1.02010-04-08 22:10:09 UTC2019-11-26 03:06:42 UTCFDB012400PrunetinOccurs in several Prunus subspecies and Glycyrrhiza glabra (licorice). Prunetin is found in tea, herbs and spices, and sour cherry.4',5-Dihydroxy-7-methoxygenistein4',5-Dihydroxy-7-methoxyisoflavone5-Hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4-benzopyrone5-Hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one5-Hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one, 9CI5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one5,4'-dihydroxy-7-methoxyisoflavone7-O-Methyl-genisteinIsoflavone, 4',5-dihydroxy-7-methoxy- (7CI,8CI)PadmakasteinPrunetinPrunusetinC16H12O5284.267284.0684734865-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-oneprunetin552-59-0COC1=CC2=C(C(O)=C1)C(=O)C(=CO2)C1=CC=C(O)C=C1InChI=1S/C16H12O5/c1-20-11-6-13(18)15-14(7-11)21-8-12(16(15)19)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3KQMVAGISDHMXJJ-UHFFFAOYSA-N belongs to the class of organic compounds known as 7-o-methylisoflavones. These are isoflavones with methoxy groups attached to the C7 atom of the isoflavone backbone.7-O-methylisoflavonesOrganic compoundsPhenylpropanoids and polyketidesIsoflavonoidsO-methylated isoflavonoidsAromatic heteropolycyclic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsAlkyl aryl ethersAnisolesBenzene and substituted derivativesChromonesHeteroaromatic compoundsHydrocarbon derivativesHydroxyisoflavonoidsIsoflavonesOrganic oxidesOxacyclic compoundsPyranones and derivativesVinylogous acids1-benzopyran1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoid7-o-methylisoflavoneAlkyl aryl etherAnisoleAromatic heteropolycyclic compoundBenzenoidBenzopyranChromoneEtherHeteroaromatic compoundHydrocarbon derivativeHydroxyisoflavonoidIsoflavoneMonocyclic benzene moietyOrganic oxideOrganic oxygen compoundOrganoheterocyclic compoundOrganooxygen compoundOxacyclePhenolPyranPyranoneVinylogous acidIsoflavonoidsIsoflavonoidsa small moleculehydroxyisoflavoneisoflavonesmethoxyisoflavonelogp3.36logs-3.69solubility5.86e-02 g/lmelting_pointMp 246-248°logp3.22pka_strongest_acidic7.32pka_strongest_basic-4.7iupac5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-oneaverage_mass284.267mono_mass284.068473486smilesCOC1=CC2=C(C(O)=C1)C(=O)C(=CO2)C1=CC=C(O)C=C1formulaC16H12O5inchiInChI=1S/C16H12O5/c1-20-11-6-13(18)15-14(7-11)21-8-12(16(15)19)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3inchikeyKQMVAGISDHMXJJ-UHFFFAOYSA-Npolar_surface_area75.99refractivity76.17polarizability28.71rotatable_bond_count2acceptor_count5donor_count2physiological_charge0formal_charge0Specdb::CMs5597Specdb::CMs32169Specdb::CMs43726Specdb::CMs101519Specdb::CMs136736Specdb::CMs144470Specdb::MsMs9788Specdb::MsMs9789Specdb::MsMs9790Specdb::MsMs16460Specdb::MsMs16461Specdb::MsMs16462Specdb::MsMs285635Specdb::MsMs285636Specdb::MsMs285637Specdb::MsMs285638Specdb::MsMs285639Specdb::MsMs373649Specdb::MsMs373650Specdb::MsMs373651Specdb::MsMs373652Specdb::MsMs373653Specdb::MsMs440202Specdb::MsMs440203Specdb::MsMs440204Specdb::MsMs440205Specdb::MsMs1479291Specdb::MsMs1479389Specdb::MsMs2236429Specdb::MsMs2236970Specdb::MsMs2238499HMDB341278600#<Reference:0x00005556763b98a0>Black teaType 1Green teaType 1Herbal teaType 1Herbs and SpicesUnknowngenericLiquoriceType 2specificPrunus (Cherry, Plum)Type 1specificPrunus3754Red cloverType 1Trifolium pratenseRed teaType 1Sour cherryType 1specificPrunus cerasus140311TeaType 1specificCamellia sinensis4442bitterfungicide940A substance used to destroy fungal pests.pesticide1210Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.