1.0 2010-04-08 22:12:00 UTC 2018-05-29 01:21:09 UTC FDB015711 Furanodiene Constituent of Curcuma zedoaria (zedoary) (5E)-3,6,10-trimethyl-4,7,8,11-tetrahydrocyclodeca[b]furan 3,6,10-Trimethyl-4,7,8,11-tetrahydro-cyclodeca[b]furan Furanodiene Furanoelemene (furanodiene) Isofuranodiene C15H20O 216.3187 216.151415262 3,6,10-trimethyl-4H,7H,8H,11H-cyclodeca[b]furan 3,6,10-trimethyl-4H,7H,8H,11H-cyclodeca[b]furan 19912-61-9 CC1=COC2=C1C\C=C(C)\CC\C=C(C)\C2 InChI=1S/C15H20O/c1-11-5-4-6-12(2)9-15-14(8-7-11)13(3)10-16-15/h6-7,10H,4-5,8-9H2,1-3H3/b11-7+,12-6+ VMDXHYHOJPKFEK-IAVOFVOCSA-N belongs to the class of organic compounds known as germacrane sesquiterpenoids. These are sesquiterpenoids having the germacrane skeleton, with a structure characterized by a cyclodecane ring substituted with an isopropyl and two methyl groups. Germacrane sesquiterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aromatic heteropolycyclic compounds Furans Heteroaromatic compounds Hydrocarbon derivatives Organooxygen compounds Oxacyclic compounds Aromatic heteropolycyclic compound Furan Germacrane sesquiterpenoid Heteroaromatic compound Hydrocarbon derivative Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle logp 4.92 ALOGPS logs -4.02 ALOGPS solubility 2.06e-02 g/l ALOGPS melting_point Mp 66° logp 4.38 ChemAxon pka_strongest_basic -2.6 ChemAxon iupac 3,6,10-trimethyl-4H,7H,8H,11H-cyclodeca[b]furan ChemAxon average_mass 216.3187 ChemAxon mono_mass 216.151415262 ChemAxon smiles CC1=COC2=C1C\C=C(C)\CC\C=C(C)\C2 ChemAxon formula C15H20O ChemAxon inchi InChI=1S/C15H20O/c1-11-5-4-6-12(2)9-15-14(8-7-11)13(3)10-16-15/h6-7,10H,4-5,8-9H2,1-3H3/b11-7+,12-6+ ChemAxon inchikey VMDXHYHOJPKFEK-IAVOFVOCSA-N ChemAxon polar_surface_area 13.14 ChemAxon refractivity 70.33 ChemAxon polarizability 25.62 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25641 Specdb::CMs 158161 Specdb::MsMs 87753 Specdb::MsMs 87754 Specdb::MsMs 87755 Specdb::MsMs 150321 Specdb::MsMs 150322 Specdb::MsMs 150323 Specdb::MsMs 2697675 Specdb::MsMs 2697676 Specdb::MsMs 2697677 Specdb::MsMs 2983874 Specdb::MsMs 2983875 Specdb::MsMs 2983876 HMDB36769 #<Reference:0x000055ce325f40c8> #<Reference:0x000055ce325f3ec0>