1.02010-04-08 22:11:56 UTC2019-11-26 03:11:54 UTCFDB015595ZerumboneConstituent of the rhizomes of wild ginger (Zingiber zerumbet). Zerumbone is found in herbs and spices.(E,E,E)-2,6,9,9-Tetramethyl-2,6,10-cycloundecatrien-1-one2,6,9-Humulatrien-8-one2,6,9,9-Tetramethyl-2,6,10-cycloundecatrien-1-one2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-oneZerumboneC15H22O218.3346218.167065326(2Z,6Z,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one(2Z,6Z,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one471-05-6C\C1=C\CC(C)(C)\C=C\C(=O)\C(C)=C/CC1InChI=1S/C15H22O/c1-12-6-5-7-13(2)14(16)9-11-15(3,4)10-8-12/h7-9,11H,5-6,10H2,1-4H3/b11-9+,12-8-,13-7-GIHNTRQPEMKFKO-RTTFEGKLSA-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 homomonocyclic compoundsCyclic ketonesHydrocarbon derivativesOrganic oxidesAliphatic homomonocyclic compoundCarbonyl groupCyclic ketoneHumulane sesquiterpenoidHydrocarbon derivativeKetoneOrganic oxideOrganic oxygen compoundOrganooxygen compoundSesquiterpenoidlogp5.15logs-3.74solubility4.00e-02 g/lmelting_pointMp 66-67°logp4.57pka_strongest_basic-4.4iupac(2Z,6Z,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-oneaverage_mass218.3346mono_mass218.167065326smilesC\C1=C\CC(C)(C)\C=C\C(=O)\C(C)=C/CC1formulaC15H22OinchiInChI=1S/C15H22O/c1-12-6-5-7-13(2)14(16)9-11-15(3,4)10-8-12/h7-9,11H,5-6,10H2,1-4H3/b11-9+,12-8-,13-7-inchikeyGIHNTRQPEMKFKO-RTTFEGKLSA-Npolar_surface_area17.07refractivity72.22polarizability26.3rotatable_bond_count0acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs25816Specdb::CMs164094Specdb::MsMs110088Specdb::MsMs110089Specdb::MsMs110090Specdb::MsMs177684Specdb::MsMs177685Specdb::MsMs177686Specdb::MsMs2452306Specdb::MsMs2452307Specdb::MsMs2452308Specdb::MsMs2483452Specdb::MsMs2483453Specdb::MsMs2483454HMDB36667#<Reference:0x0000555675c427e8>#<Reference:0x0000555675c42590>Herbs and SpicesUnknowngeneric