Mrv1652309092215502D 23 25 0 0 1 0 999 V2000 1.4626 3.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6733 3.3868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0709 3.9505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4862 2.5833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0886 2.0195 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8779 2.2593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4803 1.6956 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2697 1.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2932 0.8920 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1034 1.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 0.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9383 -0.2766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0942 -1.0868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1912 0.0734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5039 0.6523 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9025 -0.0700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3168 -0.1512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5274 -0.3910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0749 0.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1121 0.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7117 1.0209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0131 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9015 1.2160 0.0000 C 0 0 1 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 5 4 1 1 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 6 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 9 14 1 6 0 0 0 9 15 1 0 0 0 0 15 16 1 1 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 20 1 1 0 0 0 5 23 1 0 0 0 0 15 23 1 0 0 0 0 M END > NP0285600 > NP-MRD > C[C@H]1C[C@H](OC(C)=O)[C@@H]2C(C)(C)CCC[C@@]2(C)[C@]11CCC(=O)O1 > InChI=1S/C19H30O4/c1-12-11-14(22-13(2)20)16-17(3,4)8-6-9-18(16,5)19(12)10-7-15(21)23-19/h12,14,16H,6-11H2,1-5H3/t12-,14-,16+,18+,19-/m0/s1 > HXILYTQMWOYCAT-DXJHZOEWSA-N > C19H30O4 > 322.445 > 322.214409446 > 2 > 53 > 35.838073836686206 > 1 > 0 > 0 > 1 > (1S,2S,4S,4aR,8aR)-2,5,5,8a-tetramethyl-5'-oxo-octahydro-2H-spiro[naphthalene-1,2'-oxolane]-4-yl acetate > 3.412394407 > 0 > 3 > 0 > -6.726549127730056 > 52.60000000000001 > 86.26930000000002 > 2 > 1 > (1S,2S,4S,4aR,8aR)-2,5,5,8a-tetramethyl-5'-oxo-hexahydro-2H-spiro[naphthalene-1,2'-oxolane]-4-yl acetate > 0 > NP0285600 > (1s,2s,4s,4ar,8ar)-2,5,5,8a-tetramethyl-5'-oxo-hexahydro-2h-spiro[naphthalene-1,2'-oxolan]-4-yl acetate $$$$