Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:02:01 UTC
Update Date2025-03-25 00:32:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02066676
Frequency0.6
Structure
Chemical FormulaC5H8N2O2
Molecular Mass128.0586
SMILESNCc1cnc(CO)o1
InChI KeyBLQCHSOQAIBBDO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass oxazoles
Direct Parent 2,5-disubstituted oxazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • 2,5-disubstituted 1,3-oxazole
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound