DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:27:56 UTC
Update Date	2025-03-21 18:40:16 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00129282
Frequency	19.7
Structure
Chemical Formula	C₁₅H₂₀N₂O₄
Molecular Mass	292.1423
SMILES	CC(C)C(NC(=O)Cc1ccccc1)C(=O)NCC(=O)O
InChI Key	FYZIBQXCJGTAJY-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	acyl glycines
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids carbonyl compounds carboxylic acids dipeptides hydrocarbon derivatives monocarboxylic acids and derivatives n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds phenylacetamides secondary carboxylic acid amides valine and derivatives
Substituents	fatty acyl monocyclic benzene moiety carbonyl group carboxylic acid fatty amide alpha peptide organic oxide organonitrogen compound alpha-amino acid organopnictogen compound phenylacetamide alpha-amino acid amide valine or derivatives carboxamide group n-acyl-amine n-acylglycine aromatic homomonocyclic compound alpha-dipeptide secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound hydrocarbon derivative benzenoid organic nitrogen compound organooxygen compound

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