DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:51:27 UTC
Update Date	2025-03-21 18:03:03 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00041976
Frequency	81.6
Structure
Chemical Formula	C₁₅H₁₈N₂O₄
Molecular Mass	290.1267
SMILES	CC(=O)C1CCC(=O)N1C(=O)C(N)Cc1ccc(O)cc1
InChI Key	TVYYIYLKEIACJT-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	alpha amino acid amides
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids alpha amino acids amphetamines and derivatives azacyclic compounds benzene and substituted derivatives carboxylic acids and derivatives dicarboximides hydrocarbon derivatives ketones monoalkylamines n-acylpyrrolidines n-substituted carboxylic acid imides organic oxides organonitrogen compounds organopnictogen compounds pyrrolidine-2-ones
Substituents	2-pyrrolidone monocyclic benzene moiety carbonyl group aromatic heteromonocyclic compound n-acylpyrrolidine 1-hydroxy-2-unsubstituted benzenoid ketone organic oxide organonitrogen compound alpha-amino acid organopnictogen compound dicarboximide pyrrolidine carboxylic acid imide, n-substituted pyrrolidone organoheterocyclic compound amphetamine or derivatives alpha-amino acid amide azacycle carboxylic acid imide organic oxygen compound phenol hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound

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