Mrv1652309042205242D 23 26 0 0 1 0 999 V2000 8.9947 6.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2802 5.7750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2802 4.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5658 4.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5658 3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2802 3.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9947 3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9947 4.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7092 4.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2802 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5658 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8513 2.4750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1368 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1368 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4223 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7079 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7079 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4223 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9232 2.3174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4383 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9232 0.9826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8513 3.3000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1368 3.7125 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 6 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 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 13 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 16 21 1 0 0 0 0 12 22 1 0 0 0 0 5 22 1 0 0 0 0 22 23 1 6 0 0 0 M END > NP0187289 > NP-MRD > COC1=CC2=C(CCN([C@@H]2C)C2=CC=C3OCOC3=C2)C=C1O > InChI=1S/C18H19NO4/c1-11-14-9-17(21-2)15(20)7-12(14)5-6-19(11)13-3-4-16-18(8-13)23-10-22-16/h3-4,7-9,11,20H,5-6,10H2,1-2H3/t11-/m1/s1 > BBUPUHMQCXCYPL-LLVKDONJSA-N > C18H19NO4 > 313.353 > 313.131408096 > 5 > 42 > 33.70482150197203 > 1 > 1 > 0 > 1 > (1R)-2-(2H-1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-6-ol > 3.4242232033333324 > 0 > 4 > 0 > 9.975545242743049 > 2.697727706666653 > 51.16000000000001 > 87.03860000000003 > 2 > 1 > (1R)-2-(2H-1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-6-ol > 0 > NP0187289 > (1r)-2-(2h-1,3-benzodioxol-5-yl)-7-methoxy-1-methyl-3,4-dihydro-1h-isoquinolin-6-ol $$$$