DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:47:12 UTC
Update Date	2025-03-25 00:49:06 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02172049
Frequency	0.5
Structure
Chemical Formula	C₈H₁₆N₂O₃
Molecular Mass	188.1161
SMILES	CNC(C)CC(=O)NC(C)C(=O)O
InChI Key	QMJJTNRJTBVWMT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alanine and derivatives alpha amino acids amino acids beta amino acids and derivatives carbonyl compounds carboxylic acids dialkylamines hydrocarbon derivatives monocarboxylic acids and derivatives n-acyl amines n-acyl-alpha amino acids organic oxides organopnictogen compounds secondary carboxylic acid amides
Substituents	fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid amino acid or derivatives amino acid fatty amide alpha-amino acid or derivatives carboxylic acid derivative organic oxide organonitrogen compound alpha-amino acid organopnictogen compound n-acyl-alpha amino acid or derivatives secondary aliphatic amine n-acyl-alpha-amino acid secondary amine carboxamide group n-acyl-amine beta amino acid or derivatives secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound hybrid peptide alanine or derivatives hydrocarbon derivative organic nitrogen compound organooxygen compound amine

Showing information for DMID02172049