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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:09 UTC
Update Date2025-03-25 00:51:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02190234
Frequency0.5
Structure
Chemical FormulaC10H15N3O2
Molecular Mass209.1164
SMILESCC(=O)N1CCC(O)(Cn2ccnc2)C1
InChI KeyGLCBFTJWCCUXIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-acylpyrrolidines
Direct Parent n-acylpyrrolidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary alcohols
  • tertiary carboxylic acid amides
  • Substituents
  • alcohol
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • n-acylpyrrolidine
  • carboxamide group
  • carboxylic acid derivative
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • imidazole
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound
  • azole
  • n-substituted imidazole