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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:40:21 UTC
Update Date2025-03-21 17:58:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00016156
Frequency265.6
Structure
Chemical FormulaC11H14N2O2
Molecular Mass206.1055
SMILESO=C(Nc1ccc(O)cc1)C1CCCN1
InChI KeyQFBZTUFSZQXMQZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent proline and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alpha amino acid amides
  • alpha amino acids
  • anilides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • pyrrolidinecarboxamides
  • secondary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • n-arylamide
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • proline or derivatives
  • secondary aliphatic amine
  • alpha-amino acid amide
  • azacycle
  • secondary amine
  • carboxamide group
  • anilide
  • secondary carboxylic acid amide
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • pyrrolidine-2-carboxamide
  • organooxygen compound
  • amine