1.02010-04-08 22:11:30 UTC2019-11-26 03:10:50 UTCFDB014845alpha-DamasconeDetected as minor constituent of black tea leaves (nearly racemic mixture). alpha-Damascone is found in tea.(S)-(E)-(-)-alpha-damasconea-DamasconeYiyeliangwanoside IIC13H20O192.2973192.151415262(2Z)-1-(2,6,6-trimethylcyclohex-2-en-1-yl)but-2-en-1-one(2Z)-1-(2,6,6-trimethylcyclohex-2-en-1-yl)but-2-en-1-one116497-11-1C\C=C/C(=O)C1C(C)=CCCC1(C)CInChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7-8,12H,6,9H2,1-4H3/b7-5-CRIGTVCBMUKRSL-ALCCZGGFSA-N belongs to the class of organic compounds known as enones. Enones are compounds containing the enone functional group, with the structure RC(=O)CR'.EnonesOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsCarbonyl compoundsAliphatic homomonocyclic compoundsAcryloyl compoundsHydrocarbon derivativesKetonesOrganic oxidesAcryloyl-groupAliphatic homomonocyclic compoundEnoneHydrocarbon derivativeKetoneOrganic oxideLiquidlogp3.96logs-3.31solubility9.48e-02 g/lmelting_pointMp 22-23°logp3.83pka_strongest_acidic18.99pka_strongest_basic-4.7iupac(2Z)-1-(2,6,6-trimethylcyclohex-2-en-1-yl)but-2-en-1-oneaverage_mass192.2973mono_mass192.151415262smilesC\C=C/C(=O)C1C(C)=CCCC1(C)CformulaC13H20OinchiInChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7-8,12H,6,9H2,1-4H3/b7-5-inchikeyCRIGTVCBMUKRSL-ALCCZGGFSA-Npolar_surface_area17.07refractivity62.14polarizability22.87rotatable_bond_count2acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs25581Specdb::CMs169501Specdb::MsIr7051Specdb::MsIr7052Specdb::MsMs322687Specdb::MsMs322688Specdb::MsMs322689Specdb::MsMs370651Specdb::MsMs370652Specdb::MsMs370653Specdb::MsMs2728030Specdb::MsMs2728031Specdb::MsMs2728032Specdb::MsMs2980508Specdb::MsMs2980509Specdb::MsMs2980510HMDB36027#<Reference:0x000055567376efe8>Black teaType 1Green teaType 1Herbal teaType 1Red teaType 1TeaType 1specificCamellia sinensis4442