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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:38 UTC
Update Date2025-03-25 00:49:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175340
Frequency0.5
Structure
Chemical FormulaC9H13NO4
Molecular Mass199.0845
SMILESO=C(O)CC1C2CCC(N2)C1C(=O)O
InChI KeyLIYGQFFICPYNNW-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
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • dicarboxylic acids and derivatives
  • hydrocarbon 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
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • pyrrolidine carboxylic acid
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine