1.0 2010-04-08 22:05:58 UTC 2020-09-17 15:33:39 UTC FDB003839 beta-Eudesmol Beta-Eudesmol, also known as beta-selinenol belongs to the class of organic compounds known as eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids. These are sesquiterpenoids with a structure based on the eudesmane skeleton. Sesquiterpenoids are terpenes that contain 15 carbon atoms and are comprised of three isoprene units. The biosynthesis of sesquiterpenes is known to occur mainly through the mevalonic acid pathway (MVA), in the cytosol. However, recent studies have found evidence of pathway crosstalk with the methyl-eritritol-phosphate (MEP) pathway in the plastid (PMID: 19932496, 17710406). Farnesyl diphosphate (FPP) is a key intermediate in the biosynthesis of cyclic sesquiterpenes. FPP undergoes several cyclization reactions to yield a diverse number of cyclic arrangements. Beta-eudesmol is a green and wood tasting compound that can be found in a number of food items such as common walnut, sweet basil, ginkgo nuts, burdock, and ginger (PMID: 18242187). β-eudesmol β-eudesmol (β-selinenol) β-selinenol beta-Eudesmol Beta-selinenol Eudesm-4(14)-en-11-ol Eudesm-4(14)-en-11-ol (8CI) C15H26O 222.3663 222.198365454 2-[(2R,4aR,8aS)-4a-methyl-8-methylidene-decahydronaphthalen-2-yl]propan-2-ol β-eudesmol 473-15-4 CC(C)(O)[C@@H]1CC[C@@]2(C)CCCC(=C)[C@@H]2C1 InChI=1S/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h12-13,16H,1,5-10H2,2-4H3/t12-,13+,15-/m1/s1 BOPIMTNSYWYZOC-VNHYZAJKSA-N belongs to the class of organic compounds known as eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids. These are sesquiterpenoids with a structure based on the eudesmane skeleton. Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aliphatic homopolycyclic compounds Hydrocarbon derivatives Tertiary alcohols Alcohol Aliphatic homopolycyclic compound Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoid Hydrocarbon derivative Organic oxygen compound Organooxygen compound Tertiary alcohol Eudesmanes carbobicyclic compound eudesmane sesquiterpenoid tertiary alcohol logp 4.21 ALOGPS logs -4.49 ALOGPS solubility 7.19e-03 g/l ALOGPS logp 3.53 ChemAxon pka_strongest_acidic 19.32 ChemAxon pka_strongest_basic -0.91 ChemAxon iupac 2-[(2R,4aR,8aS)-4a-methyl-8-methylidene-decahydronaphthalen-2-yl]propan-2-ol ChemAxon average_mass 222.3663 ChemAxon mono_mass 222.198365454 ChemAxon smiles CC(C)(O)[C@@H]1CC[C@@]2(C)CCCC(=C)[C@@H]2C1 ChemAxon formula C15H26O ChemAxon inchi InChI=1S/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h12-13,16H,1,5-10H2,2-4H3/t12-,13+,15-/m1/s1 ChemAxon inchikey BOPIMTNSYWYZOC-VNHYZAJKSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 68.36 ChemAxon polarizability 27.56 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 1866 Specdb::CMs 103782 Specdb::MsMs 85854 Specdb::MsMs 85855 Specdb::MsMs 85856 Specdb::MsMs 148029 Specdb::MsMs 148030 Specdb::MsMs 148031 Specdb::MsMs 1473378 Specdb::MsMs 1473379 Burdock Type 1 specific Arctium lappa 4217 Common oregano Type 1 specific Origanum vulgare 39352 Common walnut Type 1 specific Juglans regia 51240 2.1 2.1 2.1 mg/100 g Dill Type 1 specific Anethum graveolens 40922 Ginger Type 1 specific Zingiber officinale 94328 23.6 23.6 23.6 mg/100 g Ginkgo nuts Type 1 specific Ginkgo biloba 3311 Orange mint Type 1 specific Mentha aquatica 190902 1.75 1.75 1.75 mg/100 g Sweet basil Type 1 specific Ocimum basilicum 39350 Sweet bay Type 1 specific Laurus nobilis 85223 Wild celery Type 1 specific Apium graveolens 4045 15.05 15.05 15.05 mg/100 g green wood anti anoxic 119 Any substance introduced into a living organism with therapeutic or diagnostic purpose. anti Epstein-Barr virus 245 A substance that destroys or inhibits replication of viruses. anti mutagenic 451 anti peptic 512 anti salmonella 591 A substance that kills or slows the growth of bacteria. anti ulcer 676 One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract. antitumor promoter 673 A substance that inhibits or prevents the proliferation of neoplasms. calcium antagonist 748 Substance that attaches to and blocks cell receptors that normally bind naturally occurring substances. central nervous system inhibitor 813 A class of drugs producing both physiological and psychological effects through a variety of mechanisms involving the central nervous system. hepatoprotective 981 Any compound that is able to prevent damage to the liver. neurogenic 1151 pesticide 1210 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. sedative 1311 A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.