Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:01:50 UTC
Update Date2025-03-21 18:07:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00066534
Frequency45.9
Structure
Chemical FormulaC10H17NO4
Molecular Mass215.1158
SMILESCCCC(CO)CC(=C=O)NCC(=O)O
InChI KeyMIPPIMLPQABHCE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • primary alcohols
  • ynolates
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • carboxylic acid
  • amino acid
  • secondary amine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • ynolate
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound
  • amine