DeepMet

Record Information
HMDB Status	predicted
Creation Date	2024-02-20 23:45:35 UTC
Update Date	2025-03-21 18:00:33 UTC
HMDB ID	HMDB0132459
Metabolite Identification
DeepMet ID	DMID00028039
Name	3-(4-methoxyphenyl)-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one
Frequency	134.8
Structure
Chemical Formula	C₁₆H₁₄O₅
Molecular Mass	286.0841
SMILES	COc1ccc(C=CC(=O)c2c(O)cc(O)cc2O)cc1
InChI Key	DGUBZDXYXXUHTJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	phenylpropanoids and polyketides
Class	linear 1,3-diarylpropanoids
Subclass	cinnamylphenols
Direct Parent	cinnamylphenols
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids acylphloroglucinols and derivatives alkyl aryl ethers alpha,beta-unsaturated ketones anisoles aryl ketones benzoyl derivatives cinnamic acids and derivatives hydrocarbon derivatives methoxybenzenes organic oxides phenoxy compounds vinylogous acids
Substituents	phenol ether monocyclic benzene moiety ether benzoyl 1-hydroxy-2-unsubstituted benzenoid cinnamylphenol alkyl aryl ether alpha,beta-unsaturated ketone ketone phloroglucinol derivative cinnamic acid or derivatives organic oxide acylphloroglucinol derivative benzenetriol 1-hydroxy-4-unsubstituted benzenoid methoxybenzene aromatic homomonocyclic compound vinylogous acid organic oxygen compound anisole phenol hydrocarbon derivative benzenoid phenoxy compound organooxygen compound aryl ketone

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