1.0 2010-04-08 22:11:47 UTC 2019-11-26 03:11:29 UTC FDB015345 10-Hydroxy-3-methoxy-1,3,5,7-cadinatetraen-9-one From Gossypium hirsutum (cotton). 10-Hydroxy-3-methoxy-1,3,5,7-cadinatetraen-9-one is found in fats and oils. Lacinilene C 7-methyl ether C16H20O3 260.3282 260.141244506 1-hydroxy-7-methoxy-1,6-dimethyl-4-(propan-2-yl)-1,2-dihydronaphthalen-2-one 1-hydroxy-4-isopropyl-7-methoxy-1,6-dimethylnaphthalen-2-one 72843-51-7 COC1=C(C)C=C2C(=CC(=O)C(C)(O)C2=C1)C(C)C InChI=1S/C16H20O3/c1-9(2)11-7-15(17)16(4,18)13-8-14(19-5)10(3)6-12(11)13/h6-9,18H,1-5H3 VMEKKHYIQYOLHA-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 Acyloins Alkyl aryl ethers Anisoles Cyclic ketones Hydrocarbon derivatives Naphthalenes Organic oxides Tertiary alcohols Acyloin Alcohol Alkyl aryl ether Anisole Aromatic homopolycyclic compound Benzenoid Cadinane sesquiterpenoid Carbonyl group Cyclic ketone Ether Hydrocarbon derivative Ketone Naphthalene Organic oxide Organic oxygen compound Organooxygen compound Sesquiterpenoid Tertiary alcohol logp 2.97 ALOGPS logs -3.84 ALOGPS solubility 3.79e-02 g/l ALOGPS melting_point Mp 100-102° logp 3.43 ChemAxon pka_strongest_acidic 12.48 ChemAxon pka_strongest_basic -3.9 ChemAxon iupac 1-hydroxy-7-methoxy-1,6-dimethyl-4-(propan-2-yl)-1,2-dihydronaphthalen-2-one ChemAxon average_mass 260.3282 ChemAxon mono_mass 260.141244506 ChemAxon smiles COC1=C(C)C=C2C(=CC(=O)C(C)(O)C2=C1)C(C)C ChemAxon formula C16H20O3 ChemAxon inchi InChI=1S/C16H20O3/c1-9(2)11-7-15(17)16(4,18)13-8-14(19-5)10(3)6-12(11)13/h6-9,18H,1-5H3 ChemAxon inchikey VMEKKHYIQYOLHA-UHFFFAOYSA-N ChemAxon polar_surface_area 46.53 ChemAxon refractivity 76.26 ChemAxon polarizability 29.21 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 12814 Specdb::CMs 44880 Specdb::CMs 156935 Specdb::MsMs 9068 Specdb::MsMs 9069 Specdb::MsMs 9070 Specdb::MsMs 15740 Specdb::MsMs 15741 Specdb::MsMs 15742 Specdb::MsMs 2286280 Specdb::MsMs 2286281 Specdb::MsMs 2286282 Specdb::MsMs 3082185 Specdb::MsMs 3082186 Specdb::MsMs 3082187 HMDB36456 #<Reference:0x000055ce335a7920> Fats and oils Unknown generic