1.0 2010-04-08 22:13:04 UTC 2019-11-26 03:14:47 UTC FDB017392 Lactarazulene Constituent of Lactarius deliciosus. Lactarazulene is found in mushrooms. 1,4-Dimethyl-7-(1-methylethenyl)-azulene 7-Isopropenyl-1,4-dimethyl-azulene 7-Isopropenyl-1,4-dimethylazulene Azulene, 1,4-dimethyl-7-(1-methylethenyl)- Azulene, 7-isopropenyl-1,4-dimethyl- Lactarazulene C15H16 196.2875 196.125200512 1,4-dimethyl-7-(prop-1-en-2-yl)azulene 1,4-dimethyl-7-(prop-1-en-2-yl)azulene 489-85-0 CC(=C)C1=CC2=C(C)C=CC2=C(C)C=C1 InChI=1S/C15H16/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h5-9H,1H2,2-4H3 KFLXZUPIDNPCSD-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 Aromatic homopolycyclic compounds Aromatic hydrocarbons Azulenes Branched unsaturated hydrocarbons Polycyclic hydrocarbons Aromatic homopolycyclic compound Aromatic hydrocarbon Azulene Branched unsaturated hydrocarbon Cyclic olefin Guaiane sesquiterpenoid Hydrocarbon Olefin Polycyclic hydrocarbon Unsaturated hydrocarbon logp 4.69 ALOGPS logs -3.11 ALOGPS solubility 1.51e-01 g/l ALOGPS logp 5.03 ChemAxon iupac 1,4-dimethyl-7-(prop-1-en-2-yl)azulene ChemAxon average_mass 196.2875 ChemAxon mono_mass 196.125200512 ChemAxon smiles CC(=C)C1=CC2=C(C)C=CC2=C(C)C=C1 ChemAxon formula C15H16 ChemAxon inchi InChI=1S/C15H16/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h5-9H,1H2,2-4H3 ChemAxon inchikey KFLXZUPIDNPCSD-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 66.56 ChemAxon polarizability 24.37 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10194 Specdb::CMs 133471 Specdb::CMs 141205 Specdb::MsMs 8915 Specdb::MsMs 8916 Specdb::MsMs 8917 Specdb::MsMs 15587 Specdb::MsMs 15588 Specdb::MsMs 15589 Specdb::MsMs 2279336 Specdb::MsMs 2279337 Specdb::MsMs 2279338 Specdb::MsMs 3090351 Specdb::MsMs 3090352 Specdb::MsMs 3090353 HMDB38162 #<Reference:0x000055ce30638e78> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322