Mrv1652309072211072D 22 24 0 0 1 0 999 V2000 5.6412 -1.0466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9527 -0.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9157 0.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5607 0.7464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1204 0.4515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6659 -0.2370 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1803 -0.8820 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9967 -1.6863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2534 -2.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5101 -1.6863 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8651 -2.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9881 -3.0165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3265 -0.8820 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5541 -0.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5912 0.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3864 0.4515 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6763 1.2239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1523 1.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3385 1.7260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4422 2.6336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8409 -0.2370 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2319 0.4895 0.0000 C 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 2 0 0 0 0 3 5 1 0 0 0 0 6 5 1 6 0 0 0 6 7 1 0 0 0 0 7 2 1 6 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 1 6 0 0 0 11 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 6 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 1 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 16 21 1 0 0 0 0 13 21 1 0 0 0 0 6 21 1 0 0 0 0 21 22 1 6 0 0 0 M END > NP0247320 > NP-MRD > CC(=O)O[C@@H]1CC[C@H]2[C@@H](CO)CC[C@@H]3[C@@H](OC(=O)C3=C)[C@]12C > InChI=1S/C17H24O5/c1-9-12-5-4-11(8-18)13-6-7-14(21-10(2)19)17(13,3)15(12)22-16(9)20/h11-15,18H,1,4-8H2,2-3H3/t11-,12+,13+,14-,15-,17+/m1/s1 > PZYPCUKIIHXLCC-CTMWFGIQSA-N > C17H24O5 > 308.374 > 308.162373873 > 3 > 46 > 32.715523594770644 > 1 > 1 > 0 > 1 > (3aS,6S,6aS,9R,9aS,9bR)-6-(hydroxymethyl)-9a-methyl-3-methylidene-2-oxo-dodecahydroazuleno[4,5-b]furan-9-yl acetate > 1.7131180496666663 > 0 > 3 > 0 > 18.09754505029501 > -1.4439309554874198 > 72.83000000000001 > 78.7846 > 3 > 1 > (3aS,6S,6aS,9R,9aS,9bR)-6-(hydroxymethyl)-9a-methyl-3-methylidene-2-oxo-octahydro-3aH-azuleno[4,5-b]furan-9-yl acetate > 0 > NP0247320 > (3as,6s,6as,9r,9as,9br)-6-(hydroxymethyl)-9a-methyl-3-methylidene-2-oxo-octahydro-3ah-azuleno[4,5-b]furan-9-yl acetate $$$$