Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:33 UTC
Update Date2025-03-21 17:59:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00021013
Frequency191.2
Structure
Chemical FormulaC7H13NO2
Molecular Mass143.0946
SMILESCCOC(=O)C1CCCN1
InChI KeyQPNJHVDIRZNKOX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid esters
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • proline and derivatives
  • pyrrolidine carboxylic acids
  • Substituents
  • carbonyl group
  • organic oxide
  • pyrrolidine carboxylic acid
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • proline or derivatives
  • secondary aliphatic amine
  • alpha-amino acid ester
  • azacycle
  • secondary amine
  • monocarboxylic acid or derivatives
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine