1.02019-09-16 21:23:28 UTC2019-11-26 03:24:13 UTCFDB093562CowaninC29H34O6478.585478.2355388151-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-3,6,8-trihydroxy-2-methoxy-7-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one1-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-3,6,8-trihydroxy-2-methoxy-7-(3-methylbut-2-en-1-yl)xanthen-9-oneCOC1=C(C\C=C(/C)CCC=C(C)C)C2=C(OC3=CC(O)=C(CC=C(C)C)C(O)=C3C2=O)C=C1OInChI=1S/C29H34O6/c1-16(2)8-7-9-18(5)11-13-20-25-23(15-22(31)29(20)34-6)35-24-14-21(30)19(12-10-17(3)4)27(32)26(24)28(25)33/h8,10-11,14-15,30-32H,7,9,12-13H2,1-6H3/b18-11+GVDDDYKLKUMEGV-WOJGMQOQSA-N belongs to the class of organic compounds known as 8-prenylated xanthones. These are organic compounds containing a C5-isoprenoid group linked to a xanthone moiety at the 8-position. Xanthone is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran ring that carries a ketone group.8-prenylated xanthonesOrganic compoundsOrganoheterocyclic compoundsBenzopyrans1-benzopyransAromatic heteropolycyclic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids2-prenylated xanthonesAlkyl aryl ethersAnisolesAromatic monoterpenoidsChromonesHeteroaromatic compoundsHydrocarbon derivativesOrganic oxidesOxacyclic compoundsPolyolsPyranones and derivativesVinylogous acids1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoid2-prenylated xanthone8-prenylated xanthoneAlkyl aryl etherAnisoleAromatic heteropolycyclic compoundAromatic monoterpenoidBenzenoidChromoneEtherHeteroaromatic compoundHydrocarbon derivativeMonoterpenoidOrganic oxideOrganic oxygen compoundOrganooxygen compoundOxacyclePolyolPyranPyranoneVinylogous acidlogp5.79logs-5.31solubility2.32e-03 g/llogp7.66pka_strongest_acidic7.24pka_strongest_basic-3.7iupac1-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-3,6,8-trihydroxy-2-methoxy-7-(3-methylbut-2-en-1-yl)-9H-xanthen-9-oneaverage_mass478.585mono_mass478.235538815smilesCOC1=C(C\C=C(/C)CCC=C(C)C)C2=C(OC3=CC(O)=C(CC=C(C)C)C(O)=C3C2=O)C=C1OformulaC29H34O6inchiInChI=1S/C29H34O6/c1-16(2)8-7-9-18(5)11-13-20-25-23(15-22(31)29(20)34-6)35-24-14-21(30)19(12-10-17(3)4)27(32)26(24)28(25)33/h8,10-11,14-15,30-32H,7,9,12-13H2,1-6H3/b18-11+inchikeyGVDDDYKLKUMEGV-WOJGMQOQSA-Npolar_surface_area96.22refractivity141.51polarizability53.75rotatable_bond_count8acceptor_count5donor_count3physiological_charge0formal_charge0Specdb::MsMs1244875Specdb::MsMs1244876Specdb::MsMs1244877Specdb::MsMs1360243Specdb::MsMs1360244Specdb::MsMs1360245Specdb::MsMs3609412Specdb::MsMs3609413Specdb::MsMs3609414Specdb::MsMs3609415Specdb::MsMs3609416Specdb::MsMs3609417MunduType 1Garcinia dulcis