1.0 2010-04-08 22:15:17 UTC 2025-11-19 02:34:03 UTC FDB020838 7-Hydroxy-2-calamenenone Constituent of Gossypium hirsutum (cotton). 7-Hydroxy-2-calamenenone is found in fats and oils. 3-Hydroxy-9-calamenenone 7-Hydroxy-2-calamenenone C15H20O2 232.3181 232.146329884 7-hydroxy-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4-tetrahydronaphthalen-2-one 7-hydroxy-4-isopropyl-1,6-dimethyl-3,4-dihydro-1H-naphthalen-2-one 155662-80-9 CC(C)C1CC(=O)C(C)C2=CC(O)=C(C)C=C12 InChI=1S/C15H20O2/c1-8(2)11-6-15(17)10(4)12-7-14(16)9(3)5-13(11)12/h5,7-8,10-11,16H,6H2,1-4H3 QPXQUILITXIQFA-UHFFFAOYSA-N belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units. Sesquiterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aromatic homopolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids Cyclic ketones Hydrocarbon derivatives Organic oxides Tetralins 1-hydroxy-2-unsubstituted benzenoid Aromatic homopolycyclic compound Benzenoid Cadinane sesquiterpenoid Carbonyl group Cyclic ketone Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Sesquiterpenoid Tetralin logp 3.49 ALOGPS logs -3.58 ALOGPS solubility 6.17e-02 g/l ALOGPS logp 4.02 ChemAxon pka_strongest_acidic 9.75 ChemAxon pka_strongest_basic -6 ChemAxon iupac 7-hydroxy-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4-tetrahydronaphthalen-2-one ChemAxon average_mass 232.3181 ChemAxon mono_mass 232.146329884 ChemAxon smiles CC(C)C1CC(=O)C(C)C2=CC(O)=C(C)C=C12 ChemAxon formula C15H20O2 ChemAxon inchi InChI=1S/C15H20O2/c1-8(2)11-6-15(17)10(4)12-7-14(16)9(3)5-13(11)12/h5,7-8,10-11,16H,6H2,1-4H3 ChemAxon inchikey QPXQUILITXIQFA-UHFFFAOYSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 69.48 ChemAxon polarizability 26.69 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 7940 Specdb::MsMs 7941 Specdb::MsMs 7942 Specdb::MsMs 14612 Specdb::MsMs 14613 Specdb::MsMs 14614 Specdb::MsMs 2375486 Specdb::MsMs 2375487 Specdb::MsMs 2375488 Specdb::MsMs 2559825 Specdb::MsMs 2559826 Specdb::MsMs 2559827 Specdb::CMs 26273 Specdb::CMs 47048 Specdb::CMs 145984 HMDB0040981 Fats and oils Unknown generic