DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:52:50 UTC
Update Date	2025-03-25 00:51:07 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02184907
Frequency	0.5
Structure
Chemical Formula	C₁₀H₁₆N₄O₄
Molecular Mass	256.1172
SMILES	N=C(N)NCCCC(=O)N1C(=O)CCC1C(=O)O
InChI Key	KKBRGKGDZDQPGC-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 carboximidamides carboxylic acids dicarboximides gamma amino acids and derivatives guanidines hydrocarbon derivatives imines monocarboxylic acids and derivatives n-acylpyrrolidines n-substituted carboxylic acid imides organic oxides organopnictogen compounds oxoprolines proline and derivatives pyrrolidine carboxylic acids pyrrolidine-2-ones
Substituents	2-pyrrolidone carbonyl group carboxylic acid gamma amino acid or derivatives guanidine imine n-acylpyrrolidine 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 proline or derivatives oxoproline azacycle n-acyl-alpha-amino acid carboximidamide carboxylic acid imide monocarboxylic acid or derivatives pyrrolidine carboxylic acid or derivatives organic oxygen compound hydrocarbon derivative organic nitrogen compound organooxygen compound

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