Mrv1652309072206372D 25 28 0 0 1 0 999 V2000 4.9279 1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9279 1.9354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 2.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 3.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 3.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7845 3.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7845 2.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 1.9354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 1.1104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0701 3.5854 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3556 3.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0701 4.4104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3556 4.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6411 4.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6411 3.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0734 3.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7878 3.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7878 4.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0734 4.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5724 4.6654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0574 3.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5724 3.3305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7845 4.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 4.4104 0.0000 C 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 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 3 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 6 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 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 15 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 18 23 1 0 0 0 0 13 24 1 0 0 0 0 24 25 1 0 0 0 0 5 25 1 0 0 0 0 M END > NP0243962 > NP-MRD > COC1=CC2=C(C=C1OC)[C@@H](C)N(CC1=CC=C3OCOC3=C1)CC2 > InChI=1S/C20H23NO4/c1-13-16-10-19(23-3)18(22-2)9-15(16)6-7-21(13)11-14-4-5-17-20(8-14)25-12-24-17/h4-5,8-10,13H,6-7,11-12H2,1-3H3/t13-/m1/s1 > BSDPQEFENGLTDD-CYBMUJFWSA-N > C20H23NO4 > 341.407 > 341.162708225 > 5 > 48 > 37.94585544961788 > 1 > 0 > 0 > 1 > (1R)-2-[(2H-1,3-benzodioxol-5-yl)methyl]-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline > 3.403470167666667 > 0 > 4 > 1 > 7.117044232146903 > 40.160000000000004 > 95.635 > 4 > 1 > (1R)-2-(2H-1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline > 0 > NP0243962 > (1r)-2-(2h-1,3-benzodioxol-5-ylmethyl)-6,7-dimethoxy-1-methyl-3,4-dihydro-1h-isoquinoline $$$$