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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:41:08 UTC
Update Date2025-03-25 01:08:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02295143
Frequency0.5
Structure
Chemical FormulaC6H9NO3
Molecular Mass143.0582
SMILESCNC1CCC(=O)OC1=O
InChI KeyHROUJNMKBFWGKK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid anhydrides
  • delta valerolactones
  • dialkylamines
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • Substituents
  • carbonyl group
  • delta valerolactone
  • lactone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • oxane
  • delta_valerolactone
  • organoheterocyclic compound
  • secondary aliphatic amine
  • secondary amine
  • oxacycle
  • organic oxygen compound
  • carboxylic acid anhydride
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine