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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:59 UTC
Update Date2025-03-25 00:57:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02224436
Frequency0.5
Structure
Chemical FormulaC7H9NO5
Molecular Mass187.0481
SMILESO=C(O)C1C2COC(N2)C1C(=O)O
InChI KeyYFDDPERRUWOUSQ-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
  • hemiaminals
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • oxazolidines
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • carboxylic acid derivative
  • hemiaminal
  • aliphatic heteropolycyclic compound
  • organic oxide
  • pyrrolidine carboxylic acid
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • oxacycle
  • organic oxygen compound
  • oxazolidine
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine