1.0 2010-04-08 22:09:55 UTC 2025-11-18 23:32:21 UTC FDB011948 Afrormosin Alfalone is a member of the class of compounds known as 7-o-methylisoflavones. 7-o-methylisoflavones are isoflavones with methoxy groups attached to the C7 atom of the isoflavone backbone. Thus, alfalone is considered to be a flavonoid lipid molecule. Alfalone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Alfalone can be found in alfalfa and pulses, which makes alfalone a potential biomarker for the consumption of these food products. 6,4'-Dimethoxy-7-hydroxyisoflavone 7-Hydroxy-4',6-dimethoxyisoflavone 7-hydroxy-6-methoxy-3-(4-methoxyphenyl)-chromen-4-one 7-Hydroxy-6,4'-dimethoxyisoflavone Afromosin Afrormosin Castanin? Isoflavone, 7-hydroxy-4',6-dimethoxy- C17H14O5 298.2901 298.084123558 7-hydroxy-6-methoxy-3-(4-methoxyphenyl)-4H-chromen-4-one afrormosin 550-79-8 COC1=CC=C(C=C1)C1=COC2=CC(OC)=C(O)C=C2C1=O InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)13-9-22-15-8-16(21-2)14(18)7-12(15)17(13)19/h3-9,18H,1-2H3 CQULNEWSZBPFNL-UHFFFAOYSA-N belongs to the class of organic compounds known as 4'-o-methylisoflavones. These are isoflavones with methoxy groups attached to the C4' atom of the isoflavone backbone. 4'-O-methylisoflavones Organic compounds Phenylpropanoids and polyketides Isoflavonoids O-methylated isoflavonoids Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Anisoles Chromones Heteroaromatic compounds Hydrocarbon derivatives Hydroxyisoflavonoids Isoflavones Methoxybenzenes Organic oxides Oxacyclic compounds Phenoxy compounds Pyranones and derivatives 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 4p-o-methylisoflavone Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromone Ether Heteroaromatic compound Hydrocarbon derivative Hydroxyisoflavonoid Isoflavone Methoxybenzene Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol ether Phenoxy compound Pyran Pyranone 7-hydroxyisoflavones Isoflavonoids Isoflavonoids an isoflavone isoflavones methoxyisoflavone logp 3.50 ALOGPS logs -3.97 ALOGPS solubility 3.20e-02 g/l ALOGPS melting_point Mp 236-237° (228-229°) logp 2.72 ChemAxon pka_strongest_acidic 6.92 ChemAxon pka_strongest_basic -4.5 ChemAxon iupac 7-hydroxy-6-methoxy-3-(4-methoxyphenyl)-4H-chromen-4-one ChemAxon average_mass 298.2901 ChemAxon mono_mass 298.084123558 ChemAxon smiles COC1=CC=C(C=C1)C1=COC2=CC(OC)=C(O)C=C2C1=O ChemAxon formula C17H14O5 ChemAxon inchi InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)13-9-22-15-8-16(21-2)14(18)7-12(15)17(13)19/h3-9,18H,1-2H3 ChemAxon inchikey CQULNEWSZBPFNL-UHFFFAOYSA-N ChemAxon polar_surface_area 64.99 ChemAxon refractivity 80.65 ChemAxon polarizability 30.86 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 5 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 1328221 Specdb::MsMs 1328222 Specdb::MsMs 1328223 Specdb::MsMs 1442548 Specdb::MsMs 1442549 Specdb::MsMs 1442550 Specdb::MsMs 2753029 Specdb::MsMs 2753030 Specdb::MsMs 2753031 Specdb::MsMs 2951958 Specdb::MsMs 2951959 Specdb::MsMs 2951960 Specdb::CMs 54693 Specdb::CMs 62575 Specdb::CMs 149193 Common pea Type 1 specific Pisum sativum 3888 Soy bean Type 1 specific Glycine max 3847