Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:38:57 UTC
Update Date2025-03-25 01:08:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02290247
Frequency0.5
Structure
Chemical FormulaC6H8N2O2
Molecular Mass140.0586
SMILESCOc1nc(=O)[nH]cc1C
InChI KeyNWUTZAVMDAGNIG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • ether
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • alkyl aryl ether
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound