1.02010-04-08 22:09:55 UTC2019-11-26 03:05:51 UTCFDB011967CajanoneConstituent of Cajanus cajan (pigeon pea). Cajanone is found in pigeon pea and pulses.7-[2,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-7,8-dihydro-5-hydroxy-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-6-one, 9CIC25H26O6422.4703422.1729385646-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-9-hydroxy-13,13-dimethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9,11-tetraen-7-onecajanone63006-48-4CC(C)=CCC1=CC(C2COC3=C(C2=O)C(O)=C2C=CC(C)(C)OC2=C3)=C(O)C=C1OInChI=1S/C25H26O6/c1-13(2)5-6-14-9-16(19(27)10-18(14)26)17-12-30-21-11-20-15(7-8-25(3,4)31-20)23(28)22(21)24(17)29/h5,7-11,17,26-28H,6,12H2,1-4H3BAKSOIVZFARRJC-UHFFFAOYSA-N belongs to the class of organic compounds known as 3'-prenylated isoflavanones. These are isoflavanones featuring a C5-isoprenoid unit at the 3'-position.3'-prenylated isoflavanonesOrganic compoundsPhenylpropanoids and polyketidesIsoflavonoidsIsoflavansAromatic heteropolycyclic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids2,2-dimethyl-1-benzopyransAlkyl aryl ethersAryl alkyl ketonesBenzene and substituted derivativesChromonesHydrocarbon derivativesHydroxyisoflavonoidsIsoflavanolsOrganic oxidesOxacyclic compoundsPyranochromenesResorcinolsVinylogous acids1-benzopyran1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoid2,2-dimethyl-1-benzopyran3'-prenylated isoflavanoneAlkyl aryl etherAromatic heteropolycyclic compoundAryl alkyl ketoneAryl ketoneBenzenoidBenzopyranChromaneChromoneEtherHydrocarbon derivativeHydroxyisoflavonoidIsoflavanolKetoneMonocyclic benzene moietyOrganic oxideOrganic oxygen compoundOrganoheterocyclic compoundOrganooxygen compoundOxacyclePhenolPyranochromeneResorcinolVinylogous acidIsoflavonoidslogp4.09logs-4.92solubility5.13e-03 g/llogp5.36pka_strongest_acidic8.91pka_strongest_basic-4iupac6-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-9-hydroxy-13,13-dimethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9,11-tetraen-7-oneaverage_mass422.4703mono_mass422.172938564smilesCC(C)=CCC1=CC(C2COC3=C(C2=O)C(O)=C2C=CC(C)(C)OC2=C3)=C(O)C=C1OformulaC25H26O6inchiInChI=1S/C25H26O6/c1-13(2)5-6-14-9-16(19(27)10-18(14)26)17-12-30-21-11-20-15(7-8-25(3,4)31-20)23(28)22(21)24(17)29/h5,7-11,17,26-28H,6,12H2,1-4H3inchikeyBAKSOIVZFARRJC-UHFFFAOYSA-Npolar_surface_area96.22refractivity120.31polarizability45.07rotatable_bond_count3acceptor_count6donor_count3physiological_charge0formal_charge0Specdb::CMs9920Specdb::CMs43513Specdb::CMs174127Specdb::MsMs92256Specdb::MsMs92257Specdb::MsMs92258Specdb::MsMs155844Specdb::MsMs155845Specdb::MsMs155846Specdb::MsMs2810123Specdb::MsMs2810124Specdb::MsMs2810125Specdb::MsMs2899530Specdb::MsMs2899531Specdb::MsMs2899532HMDB33804#<Reference:0x00005556748c0c60>Pigeon peaType 1specificCajanus cajan3821PulsesUnknowngenericanti septic603A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.pesticide1210Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.