1.0 2010-04-08 22:09:55 UTC 2025-11-18 23:32:34 UTC FDB011967 Cajanone Constituent 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, 9CI C25H26O6 422.4703 422.172938564 6-[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-one cajanone 63006-48-4 CC(C)=CCC1=CC(C2COC3=C(C2=O)C(O)=C2C=CC(C)(C)OC2=C3)=C(O)C=C1O InChI=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,6,12H2,1-4H3 BAKSOIVZFARRJC-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 isoflavanones Organic compounds Phenylpropanoids and polyketides Isoflavonoids Isoflavans Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 2,2-dimethyl-1-benzopyrans Alkyl aryl ethers Aryl alkyl ketones Benzene and substituted derivatives Chromones Hydrocarbon derivatives Hydroxyisoflavonoids Isoflavanols Organic oxides Oxacyclic compounds Pyranochromenes Resorcinols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 2,2-dimethyl-1-benzopyran 3'-prenylated isoflavanone Alkyl aryl ether Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Chromane Chromone Ether Hydrocarbon derivative Hydroxyisoflavonoid Isoflavanol Ketone Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Pyranochromene Resorcinol Vinylogous acid Isoflavonoids logp 4.09 ALOGPS logs -4.92 ALOGPS solubility 5.13e-03 g/l ALOGPS logp 5.36 ChemAxon pka_strongest_acidic 8.91 ChemAxon pka_strongest_basic -4 ChemAxon iupac 6-[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-one ChemAxon average_mass 422.4703 ChemAxon mono_mass 422.172938564 ChemAxon smiles CC(C)=CCC1=CC(C2COC3=C(C2=O)C(O)=C2C=CC(C)(C)OC2=C3)=C(O)C=C1O ChemAxon formula C25H26O6 ChemAxon inchi InChI=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,6,12H2,1-4H3 ChemAxon inchikey BAKSOIVZFARRJC-UHFFFAOYSA-N ChemAxon polar_surface_area 96.22 ChemAxon refractivity 120.31 ChemAxon polarizability 45.07 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 6 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 92256 Specdb::MsMs 92257 Specdb::MsMs 92258 Specdb::MsMs 155844 Specdb::MsMs 155845 Specdb::MsMs 155846 Specdb::MsMs 2810123 Specdb::MsMs 2810124 Specdb::MsMs 2810125 Specdb::MsMs 2899530 Specdb::MsMs 2899531 Specdb::MsMs 2899532 Specdb::CMs 9920 Specdb::CMs 43513 Specdb::CMs 174127 HMDB33804 #<Reference:0x000055ce3266ff48> Pigeon pea Type 1 specific Cajanus cajan 3821 Pulses Unknown generic Anti septic 603 A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans. Pesticide 1210 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.