DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-20 23:44:08 UTC
Update Date	2025-03-21 18:00:00 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00024610
Frequency	163.3
Structure
Chemical Formula	C₇H₁₇N₂O₂+
Molecular Mass	161.1285
SMILES	C[N+](C)(C)CC(=O)NCCO
InChI Key	YTFWOJMRDMBDMA-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	alpha amino acid amides
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alcohols and polyols alkanolamines alpha amino acids carbonyl compounds carboxylic acids and derivatives hydrocarbon derivatives n-acylethanolamines organic cations organic oxides organic salts organopnictogen compounds secondary carboxylic acid amides tetraalkylammonium salts
Substituents	alcohol aliphatic acyclic compound carbonyl group alpha-amino acid amide tetraalkylammonium salt quaternary ammonium salt carboxamide group n-acylethanolamine secondary carboxylic acid amide organic oxide organic oxygen compound organonitrogen compound alpha-amino acid organopnictogen compound hydrocarbon derivative organic nitrogen compound organic cation organic salt amine organooxygen compound alkanolamine

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