1.0 2010-04-08 22:05:47 UTC 2025-11-18 22:52:14 UTC FDB003412 Epiacorone Constituent of Acorus calamus (sweet flag). Epiacorone is found in herbs and spices and root vegetables. Epiacorone C15H24O2 236.3499 236.177630012 4,8-dimethyl-1-(propan-2-yl)spiro[4.5]decane-2,7-dione 1-isopropyl-4,8-dimethylspiro[4.5]decane-2,7-dione CC(C)C1C(=O)CC(C)C11CCC(C)C(=O)C1 InChI=1S/C15H24O2/c1-9(2)14-12(16)7-11(4)15(14)6-5-10(3)13(17)8-15/h9-11,14H,5-8H2,1-4H3 AGUISGUERLMHFF-UHFFFAOYSA-N belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety. Cyclic ketones Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aliphatic homopolycyclic compounds Hydrocarbon derivatives Organic oxides Aliphatic homopolycyclic compound Cyclic ketone Hydrocarbon derivative Organic oxide logp 2.40 ALOGPS logs -3.25 ALOGPS solubility 1.32e-01 g/l ALOGPS logp 3.43 ChemAxon pka_strongest_basic -7.1 ChemAxon iupac 4,8-dimethyl-1-(propan-2-yl)spiro[4.5]decane-2,7-dione ChemAxon average_mass 236.3499 ChemAxon mono_mass 236.177630012 ChemAxon smiles CC(C)C1C(=O)CC(C)C11CCC(C)C(=O)C1 ChemAxon formula C15H24O2 ChemAxon inchi InChI=1S/C15H24O2/c1-9(2)14-12(16)7-11(4)15(14)6-5-10(3)13(17)8-15/h9-11,14H,5-8H2,1-4H3 ChemAxon inchikey AGUISGUERLMHFF-UHFFFAOYSA-N ChemAxon polar_surface_area 34.14 ChemAxon refractivity 68.16 ChemAxon polarizability 27.36 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20696 Specdb::CMs 131248 Specdb::CMs 138982 Specdb::MsMs 77958 Specdb::MsMs 77959 Specdb::MsMs 77960 Specdb::MsMs 138201 Specdb::MsMs 138202 Specdb::MsMs 138203 Specdb::MsMs 2286289 Specdb::MsMs 2286290 Specdb::MsMs 2286291 Specdb::MsMs 3082176 Specdb::MsMs 3082177 Specdb::MsMs 3082178 HMDB0031348 Herbs and Spices Unknown generic Root vegetables Unknown generic