 0 0 0999 V2000 8.9946 1.9983 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 -2.9159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 3.4983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4946 1.1323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4946 2.8644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -0.1353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -1.4159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 1.4983 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.4503 1.8031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5555 -0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9697 -0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 0.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 0.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 1.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 1.9983 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4503 0.1936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -2.4159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -2.9159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 0.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 2.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2331 -3.9104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0422 -2.5092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2113 -4.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7113 -3.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 -0.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1397 2.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 0.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 2.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -0.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -0.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -0.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -1.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -1.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -0.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -0.0843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 0.6060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 2.3083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 -2.2967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8732 2.8907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4746 3.5809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6131 -3.9104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1683 -4.5270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5437 -2.1447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7322 -1.9722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0197 -4.7080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7777 -4.3705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2129 -3.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1261 -2.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4128 -1.2560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 2.9462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9471 3.3429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5504 2.5610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 1.4130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1707 1.9614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3976 2.8083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5506 3.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7635 -1.4408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 4.1183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4348 -0.7920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -1.6121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 -1.3017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 29 1 0 0 0 0 2 18 2 0 0 0 0 3 21 1 0 0 0 0 3 60 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 18 1 0 0 0 0 8 13 1 0 0 0 0 8 16 1 0 0 0 0 9 15 1 0 0 0 0 9 20 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 21 1 1 0 0 0 16 39 1 0 0 0 0 17 20 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 19 40 1 0 0 0 0 20 28 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 24 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 25 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 30 2 0 0 0 0 26 51 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 2 0 0 0 0 28 55 1 0 0 0 0 29 56 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 32 63 1 0 0 0 0 M END > 60193940 > 1 > 833 > 6 > 1 > 4 > AAADceB7OABAAAAAAAAAAAAAAABYAeIAAAA8QAAAAAAAAFgB8AAAHgQASAAADyzhngayxvMMFgKoAyVyVHCCiCAhIiAI2CE+bJgOdvLE8ZuUcChmxhnY6AeY2PMPoAAAAgACAABAAAAEAAQAAAAAAAAAAA== > cyclopentyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-methylsulfonyl-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclopentyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-methylsulfonyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanone > cyclopentyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-methylsulfonylspiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclopentyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-methylsulfonylspiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclopentyl-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-methylsulfonyl-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclopentyl-[(1S)-2-mesyl-7-methoxy-9-methyl-1-methylol-spiro[1,3-dihydro-beta-carboline-4,3'-azetidine]-1'-yl]methanone > InChI=1S/C23H31N3O5S/c1-24-18-10-16(31-2)8-9-17(18)20-21(24)19(11-27)26(32(3,29)30)14-23(20)12-25(13-23)22(28)15-6-4-5-7-15/h8-10,15,19,27H,4-7,11-14H2,1-3H3/t19-/m1/s1 > XDSGRCJHGUGTAB-LJQANCHMSA-N > 1.1 > 461.19844227 > C23H31N3O5S > 461.6 > CN1C2=C(C=CC(=C2)OC)C3=C1C(N(CC34CN(C4)C(=O)C5CCCC5)S(=O)(=O)C)CO > CN1C2=C(C=CC(=C2)OC)C3=C1[C@H](N(CC34CN(C4)C(=O)C5CCCC5)S(=O)(=O)C)CO > 101 > 461.19844227 > 0 > 32 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 14 15 8 14 17 8 16 21 5 17 20 8 17 26 8 20 28 8 26 30 8 28 31 8 30 31 8 9 15 8 9 20 8 $$$$