1.02010-04-08 22:15:23 UTC2019-11-26 03:19:42 UTCFDB020968(-)-(E)-1-(4-Hydroxyphenyl)-7-phenyl-6-hepten-3-olConstituent of the rhizomes of Curcuma xanthorrhiza (Java turmeric). (-)-(E)-1-(4-Hydroxyphenyl)-7-phenyl-6-hepten-3-ol is found in herbs and spices, beverages, and root vegetables.C19H22O2282.3768282.1619799484-[(6E)-3-hydroxy-7-phenylhept-6-en-1-yl]phenol4-[(6E)-3-hydroxy-7-phenylhept-6-en-1-yl]phenol158697-54-2OC(CC\C=C\C1=CC=CC=C1)CCC1=CC=C(O)C=C1InChI=1S/C19H22O2/c20-18(13-10-17-11-14-19(21)15-12-17)9-5-4-8-16-6-2-1-3-7-16/h1-4,6-8,11-12,14-15,18,20-21H,5,9-10,13H2/b8-4+PXPIJNMPDAFWSF-XBXARRHUSA-N belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.Linear diarylheptanoidsOrganic compoundsPhenylpropanoids and polyketidesDiarylheptanoidsLinear diarylheptanoidsAromatic homomonocyclic compounds1-hydroxy-2-unsubstituted benzenoidsFatty alcoholsHydrocarbon derivativesSecondary alcoholsStyrenes1-hydroxy-2-unsubstituted benzenoidAlcoholAromatic homomonocyclic compoundBenzenoidFatty acylFatty alcoholHydrocarbon derivativeLinear 1,7-diphenylheptane skeletonMonocyclic benzene moietyOrganic oxygen compoundOrganooxygen compoundPhenolSecondary alcoholStyrenelogp4.66logs-4.43solubility1.06e-02 g/lmelting_pointMp 94-95°logp4.76pka_strongest_acidic10.3pka_strongest_basic-2.7iupac4-[(6E)-3-hydroxy-7-phenylhept-6-en-1-yl]phenolaverage_mass282.3768mono_mass282.161979948smilesOC(CC\C=C\C1=CC=CC=C1)CCC1=CC=C(O)C=C1formulaC19H22O2inchiInChI=1S/C19H22O2/c20-18(13-10-17-11-14-19(21)15-12-17)9-5-4-8-16-6-2-1-3-7-16/h1-4,6-8,11-12,14-15,18,20-21H,5,9-10,13H2/b8-4+inchikeyPXPIJNMPDAFWSF-XBXARRHUSA-Npolar_surface_area40.46refractivity88.17polarizability33.77rotatable_bond_count7acceptor_count2donor_count2physiological_charge0formal_charge0Specdb::CMs18383Specdb::CMs47112Specdb::CMs170244Specdb::MsMs306766Specdb::MsMs306767Specdb::MsMs306768Specdb::MsMs350506Specdb::MsMs350507Specdb::MsMs350508Specdb::MsMs2366167Specdb::MsMs2366168Specdb::MsMs2366169Specdb::MsMs2598928Specdb::MsMs2598929Specdb::MsMs2598930HMDB41090#<Reference:0x0000555675fe0530>BeveragesUnknowngenericHerbs and SpicesUnknowngenericRoot vegetablesUnknowngeneric