DeepMet

Record Information
HMDB Status	predicted
Creation Date	2024-02-21 00:05:07 UTC
Update Date	2025-03-21 18:28:51 UTC
HMDB ID	HMDB0131772
Metabolite Identification
DeepMet ID	DMID00074445
Name	2-(2,4-dihydroxy-5-methoxyphenyl)-3,5,7-trihydroxy-4H-chromen-4-one
Frequency	39.9
Structure
Chemical Formula	C₁₆H₁₂O₈
Molecular Mass	332.0532
SMILES	COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)c(O)cc1O
InChI Key	SUXQGMDQAIFPOV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	phenylpropanoids and polyketides
Class	flavonoids
Subclass	flavones
Direct Parent	flavonols
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-o-methylated flavonoids 3-hydroxyflavonoids 4'-hydroxyflavonoids 4-alkoxyphenols 5-hydroxyflavonoids 7-hydroxyflavonoids alkyl aryl ethers anisoles chromones flavonoids heteroaromatic compounds hydrocarbon derivatives methoxybenzenes methoxyphenols organic oxides oxacyclic compounds phenoxy compounds pyranones and derivatives resorcinols vinylogous acids
Substituents	3-hydroxyflavone phenol ether monocyclic benzene moiety 3-hydroxyflavonoid ether 1-benzopyran methoxyphenol 1-hydroxy-2-unsubstituted benzenoid alkyl aryl ether resorcinol organic oxide chromone aromatic heteropolycyclic compound pyranone organoheterocyclic compound 4-alkoxyphenol benzopyran heteroaromatic compound 5-hydroxyflavonoid 1-hydroxy-4-unsubstituted benzenoid methoxybenzene 3p-methoxyflavonoid-skeleton oxacycle vinylogous acid organic oxygen compound pyran anisole 7-hydroxyflavonoid 4'-hydroxyflavonoid phenol hydrocarbon derivative benzenoid phenoxy compound organooxygen compound

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