Mrv1652309112217272D 14 16 0 0 1 0 999 V2000 4.4084 -0.7317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6297 -0.4592 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0044 -0.9973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2257 -0.7248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0605 -0.7849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6213 -1.4832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.0239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3673 0.5143 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5569 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3792 1.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6977 0.6239 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4764 0.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0724 0.0858 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3942 -0.3840 0.0000 O 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 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 8 7 1 1 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 11 10 1 1 0 0 0 11 12 1 0 0 0 0 2 12 1 0 0 0 0 11 13 1 0 0 0 0 4 13 1 0 0 0 0 8 13 1 0 0 0 0 13 14 1 6 0 0 0 M END > NP0316334 > NP-MRD > C[C@@H]1C[C@@H]2CC[C@@H]3OC(=O)C(=C1)[C@]23O > InChI=1S/C11H14O3/c1-6-4-7-2-3-9-11(7,13)8(5-6)10(12)14-9/h5-7,9,13H,2-4H2,1H3/t6-,7+,9+,11-/m1/s1 > SOIISBQQYAGDKM-VFYMIVFZSA-N > C11H14O3 > 194.23 > 194.094294311 > 2 > 28 > 19.844072419352013 > 1 > 1 > 0 > 1 > (4S,7S,9R,11R)-11-hydroxy-9-methyl-3-oxatricyclo[5.3.1.0^{4,11}]undec-1(10)-en-2-one > 1.3239990713333336 > 0 > 3 > 0 > 12.789684382024515 > -3.7655920513024776 > 46.53 > 50.486799999999995 > 0 > 1 > (4S,7S,9R,11R)-11-hydroxy-9-methyl-3-oxatricyclo[5.3.1.0^{4,11}]undec-1(10)-en-2-one > 0 > NP0316334 > (4s,7s,9r,11r)-11-hydroxy-9-methyl-3-oxatricyclo[5.3.1.0⁴,¹¹]undec-1(10)-en-2-one $$$$