Mrv1652309072217482D 17 19 0 0 1 0 999 V2000 1.8384 -2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7231 -1.4504 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9765 -1.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0906 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9095 -0.1079 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3035 0.6669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5199 0.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4393 1.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1584 0.6560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5821 1.3639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 -0.0984 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3385 0.2142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8074 -0.9293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0765 -1.4094 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0559 -2.2342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3504 -0.8786 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9259 -0.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 3 1 0 0 0 0 3 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 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 6 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 1 0 0 0 14 16 1 0 0 0 0 2 16 1 0 0 0 0 5 16 1 0 0 0 0 16 17 1 6 0 0 0 11 17 1 0 0 0 0 M END > NP0252331 > NP-MRD > C[C@H]1CC[C@@H]2[C@]11C[C@](C)(C[C@H]1O)C(=O)C2(C)C > InChI=1S/C15H24O2/c1-9-5-6-10-13(2,3)12(17)14(4)7-11(16)15(9,10)8-14/h9-11,16H,5-8H2,1-4H3/t9-,10-,11+,14-,15-/m0/s1 > DDUWSZBURGHFEW-VHKOSHJNSA-N > C15H24O2 > 236.355 > 236.177630013 > 2 > 41 > 27.286656154801964 > 1 > 1 > 0 > 1 > (1S,2S,5R,8R,10R)-10-hydroxy-2,6,6,8-tetramethyltricyclo[6.2.1.0^{1,5}]undecan-7-one > 3.1336056269999997 > 0 > 3 > 0 > 14.649428316063194 > -2.9521400545539596 > 37.3 > 67.0314 > 0 > 1 > (1S,2S,5R,8R,10R)-10-hydroxy-2,6,6,8-tetramethyltricyclo[6.2.1.0^{1,5}]undecan-7-one > 1 > NP0252331 > (1s,2s,5r,8r,10r)-10-hydroxy-2,6,6,8-tetramethyltricyclo[6.2.1.0¹,⁵]undecan-7-one $$$$