Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:44:07 UTC
Update Date2025-03-21 18:00:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00024585
Frequency158.3
Structure
Chemical FormulaC6H13NO3
Molecular Mass147.0895
SMILESO=C(O)CCCNCCO
InChI KeyQICJKRUBYXCVLU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkanolamines
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • short-chain hydroxy acids and derivatives
  • straight chain fatty acids
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • amino acid
  • gamma amino acid or derivatives
  • fatty acid
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydroxy fatty acid
  • alkanolamine
  • alcohol
  • secondary aliphatic amine
  • straight chain fatty acid
  • secondary amine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine