Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:26 UTC
Update Date2025-03-25 00:45:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149793
Frequency0.5
Structure
Chemical FormulaC9H13NO3
Molecular Mass183.0895
SMILESCC(=O)C1C2CCC(N2)C1C(=O)O
InChI KeyPHXWFXCOXNCHBH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidine carboxylic acids and derivatives
Direct Parent pyrrolidine carboxylic acids
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carboxylic acids
  • dialkylamines
  • gamma-keto acids and derivatives
  • hydrocarbon derivatives
  • ketones
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • carboxylic acid derivative
  • ketone
  • aliphatic heteropolycyclic compound
  • organic oxide
  • pyrrolidine carboxylic acid
  • organonitrogen compound
  • organopnictogen compound
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • gamma-keto acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • keto acid
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine