1.0 2010-04-08 22:15:41 UTC 2019-11-26 03:20:21 UTC FDB021417 Deterrol Isolated from the mushroom Lactarius deterrimus. Deterrol is found in mushrooms. 1-Azulenemethanol, 4-methyl-7-(1-methylethenyl)- 4-Methyl-7-(1-methylethenyl)-1-azulenemethanol 4-Methyl-7-(1-methylethenyl)-1-azulenemethanol, 9CI 7-Isopropenyl-4-methyl-1-azulenemethanol Deterrol C15H16O 212.2869 212.120115134 [4-methyl-7-(prop-1-en-2-yl)azulen-1-yl]methanol [4-methyl-7-(prop-1-en-2-yl)azulen-1-yl]methanol 113393-59-2 CC(=C)C1=CC2=C(CO)C=CC2=C(C)C=C1 InChI=1S/C15H16O/c1-10(2)12-5-4-11(3)14-7-6-13(9-16)15(14)8-12/h4-8,16H,1,9H2,2-3H3 UELYVRHCROBZCL-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 alcohols Azulenes Hydrocarbon derivatives Primary alcohols Alcohol Aromatic alcohol Aromatic homopolycyclic compound Azulene Guaiane sesquiterpenoid Hydrocarbon derivative Organic oxygen compound Organooxygen compound Primary alcohol logp 3.32 ALOGPS logs -2.89 ALOGPS solubility 2.73e-01 g/l ALOGPS melting_point Mp 100-101° logp 3.74 ChemAxon pka_strongest_acidic 15.13 ChemAxon pka_strongest_basic -2.7 ChemAxon iupac [4-methyl-7-(prop-1-en-2-yl)azulen-1-yl]methanol ChemAxon average_mass 212.2869 ChemAxon mono_mass 212.120115134 ChemAxon smiles CC(=C)C1=CC2=C(CO)C=CC2=C(C)C=C1 ChemAxon formula C15H16O ChemAxon inchi InChI=1S/C15H16O/c1-10(2)12-5-4-11(3)14-7-6-13(9-16)15(14)8-12/h4-8,16H,1,9H2,2-3H3 ChemAxon inchikey UELYVRHCROBZCL-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 68.33 ChemAxon polarizability 25.28 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24864 Specdb::CMs 47332 Specdb::CMs 134137 Specdb::CMs 141871 Specdb::MsMs 9563 Specdb::MsMs 9564 Specdb::MsMs 9565 Specdb::MsMs 16235 Specdb::MsMs 16236 Specdb::MsMs 16237 Specdb::MsMs 2660992 Specdb::MsMs 2660993 Specdb::MsMs 2660994 Specdb::MsMs 3020868 Specdb::MsMs 3020869 Specdb::MsMs 3020870 HMDB41460 #<Reference:0x000055ce31a8c280> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322