DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:17:24 UTC
Update Date	2025-03-21 18:35:06 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00103994
Frequency	26.1
Structure
Chemical Formula	C₁₃H₂₆N₂O₄
Molecular Mass	274.1893
SMILES	CCC(C)C(N)C(=O)NC(CC(C)C)C(O)C(=O)O
InChI Key	AXNWTMROABCXNZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid glycopeptides
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids alpha hydroxy acids and derivatives amino fatty acids beta amino acids and derivatives branched fatty acids carbonyl compounds carboxylic acids hydrocarbon derivatives hydroxy fatty acids isoleucine and derivatives medium-chain fatty acids medium-chain hydroxy acids and derivatives monoalkylamines monocarboxylic acids and derivatives monosaccharides n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid alpha-hydroxy acid fatty amide monosaccharide fatty acid alpha-amino acid or derivatives carboxylic acid derivative medium-chain hydroxy acid saccharide organic oxide organonitrogen compound alpha-amino acid organopnictogen compound medium-chain fatty acid hydroxy fatty acid isoleucine or derivatives alcohol alpha-amino acid amide hydroxy acid carboxamide group amino fatty acid branched fatty acid n-acyl-amine beta amino acid or derivatives secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound hybrid glycopeptide secondary alcohol hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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