1.0 2010-04-08 22:11:55 UTC 2025-11-19 00:56:17 UTC FDB015570 T-Muurolol T-muurolol, also known as 10-epi-alpha-muurolol or alpha-epi-muurolol, is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. T-muurolol is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). T-muurolol is a herbal, spicy, and weak spice tasting compound found in allspice, lemon balm, and white mustard, which makes T-muurolol a potential biomarker for the consumption of these food products. (-)-T-Muurolol α-epi-Muurolol 1beta,10betaH-Cadin-4-en-10-ol (8CI) epi- α-Muurulol epi-α-Muurol epi-α-Muurolol T-Muurolol tau-Muurolol C15H26O 222.3663 222.198365454 (1S,4S,4aR,8aS)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-ol (1S,4S,4aR,8aS)-4-isopropyl-1,6-dimethyl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol 19912-62-0 [H][C@@]12C=C(C)CC[C@]1([H])[C@@](C)(O)CC[C@H]2C(C)C InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13-,14-,15-/m0/s1 LHYHMMRYTDARSZ-AJNGGQMLSA-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 Aliphatic homopolycyclic compounds Cyclic alcohols and derivatives Hydrocarbon derivatives Tertiary alcohols Alcohol Aliphatic homopolycyclic compound Cadinane sesquiterpenoid Cyclic alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Sesquiterpenoid Tertiary alcohol logp 3.52 ALOGPS logs -3.60 ALOGPS solubility 5.57e-02 g/l ALOGPS melting_point Mp 80.5-81.5° logp 3.54 ChemAxon pka_strongest_basic -0.59 ChemAxon iupac (1S,4S,4aR,8aS)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-ol ChemAxon average_mass 222.3663 ChemAxon mono_mass 222.198365454 ChemAxon smiles [H][C@@]12C=C(C)CC[C@]1([H])[C@@](C)(O)CC[C@H]2C(C)C ChemAxon formula C15H26O ChemAxon inchi InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13-,14-,15-/m0/s1 ChemAxon inchikey LHYHMMRYTDARSZ-AJNGGQMLSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 69.43 ChemAxon polarizability 27.41 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 54954 Specdb::MsMs 54955 Specdb::MsMs 54956 Specdb::MsMs 150306 Specdb::MsMs 150307 Specdb::MsMs 150308 Specdb::MsMs 3605824 Specdb::MsMs 3605825 Specdb::MsMs 3605826 Specdb::MsMs 3606874 Specdb::MsMs 3606875 Specdb::MsMs 3606876 Allspice Type 1 specific Pimenta dioica 375272 Lemon balm Type 1 specific Melissa officinalis 39338 2.25 2.25 2.25 mg/100 g White mustard Type 1 specific Sinapis alba 3728 herb herbal spicy weak spice weakspice