Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:17:35 UTC
Update Date2025-03-21 20:52:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00384351
Frequency4.8
Structure
Chemical FormulaC6H11NO3
Molecular Mass145.0739
SMILESNC1C(O)CCC1C(=O)O
InChI KeyKUXUPXIJYKYFJK-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 homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • cyclopentanols
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • cyclic alcohol
  • beta amino acid or derivatives
  • cyclopentanol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound