DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:30:02 UTC
Update Date	2025-03-21 18:41:25 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00134140
Frequency	18.8
Structure
Chemical Formula	C₁₀H₁₇N₃O₄
Molecular Mass	243.1219
SMILES	NC(=O)CC(N)C(=O)N1CCCC1CC(=O)O
InChI Key	UUNVTIUWCUUOSU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids azacyclic compounds carbonyl compounds carboxylic acids fatty amides hydrocarbon derivatives monoalkylamines monocarboxylic acids and derivatives n-acylpyrrolidines organic oxides organonitrogen compounds organopnictogen compounds primary carboxylic acid amides tertiary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl carbonyl group carboxylic acid fatty amide n-acylpyrrolidine alpha-amino acid or derivatives carboxylic acid derivative organic oxide tertiary carboxylic acid amide aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound pyrrolidine organoheterocyclic compound alpha-amino acid amide azacycle carboxamide group monocarboxylic acid or derivatives organic oxygen compound hybrid peptide hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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