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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:47 UTC
Update Date2025-03-25 00:45:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150655
Frequency0.5
Structure
Chemical FormulaC8H11NO2
Molecular Mass153.079
SMILESO=C(O)C1CCN2C=CCC12
InChI KeyYDCWTSODGYUZGC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolizines
Subclass pyrrolizines
Direct Parent pyrrolizines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • enamines
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrrolidine carboxylic acids
  • pyrrolines
  • trialkylamines
    • Substituents
  • carbonyl group
  • carboxylic acid
  • pyrrolizine
  • amino acid or derivatives
  • amino acid
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • pyrrolidine carboxylic acid
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • tertiary amine
  • azacycle
  • tertiary aliphatic amine
  • monocarboxylic acid or derivatives
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • pyrroline
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound
  • enamine