DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:11:33 UTC
Update Date	2025-03-21 18:32:12 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00089664
Frequency	31.5
Structure
Chemical Formula	C₁₁H₂₃N₃O₃
Molecular Mass	245.1739
SMILES	CC(C)C(N)C(=O)NC(CCC(N)=O)C(C)O
InChI Key	HCGXQHDHOLVHFE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids carbonyl compounds carboxylic acids and derivatives gamma amino acids and derivatives hydrocarbon derivatives monoalkylamines n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds primary carboxylic acid amides secondary alcohols secondary carboxylic acid amides valine and derivatives
Substituents	primary carboxylic acid amide fatty acyl aliphatic acyclic compound 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 alcohol alpha-amino acid amide valine or derivatives carboxamide group n-acyl-amine secondary carboxylic acid amide organic oxygen compound secondary alcohol hybrid peptide hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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