null CDK 0225161919 null 38 42 0 0 0 0 0 0 0 0999 V2000 1.1937 -1.7170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5837 -0.9900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4083 -0.9642 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7983 -0.2372 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5995 -0.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6601 0.7822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8963 1.0941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3637 0.4640 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5391 0.4383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1491 -0.2887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3245 -0.3145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1101 0.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2799 1.1137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1045 1.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1547 1.8150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9793 1.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 2.4905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 3.2175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1994 3.2432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2352 2.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2386 2.4647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6285 1.7377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6732 3.1659 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4978 3.1402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2832 3.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6996 1.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2952 2.4662 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9074 2.1256 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7108 2.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9186 3.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 3.9584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3175 4.5293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1097 4.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3064 3.4977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1209 5.3305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7164 5.9014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8429 -1.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6675 -1.6397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 6 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 8 7 1 6 0 0 0 8 4 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 2 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 9 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 15 1 0 0 0 0 17 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 7 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 29 1 0 0 0 0 32 35 1 0 0 0 0 35 36 1 0 0 0 0 3 37 1 1 0 0 0 37 38 1 0 0 0 0 M END > CHEBI:130998 > (3aS,4S,9bR)-8-[3-[dimethylamino(oxo)methyl]phenyl]-4-(hydroxymethyl)-N-(4-methoxyphenyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide > 2 > C30H34N4O4 > 514.616 > 514.25801 > 0 > CN1[C@@H]([C@H]2CCN([C@H]2C3=C1C=CC(=C3)C4=CC(=CC=C4)C(=O)N(C)C)C(=O)NC5=CC=C(C=C5)OC)CO > InChI=1S/C30H34N4O4/c1-32(2)29(36)21-7-5-6-19(16-21)20-8-13-26-25(17-20)28-24(27(18-35)33(26)3)14-15-34(28)30(37)31-22-9-11-23(38-4)12-10-22/h5-13,16-17,24,27-28,35H,14-15,18H2,1-4H3,(H,31,37)/t24-,27-,28-/m1/s1 > SYBCXYDZMLYAOB-RYRVMRHHSA-N > LSM-42546 $$$$