Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:06:25 UTC
Update Date2025-03-25 01:18:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02354009
Frequency0.5
Structure
Chemical FormulaC4H7N3O
Molecular Mass113.0589
SMILESCc1nc(N)oc1N
InChI KeyDVKAWWKYBHVNHP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass oxazoles
Direct Parent 2,4,5-trisubstituted oxazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • 2,4,5-trisubstituted 1,3-oxazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound