Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:52:31 UTC
Update Date2025-03-25 01:13:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02321677
Frequency0.5
Structure
Chemical FormulaC4H6N2O2
Molecular Mass114.0429
SMILESCc1noc(CO)n1
InChI KeyOQKJMIGPYYWVKU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass oxadiazoles
Direct Parent 1,2,4-oxadiazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • 1,2,4-oxadiazole
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound