DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:50:51 UTC
Update Date	2025-03-25 00:50:22 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02180446
Frequency	0.5
Structure
Chemical Formula	C₈H₁₇N₂O₄+
Molecular Mass	205.1183
SMILES	C[N+](C)(CC(=O)O)CC(N)CC(=O)O
InChI Key	OZHFZEJOELVXQR-UHFFFAOYSA-O
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	beta amino acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acids amines carbonyl compounds carboxylic acids dicarboxylic acids and derivatives fatty acids and conjugates hydrocarbon derivatives monoalkylamines organic cations organic oxides organic salts organopnictogen compounds tetraalkylammonium salts
Substituents	aliphatic acyclic compound carbonyl group carboxylic acid tetraalkylammonium salt quaternary ammonium salt fatty acid alpha-amino acid or derivatives beta amino acid or derivatives organic oxide organic oxygen compound alpha-amino acid organonitrogen compound dicarboxylic acid or derivatives organopnictogen compound hydrocarbon derivative primary aliphatic amine organic nitrogen compound organic cation organic salt amine organooxygen compound

Showing information for DMID02180446