1.0 2010-04-08 22:10:02 UTC 2019-11-26 03:06:20 UTC FDB012185 Curcumenol Constituent of Curcuma zedoaria (zedoary) and Curcuma longa (turmeric). Curcumenol is found in turmeric and herbs and spices. Curcumenol C15H22O2 234.334 234.161979948 2,6-dimethyl-9-(propan-2-ylidene)-11-oxatricyclo[6.2.1.0¹,⁵]undec-6-en-8-ol 2,6-dimethyl-9-(propan-2-ylidene)-11-oxatricyclo[6.2.1.0¹,⁵]undec-6-en-8-ol 19431-84-6 CC1CCC2C(C)=CC3(O)OC12CC3=C(C)C InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h7,11-12,16H,5-6,8H2,1-4H3 ISFMXVMWEWLJGJ-UHFFFAOYSA-N belongs to the class of organic compounds known as guaianes. These are sesquiterpenoids with a structure based on the guaiane skeleton. Guaiane is a bicyclic compound consisting of a decahydroazulene moiety, substituted with two methyl groups and a 1-methylethyl group at the 1-, 4-, and 7-position, respectively. Guaianes Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aliphatic heteropolycyclic compounds Hemiacetals Hydrocarbon derivatives Oxacyclic compounds Pyrans Tetrahydrofurans Aliphatic heteropolycyclic compound Guaiane sesquiterpenoid Hemiacetal Hydrocarbon derivative Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Pyran Tetrahydrofuran sesquiterpenoid logp 2.52 ALOGPS logs -2.80 ALOGPS solubility 3.71e-01 g/l ALOGPS melting_point Mp 118.5-119.5° logp 3.14 ChemAxon pka_strongest_acidic 11.09 ChemAxon pka_strongest_basic -4.4 ChemAxon iupac 2,6-dimethyl-9-(propan-2-ylidene)-11-oxatricyclo[6.2.1.0¹,⁵]undec-6-en-8-ol ChemAxon average_mass 234.334 ChemAxon mono_mass 234.161979948 ChemAxon smiles CC1CCC2C(C)=CC3(O)OC12CC3=C(C)C ChemAxon formula C15H22O2 ChemAxon inchi InChI=1S/C15H22O2/c1-9(2)13-8-14-11(4)5-6-12(14)10(3)7-15(13,16)17-14/h7,11-12,16H,5-6,8H2,1-4H3 ChemAxon inchikey ISFMXVMWEWLJGJ-UHFFFAOYSA-N ChemAxon polar_surface_area 29.46 ChemAxon refractivity 69.18 ChemAxon polarizability 27.22 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 26161 Specdb::CMs 43610 Specdb::CMs 132456 Specdb::CMs 140190 Specdb::MsMs 63369 Specdb::MsMs 63370 Specdb::MsMs 63371 Specdb::MsMs 120318 Specdb::MsMs 120319 Specdb::MsMs 120320 Specdb::MsMs 2474003 Specdb::MsMs 2474004 Specdb::MsMs 2474005 Specdb::MsMs 2491538 Specdb::MsMs 2491539 Specdb::MsMs 2491540 Herbs and Spices Unknown generic Turmeric Type 1 specific Curcuma longa 136217 2130.0 2130.0 2130.0 mg/100 g fatty fresh anti cancer 159 A substance that inhibits or prevents the proliferation of neoplasms. antitumor 672 A substance that inhibits or prevents the proliferation of neoplasms. emetic 899