Mrv1652304292206052D 22 23 0 0 1 0 999 V2000 0.9796 -1.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1131 -0.5191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8667 -0.1483 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4231 0.5162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 0.8846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 0.7311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7086 0.1644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0167 -0.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -1.4638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5191 -2.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8282 -2.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9966 -2.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1801 -2.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 -1.8715 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3829 -1.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -0.6877 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2590 -0.3940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1275 -3.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 0.6397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3573 0.5006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1612 -1.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4357 -1.9575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 1 14 1 0 0 0 0 14 15 1 1 0 0 0 15 16 1 0 0 0 0 3 16 1 0 0 0 0 16 17 1 1 0 0 0 11 18 1 0 0 0 0 7 19 1 0 0 0 0 3 20 1 1 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 M END > NP0328506 > NP-MRD > C\C1=C\CC[C@@]2(C)OC(C)(C)[C@@H](C[C@@H]2O)CC\C(C)=C/CC1 > InChI=1S/C20H34O2/c1-15-8-6-9-16(2)11-12-17-14-18(21)20(5,13-7-10-15)22-19(17,3)4/h9-10,17-18,21H,6-8,11-14H2,1-5H3/b15-10-,16-9-/t17-,18+,20-/m1/s1 > QJAIARJGTZFFBW-QZDLPARBSA-N > C20H34O2 > 306.49 > 306.255880335 > 2 > 56 > 36.81822413617451 > 1 > 1 > 0 > 1 > (1R,4E,8E,12R,16S)-4,8,12,14,14-pentamethyl-13-oxabicyclo[10.2.2]hexadeca-4,8-dien-16-ol > 5.57 > 4.592944549333334 > -4.29 > 0 > 2 > 0 > 13.987424143085697 > -3.2417006798143158 > 29.46 > 94.82760000000002 > 0 > 1 > 1.56e-02 g/l > (1R,4E,8E,12R,16S)-4,8,12,14,14-pentamethyl-13-oxabicyclo[10.2.2]hexadeca-4,8-dien-16-ol > 1 > NP0328506 > (1r,4e,8e,12r,16s)-4,8,12,14,14-pentamethyl-13-oxabicyclo[10.2.2]hexadeca-4,8-dien-16-ol $$$$