DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:15:40 UTC
Update Date	2025-03-21 18:34:12 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00099648
Frequency	27.5
Structure
Chemical Formula	C₁₁H₁₄N₂O₄
Molecular Mass	238.0954
SMILES	NC(CCC(=O)O)C(=O)Nc1ccccc1O
InChI Key	LOGWAZJBRCZAGT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	glutamic acid and derivatives
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids alpha amino acid amides alpha amino acids anilides carbonyl compounds carboxylic acids fatty amides hydrocarbon derivatives monoalkylamines monocarboxylic acids and derivatives n-arylamides organic oxides organopnictogen compounds secondary carboxylic acid amides
Substituents	fatty acyl monocyclic benzene moiety carbonyl group carboxylic acid fatty amide 1-hydroxy-2-unsubstituted benzenoid n-arylamide organic oxide organonitrogen compound alpha-amino acid organopnictogen compound alpha-amino acid amide glutamic acid or derivatives 1-hydroxy-4-unsubstituted benzenoid carboxamide group aromatic homomonocyclic compound anilide secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound phenol hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound

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