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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:27 UTC
Update Date2025-03-25 00:56:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218584
Frequency0.5
Structure
Chemical FormulaC9H12N2O3
Molecular Mass196.0848
SMILESCn1cnc(C(O)C2CCC(=O)O2)c1
InChI KeyGOJDQZDREKPUHW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent n-substituted imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • gamma butyrolactones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • aromatic alcohol
  • carbonyl group
  • aromatic heteromonocyclic compound
  • carboxylic acid derivative
  • lactone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • gamma butyrolactone
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound