DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:39:35 UTC
Update Date	2025-03-25 00:46:23 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02154898
Frequency	0.5
Structure
Chemical Formula	C₁₁H₁₀O₅
Molecular Mass	222.0528
SMILES	COc1ccc(C(=O)O)cc1C=CC(=O)O
InChI Key	UWJVHKNLSCWHPD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	phenylpropanoids and polyketides
Class	cinnamic acids and derivatives
Subclass	cinnamic acids and derivatives
Direct Parent	cinnamic acids and derivatives
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	alkyl aryl ethers anisoles benzoic acids benzoyl derivatives carbonyl compounds carboxylic acids dicarboxylic acids and derivatives hydrocarbon derivatives methoxybenzenes organic oxides p-methoxybenzoic acids and derivatives phenoxy compounds
Substituents	phenol ether monocyclic benzene moiety carbonyl group ether carboxylic acid benzoyl benzoic acid or derivatives alkyl aryl ether carboxylic acid derivative methoxybenzene aromatic homomonocyclic compound cinnamic acid or derivatives organic oxide organic oxygen compound p-methoxybenzoic acid or derivatives anisole dicarboxylic acid or derivatives hydrocarbon derivative benzenoid benzoic acid phenoxy compound organooxygen compound

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