Marvin 09261313362D 29 31 0 0 0 0 999 V2000 7.6655 -4.6281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6655 -5.4532 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6655 -6.2782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3800 -6.6907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0944 -6.2782 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0944 -7.1031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 -6.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3639 -5.8658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1889 -5.8658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8791 -5.1983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0944 -5.4532 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.0944 -4.6281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3800 -5.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9511 -5.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2366 -5.4532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5221 -5.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8077 -5.4532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0932 -5.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3787 -5.4532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6643 -5.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9498 -5.4532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2353 -5.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5209 -5.4532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1936 -5.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9038 -5.4525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6202 -5.0444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6202 -4.2158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9056 -3.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1936 -4.2154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 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 1 0 0 0 5 7 1 0 0 0 0 8 7 1 0 0 0 0 8 9 2 0 0 0 0 10 8 1 0 0 0 0 11 10 1 0 0 0 0 5 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 0 0 0 0 13 2 1 0 0 0 0 2 14 1 0 0 0 0 15 14 1 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 1 0 0 0 0 20 19 1 0 0 0 0 21 20 2 0 0 0 0 22 21 1 0 0 0 0 23 22 2 0 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 26 25 2 0 0 0 0 27 26 1 0 0 0 0 28 27 2 0 0 0 0 29 28 1 0 0 0 0 24 29 2 0 0 0 0 M END > CHEBI:68415 > plakortolide R > An organic heterobicyclic compound that is a cyclic peroxy compound isolated from the Australian marine sponge Plakinastrella clathrata. > 3 > (3S,4aS,7aS)-3,4a-dimethyl-3-[(7E,9E)-10-phenyldeca-7,9-dien-1-yl]tetrahydrofuro[3,2-c][1,2]dioxin-6(3H)-one > C24H32O4 > 384.50850 > 384.23006 > 0 > [H][C@]12CC(=O)O[C@@]1(C)C[C@](C)(CCCCCC\C=C\C=C\c1ccccc1)OO2 > InChI=1S/C24H32O4/c1-23(19-24(2)21(27-28-23)18-22(25)26-24)17-13-8-6-4-3-5-7-10-14-20-15-11-9-12-16-20/h5,7,9-12,14-16,21H,3-4,6,8,13,17-19H2,1-2H3/b7-5+,14-10+/t21-,23-,24-/m0/s1 > VIBYZHWNCSGZMC-AANDXKHTSA-N > 21309197 > 21261297 $$$$