DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:10:57 UTC
Update Date	2025-03-25 00:57:43 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02226523
Frequency	0.5
Structure
Chemical Formula	C₁₈H₂₉N₃O₄
Molecular Mass	351.2158
SMILES	CC(N)C(=O)NC(CNC(=O)C(O)C(C)(C)CO)Cc1ccccc1
InChI Key	USXGQVYWJQGCJV-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 homomonocyclic compounds
Alternative Parents	alanine and derivatives alpha amino acids amphetamines and derivatives benzene and substituted derivatives carbonyl compounds carboxylic acids and derivatives hydrocarbon derivatives monoalkylamines monosaccharides n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl monocyclic benzene moiety carbonyl group fatty amide monosaccharide saccharide organic oxide organonitrogen compound alpha-amino acid organopnictogen compound amphetamine or derivatives alcohol alpha-amino acid amide carboxamide group n-acyl-amine aromatic homomonocyclic compound secondary carboxylic acid amide organic oxygen compound secondary alcohol alanine or derivatives hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound

Showing information for DMID02226523