1.0 2010-04-08 22:07:00 UTC 2019-11-26 03:00:58 UTC FDB006158 beta-Ylangene Beta-ylangene can be found in peppermint and spearmint, which makes beta-ylangene a potential biomarker for the consumption of these food products. β-yalangene β-ylangene beta-Ylangene C15H24 204.3511 204.187800768 (1S,6R,7R,8S)-1-methyl-3-methylidene-8-(propan-2-yl)tricyclo[4.4.0.0²,⁷]decane (1S,6R,7R,8S)-8-isopropyl-1-methyl-3-methylidenetricyclo[4.4.0.0²,⁷]decane [H][C@]12C3C(=C)CC[C@@]1([H])[C@]3(C)CC[C@H]2C(C)C InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13+,14?,15-/m0/s1 UPVZPMJSRSWJHQ-ZVQPBLDFSA-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 Branched unsaturated hydrocarbon Copaane sesquiterpenoid Cyclic olefin Hydrocarbon Olefin Polycyclic hydrocarbon Sesquiterpenoid Unsaturated aliphatic hydrocarbon Unsaturated hydrocarbon logp 3.38 ALOGPS logs -4.95 ALOGPS solubility 2.31e-03 g/l ALOGPS logp 4.15 ChemAxon iupac (1S,6R,7R,8S)-1-methyl-3-methylidene-8-(propan-2-yl)tricyclo[4.4.0.0²,⁷]decane ChemAxon average_mass 204.3511 ChemAxon mono_mass 204.187800768 ChemAxon smiles [H][C@]12C3C(=C)CC[C@@]1([H])[C@]3(C)CC[C@H]2C(C)C ChemAxon formula C15H24 ChemAxon inchi InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13+,14?,15-/m0/s1 ChemAxon inchikey UPVZPMJSRSWJHQ-ZVQPBLDFSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 64.7 ChemAxon polarizability 26.03 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 96495 Specdb::MsMs 96496 Specdb::MsMs 96497 Specdb::MsMs 160980 Specdb::MsMs 160981 Specdb::MsMs 160982 Specdb::MsMs 3602555 Specdb::MsMs 3602556 Specdb::MsMs 3602557 Specdb::MsMs 3602558 Specdb::MsMs 3602559 Specdb::MsMs 3602560 Peppermint Type 1 specific Mentha X piperita 34256 Spearmint Type 1 specific Mentha spicata 29719 17.0 17.0 17.0 mg/100 g