1.0 2010-04-08 22:05:02 UTC 2025-11-18 22:32:10 UTC FDB001597 Cerasidin Cerasidin is a member of the class of compounds known as 2'-hydroxychalcones. 2'-hydroxychalcones are organic compounds containing chalcone skeleton that carries a hydroxyl group at the 2'-position. Thus, cerasidin is considered to be a flavonoid lipid molecule. Cerasidin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Cerasidin can be found in sour cherry, which makes cerasidin a potential biomarker for the consumption of this food product. C19H20O6 344.3585 344.125988372 (2E)-3-(2,4-dimethoxyphenyl)-1-(2-hydroxy-4,6-dimethoxyphenyl)prop-2-en-1-one cerasidin 64200-22-2 COC1=CC=C(\C=C\C(=O)C2=C(OC)C=C(OC)C=C2O)C(OC)=C1 InChI=1S/C19H20O6/c1-22-13-7-5-12(17(10-13)24-3)6-8-15(20)19-16(21)9-14(23-2)11-18(19)25-4/h5-11,21H,1-4H3/b8-6+ IAUDUEQNUVKNBT-SOFGYWHQSA-N belongs to the class of organic compounds known as 2'-hydroxychalcones. These are organic compounds containing chalcone skeleton that carries a hydroxyl group at the 2'-position. 2'-Hydroxychalcones Organic compounds Phenylpropanoids and polyketides Linear 1,3-diarylpropanoids Chalcones and dihydrochalcones Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Acryloyl compounds Alkyl aryl ethers Anisoles Aryl ketones Benzoyl derivatives Cinnamylphenols Dimethoxybenzenes Enones Hydrocarbon derivatives Methoxyphenols Organic oxides Phenoxy compounds Styrenes Vinylogous acids 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 2'-hydroxychalcone Acryloyl-group Alkyl aryl ether Alpha,beta-unsaturated ketone Anisole Aromatic homomonocyclic compound Aryl ketone Benzenoid Benzoyl Cinnamylphenol Dimethoxybenzene Enone Ether Hydrocarbon derivative Ketone M-dimethoxybenzene Methoxybenzene Methoxyphenol Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenol Phenol ether Phenoxy compound Styrene Vinylogous acid Chalcones and dihydrochalcones logp 3.54 ALOGPS logs -4.34 ALOGPS solubility 1.59e-02 g/l ALOGPS logp 3.61 ChemAxon pka_strongest_acidic 8.19 ChemAxon pka_strongest_basic -4.3 ChemAxon iupac (2E)-3-(2,4-dimethoxyphenyl)-1-(2-hydroxy-4,6-dimethoxyphenyl)prop-2-en-1-one ChemAxon average_mass 344.3585 ChemAxon mono_mass 344.125988372 ChemAxon smiles COC1=CC=C(\C=C\C(=O)C2=C(OC)C=C(OC)C=C2O)C(OC)=C1 ChemAxon formula C19H20O6 ChemAxon inchi InChI=1S/C19H20O6/c1-22-13-7-5-12(17(10-13)24-3)6-8-15(20)19-16(21)9-14(23-2)11-18(19)25-4/h5-11,21H,1-4H3/b8-6+ ChemAxon inchikey IAUDUEQNUVKNBT-SOFGYWHQSA-N ChemAxon polar_surface_area 74.22 ChemAxon refractivity 94.71 ChemAxon polarizability 36.24 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 6 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 66465 Specdb::MsMs 66466 Specdb::MsMs 66467 Specdb::MsMs 124041 Specdb::MsMs 124042 Specdb::MsMs 124043 Specdb::MsMs 3597809 Specdb::MsMs 3597810 Specdb::MsMs 3597811 Specdb::MsMs 3597812 Specdb::MsMs 3597813 Specdb::MsMs 3597814 Sour cherry Type 1 specific Prunus cerasus 140311