Mrv1652309052215152D 22 24 0 0 1 0 999 V2000 4.2374 3.9093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3293 3.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0853 2.7591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1772 1.9393 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8480 1.4590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5985 0.6726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 0.0085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7735 0.6669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2932 -0.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5131 1.4497 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7571 1.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0931 1.2906 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4290 0.8010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3371 1.6209 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5172 1.5290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2452 2.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9093 2.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6652 2.6000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5733 3.4198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8174 3.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1533 3.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7255 4.5700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 6 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 10 8 1 1 0 0 0 4 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 1 0 0 0 13 14 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 6 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 2 18 1 0 0 0 0 18 19 1 6 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 2 0 0 0 0 M END > NP0214062 > NP-MRD > CC(=O)O[C@@H]1CC[C@]2(C)O[C@@H]2C[C@H]2[C@H](CC1=C)OC(=O)C2=C > InChI=1S/C17H22O5/c1-9-7-14-12(10(2)16(19)21-14)8-15-17(4,22-15)6-5-13(9)20-11(3)18/h12-15H,1-2,5-8H2,3-4H3/t12-,13-,14+,15-,17+/m1/s1 > GJVYVMKLKQEPCA-GAGVYUBLSA-N > C17H22O5 > 306.358 > 306.146723808 > 3 > 44 > 31.921383508414596 > 1 > 0 > 0 > 1 > (1R,3R,5S,8R,11S)-5-methyl-9,14-dimethylidene-13-oxo-4,12-dioxatricyclo[9.3.0.0^{3,5}]tetradecan-8-yl acetate > 2.0277256919999997 > 0 > 3 > 0 > -4.2228528750504735 > 65.13 > 78.45540000000001 > 2 > 1 > (1R,3R,5S,8R,11S)-5-methyl-9,14-dimethylidene-13-oxo-4,12-dioxatricyclo[9.3.0.0^{3,5}]tetradecan-8-yl acetate > 0 > NP0214062 > (1r,3r,5s,8r,11s)-5-methyl-9,14-dimethylidene-13-oxo-4,12-dioxatricyclo[9.3.0.0³,⁵]tetradecan-8-yl acetate $$$$