Mrv1652309032211152D 25 29 0 0 1 0 999 V2000 -2.0500 2.1390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2413 1.9761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6959 2.5952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9779 1.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5232 0.5753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2599 -0.2065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4511 -0.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0943 0.2497 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8698 -0.0318 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5734 0.3989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6753 1.2176 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9218 2.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4297 2.6671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7467 2.0138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2244 2.6865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0101 1.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7674 0.9046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8624 0.0851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2003 -0.4070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -0.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3479 0.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0988 1.8077 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2779 1.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1691 1.0315 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2142 0.8593 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 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 9 1 0 0 0 0 9 10 1 0 0 0 0 11 10 1 6 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 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 20 21 2 0 0 0 0 16 21 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 22 23 1 0 0 0 0 24 23 1 6 0 0 0 4 24 1 0 0 0 0 8 24 1 0 0 0 0 22 25 1 6 0 0 0 9 25 1 6 0 0 0 M END > NP0172370 > NP-MRD > CN1C(=O)[C@@]2(C[C@@H]3N[C@H]2C[C@@H]2[C@H]3COC=C2C(C)=O)C2=CC=CC=C12 > InChI=1S/C20H22N2O3/c1-11(23)13-9-25-10-14-12(13)7-18-20(8-16(14)21-18)15-5-3-4-6-17(15)22(2)19(20)24/h3-6,9,12,14,16,18,21H,7-8,10H2,1-2H3/t12-,14+,16-,18-,20-/m0/s1 > JUWMPKQYUSKQSY-KWJBKDRPSA-N > C20H22N2O3 > 338.407 > 338.163042576 > 4 > 47 > 36.10357182763169 > 1 > 1 > 0 > 1 > (1'S,2'R,3S,7'R,9'S)-6'-acetyl-1-methyl-1,2-dihydro-4'-oxa-12'-azaspiro[indole-3,10'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-2-one > 1.19 > 0.7795337569999995 > -3.15 > 0 > 5 > 1 > 19.217732982218468 > 10.121427436893345 > 58.64000000000001 > 93.24699999999999 > 1 > 1 > 2.39e-01 g/l > (1'S,2'R,3S,7'R,9'S)-6'-acetyl-1-methyl-4'-oxa-12'-azaspiro[indole-3,10'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-2-one > 0 > NP0172370 > (1's,2'r,3s,7'r,9's)-6'-acetyl-1-methyl-4'-oxa-12'-azaspiro[indole-3,10'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-2-one $$$$