Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:35:18 UTC
Update Date2025-03-21 17:56:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00004545
Frequency1234.6
Structure
Chemical FormulaC5H9NO2
Molecular Mass115.0633
SMILESO=C(O)C1CCNC1
InChI KeyJAEIBKXSIXOLOL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidine carboxylic acids and derivatives
Direct Parent pyrrolidine carboxylic acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • carboxylic acid
  • azacycle
  • amino acid or derivatives
  • amino acid
  • secondary amine
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyrrolidine carboxylic acid
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine