Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:52 UTC
Update Date2025-03-21 18:40:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00131515
Frequency19.2
Structure
Chemical FormulaC6H13NO3
Molecular Mass147.0895
SMILESCC(CO)C(N)CC(=O)O
InChI KeyLLMJFUHFZXZJMP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • methyl-branched 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
  • methyl-branched fatty acid
  • short-chain hydroxy acid
  • fatty acid
  • branched fatty acid
  • beta amino acid or derivatives
  • 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