Mrv1652309082205422D 22 24 0 0 1 0 999 V2000 2.1915 2.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5735 1.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7379 0.6858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5203 0.4239 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2383 0.8301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8465 0.2727 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1887 1.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0084 0.9299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1728 0.1214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9597 0.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5017 -0.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4547 -0.2848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5043 -0.4780 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9105 -1.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6846 -0.3845 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0667 -0.9311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2844 -0.6693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 0.1392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2986 0.9446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3376 0.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1732 1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7912 1.7561 0.0000 C 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 3 4 1 0 0 0 0 4 5 1 6 0 0 0 6 5 1 6 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 13 14 1 6 0 0 0 13 15 1 0 0 0 0 4 15 1 0 0 0 0 15 16 1 1 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 2 22 1 0 0 0 0 M END > NP0261302 > NP-MRD > C[C@@H]1[C@H]2CC\C(C)=C\CC\C(C)=C\[C@@H]2O[C@]11OC(C)(C)C=C1 > InChI=1S/C20H30O2/c1-14-7-6-8-15(2)13-18-17(10-9-14)16(3)20(21-18)12-11-19(4,5)22-20/h7,11-13,16-18H,6,8-10H2,1-5H3/b14-7+,15-13+/t16-,17-,18+,20-/m1/s1 > SKBMVFLRYDINQT-ZTPOLTEHSA-N > C20H30O2 > 302.458 > 302.224580206 > 2 > 52 > 35.947987565732376 > 1 > 0 > 0 > 1 > (2R,3R,3aR,11aR)-3,5',5',6,10-pentamethyl-3a,4,5,8,9,11a-hexahydro-3H,5'H-spiro[cyclodeca[b]furan-2,2'-furan] > 5.328995308333333 > 0 > 3 > 0 > -4.120368680204226 > 18.46 > 93.636 > 0 > 0 > (2R,3R,3aR,11aR)-3,5',5',6,10-pentamethyl-3a,4,5,8,9,11a-hexahydro-3H-spiro[cyclodeca[b]furan-2,2'-furan] > 1 > NP0261302 > (2r,3r,3ar,11ar)-3,5',5',6,10-pentamethyl-3a,4,5,8,9,11a-hexahydro-3h-spiro[cyclodeca[b]furan-2,2'-furan] $$$$