DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:00:26 UTC
Update Date	2025-03-25 00:53:49 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02202232
Frequency	0.5
Structure
Chemical Formula	C₈H₁₉N₂O₃+
Molecular Mass	191.139
SMILES	C[N+](C)(C)CC(O)(CN)CC(=O)O
InChI Key	PDRHQGGPQZKCJN-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	gamma amino acids and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	1,2-aminoalcohols amines branched fatty acids carbonyl compounds carboxylic acids hydrocarbon derivatives hydroxy fatty acids monoalkylamines monocarboxylic acids and derivatives organic cations organic oxides organic salts organopnictogen compounds short-chain hydroxy acids and derivatives tertiary alcohols tetraalkylammonium salts
Substituents	fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid short-chain hydroxy acid gamma amino acid or derivatives fatty acid organic oxide organonitrogen compound organopnictogen compound hydroxy fatty acid organic cation organic salt alcohol tetraalkylammonium salt 1,2-aminoalcohol quaternary ammonium salt branched fatty acid tertiary alcohol monocarboxylic acid or derivatives organic oxygen compound hydrocarbon derivative primary aliphatic amine organic nitrogen compound amine organooxygen compound

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