DeepMet

Record Information
HMDB Status	predicted
Creation Date	2024-02-21 00:01:29 UTC
Update Date	2025-03-21 18:06:52 UTC
HMDB ID	HMDB0132455
Metabolite Identification
DeepMet ID	DMID00065697
Name	7-hydroxy-2-(4-hydroxyphenyl)-5-methoxy-4H-chromen-4-one
Frequency	46.5
Structure
Chemical Formula	C₁₆H₁₂O₅
Molecular Mass	284.0685
SMILES	COc1cc(O)cc2oc(-c3ccc(O)cc3)cc(=O)c12
InChI Key	YQABHAHJGSNVQR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	phenylpropanoids and polyketides
Class	flavonoids
Subclass	o-methylated flavonoids
Direct Parent	5-o-methylated flavonoids
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids 4'-hydroxyflavonoids 7-hydroxyflavonoids alkyl aryl ethers anisoles benzene and substituted derivatives chromones flavonoids heteroaromatic compounds hydrocarbon derivatives organic oxides oxacyclic compounds pyranones and derivatives vinylogous esters
Substituents	phenol ether monocyclic benzene moiety ether 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid alkyl aryl ether organic oxide chromone aromatic heteropolycyclic compound 5-methoxyflavonoid-skeleton pyranone organoheterocyclic compound benzopyran vinylogous ester heteroaromatic compound oxacycle organic oxygen compound pyran anisole 7-hydroxyflavonoid 4'-hydroxyflavonoid phenol hydrocarbon derivative benzenoid organooxygen compound

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