DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:05:50 UTC
Update Date	2025-03-25 00:55:54 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02214830
Frequency	0.5
Structure
Chemical Formula	C₁₇H₂₇N₃O₃
Molecular Mass	321.2052
SMILES	CCC(C)C(N)C(=O)NC(Cc1ccccc1)C(O)CC(N)=O
InChI Key	IBFHCDDNDZWJDW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids amphetamines and derivatives benzene and substituted derivatives carbonyl compounds carboxylic acids and derivatives gamma amino acids and derivatives hydrocarbon derivatives isoleucine and derivatives monoalkylamines n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds primary carboxylic acid amides secondary alcohols secondary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl monocyclic benzene moiety carbonyl group gamma amino acid or derivatives fatty amide alpha-amino acid or derivatives carboxylic acid derivative organic oxide organonitrogen compound alpha-amino acid organopnictogen compound isoleucine or derivatives 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 hybrid peptide hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound

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