Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:58:53 UTC
Update Date2025-03-24 20:33:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01486913
Frequency0.9
Structure
Chemical FormulaC6H8N2O2
Molecular Mass140.0586
SMILESCOc1ncnc(C)c1O
InChI KeyDXQWOTGUTOBJEZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent hydroxypyrimidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • ether
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyrimidine
  • alkyl aryl ether
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound