60188795 -OEChem-03282409412D 57 61 0 1 0 0 0 0 0999 V2000 5.0302 1.2749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3512 -3.7246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0954 2.3513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -0.4199 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3512 -1.7246 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6192 -1.7246 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6192 -0.7246 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6730 -2.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4852 -2.2246 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0894 -1.2246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4852 -0.2246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3838 0.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3623 0.5306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8377 1.5746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5461 0.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3512 -0.7246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4852 -3.2246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4692 0.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2613 -0.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3672 1.3446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2693 0.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3634 2.3446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2274 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4954 2.8413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2236 3.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4916 3.8413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3556 4.3446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9595 2.8546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5293 -2.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5293 0.1206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1356 -2.3386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -2.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0222 -2.5346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6285 -0.8099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6285 -1.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4979 0.1274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3571 1.9132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4992 2.0940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0267 -0.1478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8847 -0.3286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8882 -2.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6614 1.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4806 0.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8746 -3.1170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2732 -3.8072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9287 1.1207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7946 -0.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8074 1.1318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3512 -4.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9597 2.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7593 4.1600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9534 4.1492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3532 4.9646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2715 2.3189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4952 3.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6474 3.3904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 18 1 0 0 0 0 2 50 1 0 0 0 0 3 24 1 0 0 0 0 3 29 1 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 9 1 0 0 0 0 5 16 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 30 1 6 0 0 0 7 11 1 0 0 0 0 7 31 1 6 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 18 1 6 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 16 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 37 1 0 0 0 0 14 17 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 20 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 21 2 0 0 0 0 19 47 1 0 0 0 0 20 22 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 26 2 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 26 28 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END > 60188795 > 1 > 595 > 4 > 2 > 4 > AAADceB7MAAAAAAAAAAAAAAAAABgAWAAAAA8YIAAAAAAAFixQAAAHgAQCAAADSzhmAYyxoPABgCIAiVSUACCCAAhIgAIiIEObIgONjLE8ZuEcChk1hHY6Ae40PIOiAACAAAKAAAQAAQAABQAAAAAAAAAAA== > [(3aR,4S,9bR)-4-(hydroxymethyl)-8-(2-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-cyclobutyl-methanone > [(3aR,4S,9bR)-4-(hydroxymethyl)-8-(2-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-cyclobutylmethanone > [(3aR,4S,9bR)-4-(hydroxymethyl)-8-(2-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-cyclobutylmethanone > [(3aR,4S,9bR)-4-(hydroxymethyl)-8-(2-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-cyclobutylmethanone > [(3aR,4S,9bR)-4-(hydroxymethyl)-8-(2-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-cyclobutyl-methanone > [(3aR,4S,9bR)-8-(2-methoxyphenyl)-4-methylol-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-cyclobutyl-methanone > InChI=1S/C24H28N2O3/c1-29-22-8-3-2-7-17(22)16-9-10-20-19(13-16)23-18(21(14-27)25-20)11-12-26(23)24(28)15-5-4-6-15/h2-3,7-10,13,15,18,21,23,25,27H,4-6,11-12,14H2,1H3/t18-,21-,23-/m1/s1 > HQOAOZDBFVRWJO-JMUQELJHSA-N > 3.4 > 392.20999276 > C24H28N2O3 > 392.5 > COC1=CC=CC=C1C2=CC3=C(C=C2)NC(C4C3N(CC4)C(=O)C5CCC5)CO > COC1=CC=CC=C1C2=CC3=C(C=C2)N[C@@H]([C@@H]4[C@H]3N(CC4)C(=O)C5CCC5)CO > 61.8 > 392.20999276 > 0 > 29 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 16 8 11 19 8 16 20 8 19 21 8 20 22 8 21 22 8 23 24 8 23 25 8 24 26 8 25 27 8 26 28 8 27 28 8 6 30 6 7 31 6 9 18 6 $$$$