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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:26 UTC
Update Date2025-03-25 00:49:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177248
Frequency0.5
Structure
Chemical FormulaC11H14N2O3
Molecular Mass222.1004
SMILESCc1ccc(CNC2CCC(=O)NC2=O)o1
InChI KeyGJCIULAOWVIYKE-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 aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • delta lactams
  • dialkylamines
  • dicarboximides
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • piperidinediones
  • Substituents
  • furan
  • carbonyl group
  • aromatic heteromonocyclic compound
  • carboxylic acid imide, n-unsubstituted
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • piperidinedione
  • piperidinone
  • dicarboximide
  • piperidine
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • carboxylic acid imide
  • delta-lactam
  • oxacycle
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine