1.0 2010-04-08 22:06:57 UTC 2025-11-18 23:00:45 UTC FDB006026 Bourbonene Bourbonene is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. Thus, bourbonene is considered to be an isoprenoid lipid molecule. Bourbonene can be found in orange mint, which makes bourbonene a potential biomarker for the consumption of this food product. (-)-beta-bourbonene Bourbonene, beta- C15H24 204.357 204.187800773 (1S,2R,6S,7R,8S)-1-methyl-5-methylidene-8-(propan-2-yl)tricyclo[5.3.0.0^{2,6}]decane (1S,2R,6S,7R,8S)-8-isopropyl-1-methyl-5-methylidenetricyclo[5.3.0.0^{2,6}]decane [H][C@]12C(=C)CC[C@@]1([H])[C@]1(C)CC[C@@]([H])(C(C)C)[C@]21[H] InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)13(12)14(11)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13-,14+,15-/m0/s1 YIRAHEODBQONHI-ZQNQSHIBSA-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 Branched unsaturated hydrocarbons Cyclic olefins Polycyclic hydrocarbons Unsaturated aliphatic hydrocarbons Aliphatic homopolycyclic compound Bourbonane sesquiterpenoid Branched unsaturated hydrocarbon Cyclic olefin Hydrocarbon Olefin Polycyclic hydrocarbon Sesquiterpenoid Unsaturated aliphatic hydrocarbon Unsaturated hydrocarbon Bourbonane sesquiterpenoids logp 3.47 ALOGPS logs -4.93 ALOGPS solubility 2.41e-03 g/l ALOGPS logp 4.15 ChemAxon iupac (1S,2R,6S,7R,8S)-1-methyl-5-methylidene-8-(propan-2-yl)tricyclo[5.3.0.0^{2,6}]decane ChemAxon average_mass 204.357 ChemAxon mono_mass 204.187800773 ChemAxon smiles [H][C@]12C(=C)CC[C@@]1([H])[C@]1(C)CC[C@@]([H])(C(C)C)[C@]21[H] ChemAxon formula C15H24 ChemAxon inchi InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)13(12)14(11)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13-,14+,15-/m0/s1 ChemAxon inchikey YIRAHEODBQONHI-ZQNQSHIBSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 64.7 ChemAxon polarizability 25.84 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 5789 Specdb::CMs 149679 Specdb::MsMs 49113 Specdb::MsMs 49114 Specdb::MsMs 49115 Specdb::MsMs 148332 Specdb::MsMs 148333 Specdb::MsMs 148334 Specdb::MsMs 2278022 Specdb::MsMs 2278023 Specdb::MsMs 2278024 Specdb::MsMs 3087343 Specdb::MsMs 3087344 Specdb::MsMs 3087345 Grape Type 1 specific Vitis 3603 Orange mint Type 1 specific Mentha aquatica 190902 0.45 0.45 0.45 mg/100 g