DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:29:22 UTC
Update Date	2025-03-21 18:41:08 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00132635
Frequency	19.0
Structure
Chemical Formula	C₅H₁₁NO₃
Molecular Mass	133.0739
SMILES	NCC(CO)CC(=O)O
InChI Key	MLJWMAJBCXBCGJ-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	branched fatty acids carbonyl compounds carboxylic acids hydrocarbon derivatives hydroxy fatty acids monoalkylamines monocarboxylic acids and derivatives organic oxides organonitrogen compounds organopnictogen compounds primary alcohols short-chain hydroxy acids and derivatives
Substituents	alcohol fatty acyl aliphatic acyclic compound carbonyl group carboxylic acid short-chain hydroxy acid gamma amino acid or derivatives fatty acid branched fatty acid organic oxide monocarboxylic acid or derivatives organic oxygen compound organonitrogen compound organopnictogen compound hydrocarbon derivative hydroxy fatty acid primary aliphatic amine organic nitrogen compound primary alcohol organooxygen compound

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