DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:05:48 UTC
Update Date	2025-03-21 18:29:10 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00076050
Frequency	38.8
Structure
Chemical Formula	C₁₄H₁₆N₂O₄
Molecular Mass	276.111
SMILES	NC(CCCCN1C(=O)c2ccccc2C1=O)C(=O)O
InChI Key	WFKJLXBKVVZRLS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organoheterocyclic compounds
Class	isoindoles and derivatives
Subclass	isoindolines
Direct Parent	phthalimides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	alpha amino acids amino fatty acids azacyclic compounds benzenoids carbonyl compounds carboxylic acids heterocyclic fatty acids hydrocarbon derivatives isoindoles medium-chain fatty acids monoalkylamines monocarboxylic acids and derivatives n-substituted carboxylic acid imides organic oxides organonitrogen compounds organopnictogen compounds
Substituents	fatty acyl carbonyl group carboxylic acid heterocyclic fatty acid fatty acid alpha-amino acid or derivatives carboxylic acid derivative organic oxide aromatic heteropolycyclic compound organonitrogen compound alpha-amino acid organopnictogen compound medium-chain fatty acid carboxylic acid imide, n-substituted azacycle isoindole amino fatty acid phthalimide carboxylic acid imide monocarboxylic acid or derivatives organic oxygen compound hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound

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