DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:59:08 UTC
Update Date	2025-03-21 18:05:57 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00060126
Frequency	52.1
Structure
Chemical Formula	C₁₁H₁₉N₃O₅
Molecular Mass	273.1325
SMILES	CC(=O)NCCCC(=O)NC(CCC(N)=O)C(=O)O
InChI Key	WJUKZXUTSFZELU-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	glutamine and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	acetamides alpha amino acids carbonyl compounds carboxylic acids fatty acids and conjugates gamma amino acids and derivatives hydrocarbon derivatives monocarboxylic acids and derivatives n-acyl amines n-acyl-alpha amino acids organic oxides organonitrogen compounds organopnictogen compounds primary carboxylic acid amides secondary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid glutamine or derivatives gamma amino acid or derivatives fatty amide fatty acid organic oxide organonitrogen compound alpha-amino acid organopnictogen compound acetamide n-acyl-alpha amino acid or derivatives n-acyl-alpha-amino acid carboxamide group n-acyl-amine secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound hydrocarbon derivative organic nitrogen compound organooxygen compound

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