DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:57:42 UTC
Update Date	2025-03-21 18:05:23 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00056699
Frequency	56.1
Structure
Chemical Formula	C₁₀H₁₄N₂O₄
Molecular Mass	226.0954
SMILES	O=C(O)C1CCC(=O)N1C(=O)C1CCCN1
InChI Key	RSZZIJPHQIDLTR-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	dipeptides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids amino acids azacyclic compounds carbonyl compounds carboxylic acids dialkylamines dicarboximides hydrocarbon derivatives monocarboxylic acids and derivatives n-acyl-alpha amino acids n-acylpyrrolidines n-substituted carboxylic acid imides organic oxides organopnictogen compounds oxoprolines proline and derivatives pyrrolidine carboxylic acids pyrrolidine-2-ones pyrrolidinecarboxamides
Substituents	2-pyrrolidone carbonyl group carboxylic acid amino acid or derivatives amino acid n-acylpyrrolidine alpha-amino acid or derivatives organic oxide pyrrolidine carboxylic acid aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound dicarboximide pyrrolidine carboxylic acid imide, n-substituted pyrrolidone organoheterocyclic compound n-acyl-alpha amino acid or derivatives proline or derivatives secondary aliphatic amine oxoproline alpha-amino acid amide azacycle n-acyl-alpha-amino acid secondary amine carboxylic acid imide alpha-dipeptide monocarboxylic acid or derivatives pyrrolidine carboxylic acid or derivatives organic oxygen compound hydrocarbon derivative organic nitrogen compound pyrrolidine-2-carboxamide organooxygen compound amine

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