1.0 2010-04-08 22:12:30 UTC 2019-11-26 03:13:26 UTC FDB016552 Persicogenin Isolated from Persica vulgaris (peach). Persicogenin is found in peach. 3',5-Dihydroxy-4',7-dimethoxyflavanone Persicogenin C17H16O6 316.3053 316.094688244 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-3,4-dihydro-2H-1-benzopyran-4-one persicogenin 28590-40-1 COC1=CC(O)=C2C(=O)CC(OC2=C1)C1=CC(O)=C(OC)C=C1 InChI=1S/C17H16O6/c1-21-10-6-12(19)17-13(20)8-15(23-16(17)7-10)9-3-4-14(22-2)11(18)5-9/h3-7,15,18-19H,8H2,1-2H3 LWBHKKLWSUFUNZ-UHFFFAOYSA-N belongs to the class of organic compounds known as 7-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone. 7-O-methylated flavonoids Organic compounds Phenylpropanoids and polyketides Flavonoids O-methylated flavonoids Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-hydroxyflavonoids 4'-O-methylated flavonoids 5-hydroxyflavonoids Alkyl aryl ethers Anisoles Aryl alkyl ketones Chromones Flavanones Hydrocarbon derivatives Methoxybenzenes Methoxyphenols Organic oxides Oxacyclic compounds Phenoxy compounds Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3'-hydroxyflavonoid 4p-methoxyflavonoid-skeleton 5-hydroxyflavonoid 7-methoxyflavonoid-skeleton Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Chromane Chromone Ether Flavan Flavanone Hydrocarbon derivative Hydroxyflavonoid Ketone Methoxybenzene Methoxyphenol Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Phenol ether Phenoxy compound Vinylogous acid Flavanones logp 2.80 ALOGPS logs -3.64 ALOGPS solubility 7.31e-02 g/l ALOGPS melting_point Mp 163-164° logp 2.82 ChemAxon pka_strongest_acidic 9.54 ChemAxon pka_strongest_basic -3.9 ChemAxon iupac 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-3,4-dihydro-2H-1-benzopyran-4-one ChemAxon average_mass 316.3053 ChemAxon mono_mass 316.094688244 ChemAxon smiles COC1=CC(O)=C2C(=O)CC(OC2=C1)C1=CC(O)=C(OC)C=C1 ChemAxon formula C17H16O6 ChemAxon inchi InChI=1S/C17H16O6/c1-21-10-6-12(19)17-13(20)8-15(23-16(17)7-10)9-3-4-14(22-2)11(18)5-9/h3-7,15,18-19H,8H2,1-2H3 ChemAxon inchikey LWBHKKLWSUFUNZ-UHFFFAOYSA-N ChemAxon polar_surface_area 85.22 ChemAxon refractivity 82.24 ChemAxon polarizability 32.36 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 6 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 15992 Specdb::CMs 45414 Specdb::CMs 161759 Specdb::MsMs 9536 Specdb::MsMs 9537 Specdb::MsMs 9538 Specdb::MsMs 16208 Specdb::MsMs 16209 Specdb::MsMs 16210 Specdb::MsMs 2297371 Specdb::MsMs 2297372 Specdb::MsMs 2297373 HMDB37481 #<Reference:0x000055ce30abf5f0> Peach Type 1 specific Prunus persica 3760