DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:30:59 UTC
Update Date	2025-03-21 18:41:49 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00136316
Frequency	18.4
Structure
Chemical Formula	C₇H₁₄N₂O₃
Molecular Mass	174.1004
SMILES	CC(NCCCC(N)=O)C(=O)O
InChI Key	ZELREQYFIJUCIX-UHFFFAOYSA-N
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	alanine and derivatives alpha amino acids amino acids carbonyl compounds carboxylic acids dialkylamines fatty amides hydrocarbon derivatives monocarboxylic acids and derivatives organic oxides organopnictogen compounds primary carboxylic acid amides
Substituents	primary carboxylic acid amide fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid amino acid gamma amino acid or derivatives fatty amide alpha-amino acid or derivatives organic oxide organonitrogen compound alpha-amino acid organopnictogen compound secondary aliphatic amine secondary amine carboxamide group monocarboxylic acid or derivatives organic oxygen compound alanine or derivatives hydrocarbon derivative organic nitrogen compound organooxygen compound amine

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