DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:42:39 UTC
Update Date	2025-03-25 00:47:25 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02161620
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₆N₂O₅
Molecular Mass	244.1059
SMILES	NCCCC(=O)N1C(C(=O)O)CCC1C(=O)O
InChI Key	CZLYFUDYXGATAV-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	n-acyl-alpha amino acids
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha amino acids azacyclic compounds carbonyl compounds carboxylic acids dicarboxylic acids and derivatives gamma amino acids and derivatives hydrocarbon derivatives monoalkylamines n-acylpyrrolidines organic oxides organonitrogen compounds organopnictogen compounds proline and derivatives pyrrolidine carboxylic acids tertiary carboxylic acid amides
Substituents	carbonyl group carboxylic acid gamma amino acid or derivatives n-acylpyrrolidine organic oxide pyrrolidine carboxylic acid tertiary carboxylic acid amide aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound pyrrolidine organoheterocyclic compound proline or derivatives azacycle n-acyl-alpha-amino acid carboxamide group pyrrolidine carboxylic acid or derivatives organic oxygen compound dicarboxylic acid or derivatives hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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