1.02010-04-08 22:12:18 UTC2015-07-20 23:27:13 UTCFDB016225Guaiol acetateFlavouring ingredient with a sweet taste suggestive of currantGuai-1(5)-en-11-ol, acetateGuaiac acetateGuaijol, acetateGuaiol acetateGuaiol, acetateGuaiyl acetateC17H28O2264.403264.208930142-(3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl)propan-2-yl acetate2-(3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl)propan-2-yl acetate134-28-1CC1CCC2=C1CC(CCC2C)C(C)(C)OC(C)=OInChI=1S/C17H28O2/c1-11-6-8-14(17(4,5)19-13(3)18)10-16-12(2)7-9-15(11)16/h11-12,14H,6-10H2,1-5H3DRFSOBZVMGLICQ-UHFFFAOYSA-N belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units.SesquiterpenoidsOrganic compoundsLipids and lipid-like moleculesPrenol lipidsSesquiterpenoidsAliphatic homopolycyclic compoundsCarbonyl compoundsCarboxylic acid estersHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesAliphatic homopolycyclic compoundCarbonyl groupCarboxylic acid derivativeCarboxylic acid esterHydrocarbon derivativeMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundSesquiterpenoidlogp5.22logs-4.13solubility1.98e-02 g/llogp3.86pka_strongest_basic-7iupac2-(3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl)propan-2-yl acetateaverage_mass264.403mono_mass264.20893014smilesCC1CCC2=C1CC(CCC2C)C(C)(C)OC(C)=OformulaC17H28O2inchiInChI=1S/C17H28O2/c1-11-6-8-14(17(4,5)19-13(3)18)10-16-12(2)7-9-15(11)16/h11-12,14H,6-10H2,1-5H3inchikeyDRFSOBZVMGLICQ-UHFFFAOYSA-Npolar_surface_area26.3refractivity78.39polarizability31.69rotatable_bond_count3acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs17714Specdb::CMs156039Specdb::MsMs305212Specdb::MsMs305213Specdb::MsMs305214Specdb::MsMs348571Specdb::MsMs348572Specdb::MsMs348573Specdb::MsMs2814763Specdb::MsMs2814764Specdb::MsMs2814765Specdb::MsMs2891097Specdb::MsMs2891098Specdb::MsMs2891099HMDB37218#<Reference:0x000055567568f878>fattygreenrosespicyteawoody