60194030 -OEChem-05102420152D 62 67 0 1 0 0 0 0 0999 V2000 6.3966 -3.0341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 3.3801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 2.8801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -0.2535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -1.5341 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 1.3801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 1.6848 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 1.8801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -0.1199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5555 -0.8270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9697 -0.8270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 0.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 0.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 1.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 1.8801 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1286 -3.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -2.5341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 0.0753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3874 -4.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0945 -2.7753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3534 -3.7412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 0.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 2.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 1.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 -0.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 0.7886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -0.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -0.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 1.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 0.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 -0.1199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 1.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 0.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -0.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -1.2654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -1.2654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -0.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -0.2025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 0.4877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 2.1901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2095 -2.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7886 -4.1605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5479 -4.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6934 -2.6149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9341 -2.1764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2577 2.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5138 -4.3401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9522 -3.5808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8732 2.7724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4746 3.4627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4128 -1.3743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 1.2947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7635 -1.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 4.0001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3237 0.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 -0.7399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1296 1.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4348 -0.9103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -1.7303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 -1.4200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1296 0.0701 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 55 1 0 0 0 0 3 24 2 0 0 0 0 4 28 1 0 0 0 0 4 33 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 17 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 6 24 1 0 0 0 0 7 14 1 0 0 0 0 7 22 1 0 0 0 0 7 47 1 0 0 0 0 8 29 1 0 0 0 0 8 32 2 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 22 2 0 0 0 0 18 25 1 0 0 0 0 19 21 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 26 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 29 1 0 0 0 0 25 27 2 0 0 0 0 25 52 1 0 0 0 0 26 28 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 34 2 0 0 0 0 31 57 1 0 0 0 0 32 34 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 M END > 60194030 > 1 > 798 > 5 > 2 > 4 > AAADceB7uAAAAAAAAAAAAAAAAAB4gWAAAAA8WIAAAAAAAFgB/AAAHgAQCAAADyzhngY+xvPJlgCoAzV3VACCiCA3IiAI2SG+bNgOdvLE9buUcShm1hnY6YeY2PMPoAAAAgACAABAAAAEAAQAAAAAAAAAAA== > cyclobutyl-[(1S)-1-(hydroxymethyl)-7-methoxy-2-(pyridine-2-carbonyl)spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclobutyl-[(1S)-1-(hydroxymethyl)-7-methoxy-2-[oxo(2-pyridinyl)methyl]-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanone > cyclobutyl-[(1S)-1-(hydroxymethyl)-7-methoxy-2-(pyridine-2-carbonyl)spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclobutyl-[(1S)-1-(hydroxymethyl)-7-methoxy-2-(pyridine-2-carbonyl)spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclobutyl-[(1S)-1-(hydroxymethyl)-7-methoxy-2-pyridin-2-ylcarbonyl-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]-1'-yl]methanone > cyclobutyl-[(1S)-7-methoxy-1-methylol-2-picolinoyl-spiro[3,9-dihydro-1H-beta-carboline-4,3'-azetidine]-1'-yl]methanone > InChI=1S/C26H28N4O4/c1-34-17-8-9-18-20(11-17)28-23-21(12-31)30(25(33)19-7-2-3-10-27-19)15-26(22(18)23)13-29(14-26)24(32)16-5-4-6-16/h2-3,7-11,16,21,28,31H,4-6,12-15H2,1H3/t21-/m1/s1 > BDBXTZXUAZWGDX-OAQYLSRUSA-N > 1.7 > 460.21105539 > C26H28N4O4 > 460.5 > COC1=CC2=C(C=C1)C3=C(N2)C(N(CC34CN(C4)C(=O)C5CCC5)C(=O)C6=CC=CC=N6)CO > COC1=CC2=C(C=C1)C3=C(N2)[C@H](N(CC34CN(C4)C(=O)C5CCC5)C(=O)C6=CC=CC=N6)CO > 98.8 > 460.21105539 > 0 > 34 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 14 8 13 18 8 15 23 5 18 22 8 18 25 8 22 26 8 25 27 8 26 28 8 27 28 8 29 30 8 30 31 8 31 34 8 32 34 8 7 14 8 7 22 8 8 29 8 8 32 8 $$$$