DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:53:08 UTC
Update Date	2025-03-21 18:03:43 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00046065
Frequency	72.9
Structure
Chemical Formula	C₉H₁₈N₂O₃
Molecular Mass	202.1317
SMILES	CC(C)C(N)C(=O)NCCCC(=O)O
InChI Key	ASFJAXMINAYWHI-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 branched fatty acids carbonyl compounds carboxylic acids gamma amino acids and derivatives hydrocarbon derivatives monoalkylamines monocarboxylic acids and derivatives n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds secondary carboxylic acid amides valine and derivatives
Substituents	fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid gamma amino acid or derivatives fatty amide fatty acid alpha-amino acid or derivatives carboxylic acid derivative organic oxide organonitrogen compound alpha-amino acid organopnictogen compound alpha-amino acid amide valine or derivatives carboxamide group branched fatty acid n-acyl-amine secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound hybrid peptide hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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