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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:31 UTC
Update Date2025-03-25 00:58:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02232177
Frequency0.5
Structure
Chemical FormulaC11H15NO3
Molecular Mass209.1052
SMILESCCC1=C(C)C2C(C(=O)O)CCN2C1=O
InChI KeyIJPIUJPHIPWMRW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolizines
Subclass pyrrolizines
Direct Parent pyrrolizines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • lactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine carboxylic acids
  • pyrrolines
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • carboxylic acid
  • pyrrolizine
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • pyrroline
  • pyrrolidine carboxylic acid
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound