DeepMet

Record Information
HMDB Status	detected
Creation Date	2024-02-20 23:41:57 UTC
Update Date	2025-03-21 17:59:15 UTC
HMDB ID	HMDB0251771
Metabolite Identification
DeepMet ID	DMID00019670
Name	Emeriamine
Frequency	207.3
Structure
Chemical Formula	C₇H₁₇N₂O₂+
Molecular Mass	161.1285
SMILES	C[N+](C)(C)CC(N)CC(=O)O
InChI Key	DAWBGYHPBBDHMQ-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	amines carbonyl compounds carboxylic acids fatty acids and conjugates hydrocarbon derivatives monoalkylamines monocarboxylic acids and derivatives 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 beta amino acid or derivatives organic oxide monocarboxylic acid or derivatives organic oxygen compound organonitrogen compound organopnictogen compound hydrocarbon derivative primary aliphatic amine organic nitrogen compound organic cation organic salt amine organooxygen compound

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