60158055 -OEChem-05132420302D 72 77 0 1 0 0 0 0 0999 V2000 11.6646 -3.3238 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.8081 2.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1219 -0.7843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8113 2.6599 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.7712 -0.2554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 1.5425 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1421 1.9168 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.1629 1.4709 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4659 0.6969 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4487 0.9213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8334 2.4591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 2.1247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5022 3.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1418 1.2668 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8550 3.0757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5241 3.8189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8609 3.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5545 2.1275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4545 0.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7486 -0.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0992 -0.9959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5453 1.8957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1793 3.8527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8459 2.6592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 3.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4046 -1.9482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2482 0.9409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3819 -2.1599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7326 -2.6887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2727 0.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9265 0.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9755 -0.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6873 -3.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0379 -3.6410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6293 -0.7487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0153 -3.8527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6538 -0.9688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5685 1.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7280 2.1059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0483 0.2385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8337 0.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4207 0.3019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4464 2.5517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8470 3.0789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1162 3.6973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5239 4.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9479 1.8557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7564 4.3937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9983 4.1474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3572 0.9225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8656 0.1231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6483 -0.2720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0434 0.5108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6173 -1.0730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3545 -0.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8798 0.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4150 1.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3772 4.4402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 2.5275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7515 4.1063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7985 -1.7007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1266 -2.5575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8521 1.1764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5313 0.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6213 -4.1001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0498 -1.2043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2046 -4.4431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4696 -1.5607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8636 0.1508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3952 -0.5905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1364 -1.0588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 14 2 1 1 0 0 0 2 58 1 0 0 0 0 3 21 2 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 9 5 1 1 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 12 1 0 0 0 0 6 18 1 0 0 0 0 6 51 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 7 39 1 6 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 8 40 1 6 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 15 2 0 0 0 0 13 16 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 19 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 22 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 55 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 26 1 0 0 0 0 22 24 2 0 0 0 0 22 27 1 0 0 0 0 23 25 2 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 60 1 0 0 0 0 25 61 1 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 27 30 1 0 0 0 0 27 31 2 0 0 0 0 28 33 1 0 0 0 0 28 62 1 0 0 0 0 29 34 2 0 0 0 0 29 63 1 0 0 0 0 30 32 2 0 0 0 0 30 64 1 0 0 0 0 31 35 1 0 0 0 0 31 65 1 0 0 0 0 32 37 1 0 0 0 0 32 38 1 0 0 0 0 33 36 2 0 0 0 0 34 36 1 0 0 0 0 34 66 1 0 0 0 0 35 37 2 0 0 0 0 35 67 1 0 0 0 0 36 68 1 0 0 0 0 37 69 1 0 0 0 0 38 70 1 0 0 0 0 38 71 1 0 0 0 0 38 72 1 0 0 0 0 M END > 60158055 > 1 > 842 > 3 > 2 > 4 > AAADcfB/MAAEAAAAAAAAAAAAAAAAAWAAAAA8eMECAAAAAFix9AAAHgIQCAAADT7hniYywPPJkgCoAyVyVACCgCAlBSAImSE4RtgIcPLB15GUYQhmlgDIyYeY2OOOgAACIAACAAAAAARAAAQAAAAAAAAAAA== > N-[(2S,3R,12bS)-3-[(1S)-1-hydroxyethyl]-11-(m-tolyl)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-chloro-N-methyl-benzamide > N-[(2S,3R,12bS)-3-[(1S)-1-hydroxyethyl]-11-(3-methylphenyl)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-chloro-N-methylbenzamide > N-[(2S,3R,12bS)-3-[(1S)-1-hydroxyethyl]-11-(3-methylphenyl)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-chloro-N-methylbenzamide > N-[(2S,3R,12bS)-3-[(1S)-1-hydroxyethyl]-11-(3-methylphenyl)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-chloro-N-methylbenzamide > N-[(2S,3R,12bS)-11-(3-methylphenyl)-3-[(1S)-1-oxidanylethyl]-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-chloranyl-N-methyl-benzamide > N-[(2S,3R,12bS)-3-[(1S)-1-hydroxyethyl]-11-(m-tolyl)-1,2,3,4,6,7,12,12b-octahydropyrido[2,1-a]beta-carbolin-2-yl]-3-chloro-N-methyl-benzamide > InChI=1S/C32H34ClN3O2/c1-19-7-4-8-21(15-19)24-11-6-12-25-26-13-14-36-18-27(20(2)37)28(17-29(36)31(26)34-30(24)25)35(3)32(38)22-9-5-10-23(33)16-22/h4-12,15-16,20,27-29,34,37H,13-14,17-18H2,1-3H3/t20-,27-,28-,29-/m0/s1 > AGNSYHJSVNBCDW-KXPNRLJCSA-N > 6 > 527.2339550 > C32H34ClN3O2 > 528.1 > CC1=CC(=CC=C1)C2=CC=CC3=C2NC4=C3CCN5C4CC(C(C5)C(C)O)N(C)C(=O)C6=CC(=CC=C6)Cl > CC1=CC(=CC=C1)C2=CC=CC3=C2NC4=C3CCN5[C@H]4C[C@@H]([C@@H](C5)[C@H](C)O)N(C)C(=O)C6=CC(=CC=C6)Cl > 59.6 > 527.2339550 > 0 > 38 > 4 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 15 8 15 17 8 17 18 8 17 23 8 18 22 8 14 2 5 22 24 8 23 25 8 24 25 8 26 28 8 26 29 8 27 30 8 27 31 8 28 33 8 29 34 8 30 32 8 31 35 8 32 37 8 33 36 8 34 36 8 35 37 8 9 5 5 6 12 8 6 18 8 7 39 6 8 40 6 $$$$