60193834 -OEChem-04232411422D 77 82 0 1 0 0 0 0 0999 V2000 8.1286 4.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 -2.3100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 1.0564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4587 1.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 2.6900 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.2626 -0.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 2.9947 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 3.1900 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3966 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 -0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 1.3853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 4.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 0.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 2.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 0.3180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 1.1562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -3.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 1.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 -3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 -4.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -4.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -5.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3248 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 1.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 1.7977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1845 1.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 0.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 0.5823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 1.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 -0.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1845 -0.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -0.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 -0.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2577 3.5840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3932 3.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5961 3.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0505 4.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 4.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4128 -0.0644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 2.6046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7635 -0.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 -2.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -1.7274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3237 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 0.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1296 3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5316 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7256 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4348 0.3996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -0.4204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 -0.1100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5316 -5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7256 -5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 -5.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6348 1.1531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8617 2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0148 2.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 62 1 0 0 0 0 2 22 2 0 0 0 0 3 27 1 0 0 0 0 3 36 1 0 0 0 0 4 33 1 0 0 0 0 4 40 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 5 18 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 22 1 0 0 0 0 7 14 1 0 0 0 0 7 19 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 14 2 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 16 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 1 0 0 0 13 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 19 2 0 0 0 0 17 21 1 0 0 0 0 18 24 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 23 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 21 25 2 0 0 0 0 21 57 1 0 0 0 0 22 26 1 0 0 0 0 23 27 2 0 0 0 0 23 58 1 0 0 0 0 24 28 2 0 0 0 0 24 29 1 0 0 0 0 25 27 1 0 0 0 0 25 59 1 0 0 0 0 26 30 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 28 31 1 0 0 0 0 28 63 1 0 0 0 0 29 32 2 0 0 0 0 29 64 1 0 0 0 0 30 34 2 0 0 0 0 30 35 1 0 0 0 0 31 33 2 0 0 0 0 31 65 1 0 0 0 0 32 33 1 0 0 0 0 32 66 1 0 0 0 0 34 37 1 0 0 0 0 34 67 1 0 0 0 0 35 38 2 0 0 0 0 35 68 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 37 39 2 0 0 0 0 37 72 1 0 0 0 0 38 39 1 0 0 0 0 38 73 1 0 0 0 0 39 74 1 0 0 0 0 40 75 1 0 0 0 0 40 76 1 0 0 0 0 40 77 1 0 0 0 0 M END > 60193834 > 1 > 834 > 5 > 2 > 7 > AAADcfB/OAAAAAAAAAAAAAAAAAAAAWAAAAA8eMECAAAAAFgB9AAAHgAQCAAADizhngYyxvPJlgCoAyVyVACCiCAhIiAImSE+bJgOdvLEtZuUcChm1hnY6AeY2POPoAAAAgACAABAAAAEAAQAAAAAAAAAAA== > 1-[(1S)-1-(hydroxymethyl)-7-methoxy-2-[(4-methoxyphenyl)methyl]spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]-1'-yl]-2-phenyl-ethanone > 1-[(1S)-1-(hydroxymethyl)-7-methoxy-2-[(4-methoxyphenyl)methyl]-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]-2-phenylethanone > 1-[(1S)-1-(hydroxymethyl)-7-methoxy-2-[(4-methoxyphenyl)methyl]spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]-1'-yl]-2-phenylethanone > 1-[(1S)-1-(hydroxymethyl)-7-methoxy-2-[(4-methoxyphenyl)methyl]spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]-1'-yl]-2-phenylethanone > 1-[(1S)-1-(hydroxymethyl)-7-methoxy-2-[(4-methoxyphenyl)methyl]spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]-1'-yl]-2-phenyl-ethanone > 1-[(1S)-7-methoxy-1-methylol-2-p-anisyl-spiro[3,9-dihydro-1H-beta-carboline-4,4'-piperidine]-1'-yl]-2-phenyl-ethanone > InChI=1S/C33H37N3O4/c1-39-25-10-8-24(9-11-25)20-36-22-33(14-16-35(17-15-33)30(38)18-23-6-4-3-5-7-23)31-27-13-12-26(40-2)19-28(27)34-32(31)29(36)21-37/h3-13,19,29,34,37H,14-18,20-22H2,1-2H3/t29-/m1/s1 > DUBCHFNRCVHMBL-GDLZYMKVSA-N > 4.1 > 539.27840667 > C33H37N3O4 > 539.7 > COC1=CC=C(C=C1)CN2CC3(CCN(CC3)C(=O)CC4=CC=CC=C4)C5=C(C2CO)NC6=C5C=CC(=C6)OC > COC1=CC=C(C=C1)CN2CC3(CCN(CC3)C(=O)CC4=CC=CC=C4)C5=C([C@H]2CO)NC6=C5C=CC(=C6)OC > 78 > 539.27840667 > 0 > 40 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 14 8 10 17 8 13 20 5 17 19 8 17 21 8 19 23 8 21 25 8 23 27 8 24 28 8 24 29 8 25 27 8 28 31 8 29 32 8 30 34 8 30 35 8 31 33 8 32 33 8 34 37 8 35 38 8 37 39 8 38 39 8 7 14 8 7 19 8 $$$$