46902457 -OEChem-05092409542D 47 51 0 1 0 0 0 0 0999 V2000 11.8009 -1.7820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1671 0.3129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2172 -0.9772 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.5390 -2.2820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2710 -1.2820 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2710 -2.2820 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4050 -0.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5390 -1.2820 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4050 -2.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2172 -2.5867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 -0.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5279 -0.0267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 0.2180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 -1.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 0.7180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9409 -0.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9409 0.2180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0749 0.7180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9718 1.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 1.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 1.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 2.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 2.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3610 -0.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3610 -3.1272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8035 -0.3070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0065 -0.3070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0020 -1.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0065 -3.2569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8035 -3.2569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9662 -3.1536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7546 -2.8959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0020 -2.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1172 -0.2193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7205 0.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9386 0.1659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2099 0.5280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 -1.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 1.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 -1.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4333 2.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 3.3189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 0.5130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 3.3189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 1.9160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 10 1 0 0 0 0 2 18 1 0 0 0 0 2 21 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 26 1 1 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 6 27 1 1 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 11 1 6 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 14 16 2 0 0 0 0 14 40 1 0 0 0 0 15 17 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 21 23 2 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 23 25 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 M END > 46902457 > 1 > 465 > 4 > 1 > 2 > AAADceB7MAAAAAAAAAAAAAAAAAAAAWJAAAA8YIAAAAAAAFgB9AAAHgAUAAAADSzhmAYyBsLQBECIAqBSAACCCAAkIAAoiIEODMgMJjKE9RuGOSjm0BGIqYeY2POOQAAAAAAIAACAAAAAABAAAAAAAAAAAA== > (3aR,6S,7aS)-6-[4-(benzofuran-2-yl)phenyl]-1-methyl-3a,4,5,6,7,7a-hexahydro-3H-isoxazolo[4,3-c]pyridine > (3aR,6S,7aS)-6-[4-(2-benzofuranyl)phenyl]-1-methyl-3a,4,5,6,7,7a-hexahydro-3H-isoxazolo[4,3-c]pyridine > (3aR,6S,7aS)-6-[4-(1-benzofuran-2-yl)phenyl]-1-methyl-3a,4,5,6,7,7a-hexahydro-3H-[1,2]oxazolo[4,3-c]pyridine > (3aR,6S,7aS)-6-[4-(1-benzofuran-2-yl)phenyl]-1-methyl-3a,4,5,6,7,7a-hexahydro-3H-[1,2]oxazolo[4,3-c]pyridine > (3aR,6S,7aS)-6-[4-(1-benzofuran-2-yl)phenyl]-1-methyl-3a,4,5,6,7,7a-hexahydro-3H-[1,2]oxazolo[4,3-c]pyridine > (3aR,6S,7aS)-6-[4-(benzofuran-2-yl)phenyl]-1-methyl-3a,4,5,6,7,7a-hexahydro-3H-isoxazolo[4,3-c]pyridine > InChI=1S/C21H22N2O2/c1-23-19-11-18(22-12-17(19)13-24-23)14-6-8-15(9-7-14)21-10-16-4-2-3-5-20(16)25-21/h2-10,17-19,22H,11-13H2,1H3/t17-,18-,19-/m0/s1 > UZQJBUXVAXUKCN-FHWLQOOXSA-N > 3.7 > 334.168127949 > C21H22N2O2 > 334.4 > CN1C2CC(NCC2CO1)C3=CC=C(C=C3)C4=CC5=CC=CC=C5O4 > CN1[C@H]2C[C@H](NC[C@H]2CO1)C3=CC=C(C=C3)C4=CC5=CC=CC=C5O4 > 37.6 > 334.168127949 > 0 > 25 > 3 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 13 8 11 14 8 13 15 8 14 16 8 15 17 8 16 17 8 18 19 8 19 20 8 2 18 8 2 21 8 20 21 8 20 22 8 21 23 8 22 24 8 23 25 8 24 25 8 5 26 5 6 27 5 8 11 6 $$$$