1.0 2016-09-30 23:22:59 UTC 2020-06-04 18:59:37 UTC BMDB0006525 BMDB06525 (+)-a-Pinene (+)-a-Pinene, also known as 2-pinene or acintene a, belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other (+)-a-Pinene exists as a liquid, possibly soluble (in water), and possibly neutral molecule (+)-a-Pinene exists in all living organisms, ranging from bacteria to humans (+)-a-Pinene has been found to be associated with several diseases known as diarrhoea predominant irritable bowel syndrome and nonalcoholic fatty liver disease; also (+)-a-pinene has been linked to the inborn metabolic disorders including celiac disease. (+-)-2-Pinene (+-)-alpha-Pinene 2-Pinene Acintene a Pin-2(3)-ene (+-)-a-Pinene (+-)-Α-pinene (-)-a-Pinene (-)-Α-pinene (+)-alpha-Pinene (+)-Pin-2(3)-ene (1R)-2,6,6-trimethylbicyclo[3.1.1]Hept-2-ene (1R,5R)-2,6,6-trimethylbicyclo[3.1.1]Hept-2-ene 1R-(+)-a-Pinene 1R-(+)-alpha-Pinene 1R-a-Pinene 1R-alpha-Pinene 2,6,6-Trimethyl-bicyclo(3.1.1)hept-2-ene 2,6,6-trimethylbicyclo[3.1.1]Hept-2-ene alpha-Pinene(dextro) Wilt pruf alpha-Pinene, pinene alpha-Pinene C10H16 136.238 136.125200515 2,6,6-trimethylbicyclo[3.1.1]hept-2-ene α pinene 80-56-8 CC1=CCC2CC1C2(C)C InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3 GRWFGVWFFZKLTI-UHFFFAOYSA-N belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other. Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Bicyclic monoterpenoids Branched unsaturated hydrocarbons Cyclic olefins Polycyclic hydrocarbons Unsaturated aliphatic hydrocarbons Aliphatic homopolycyclic compound Bicyclic monoterpenoid Branched unsaturated hydrocarbon Cyclic olefin Hydrocarbon Olefin Pinane monoterpenoid Polycyclic hydrocarbon Unsaturated aliphatic hydrocarbon Unsaturated hydrocarbon Aliphatic homopolycyclic compounds Bicyclic monoterpenoids Cyclic monoterpenes an α-pinene pinene Liquid melting_point -62 °C logp 4.44 GRIFFIN,S ET AL. (1999) logp 3.66 ALOGPS logs -2.94 ALOGPS logp 2.8 ChemAxon iupac 2,6,6-trimethylbicyclo[3.1.1]hept-2-ene ChemAxon average_mass 136.238 ChemAxon mono_mass 136.125200515 ChemAxon smiles CC1=CCC2CC1C2(C)C ChemAxon formula C10H16 ChemAxon inchi InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3 ChemAxon inchikey GRWFGVWFFZKLTI-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 44.72 ChemAxon polarizability 17.22 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 2 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::EiMs 1905 Specdb::CMs 5835 Specdb::CMs 26802 Specdb::CMs 28652 Specdb::CMs 99931 Specdb::CMs 99932 Specdb::CMs 102699 Specdb::CMs 102700 Specdb::CMs 103745 Specdb::MsMs 50067 Specdb::MsMs 50068 Specdb::MsMs 50069 Specdb::MsMs 169227 Specdb::MsMs 169228 Specdb::MsMs 169229 Specdb::MsMs 3601052 Specdb::MsMs 3601053 Specdb::MsMs 3601054 Specdb::MsMs 3601892 Specdb::MsMs 3601893 Specdb::MsMs 3601894 Milk 0.000378 +/- 0.000151 uM In raw milk samples for diets based on grass silage Toso B, Procida G, Stefanon B: Determination of volatile compounds in cows' milk using headspace GC-MS. J Dairy Res. 2002 Nov;69(4):569-77. 12463694 Milk 0.000529 +/- 0.000454 uM In raw milk samples for diets based on maize silage Toso B, Procida G, Stefanon B: Determination of volatile compounds in cows' milk using headspace GC-MS. J Dairy Res. 2002 Nov;69(4):569-77. 12463694 Milk 0.000983 +/- 0.000378 uM In raw milk samples for diets based on hay Toso B, Procida G, Stefanon B: Determination of volatile compounds in cows' milk using headspace GC-MS. J Dairy Res. 2002 Nov;69(4):569-77. 12463694 FDB004843 6402 C09880 36740 Alpha-pinene Alpha-Pinene C00000805 Toso B, Procida G, Stefanon B: Determination of volatile compounds in cows' milk using headspace GC-MS. J Dairy Res. 2002 Nov;69(4):569-77. 12463694