Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:31 UTC
Update Date2025-03-25 00:50:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179697
Frequency0.5
Structure
Chemical FormulaC7H6N4O4
Molecular Mass210.0389
SMILESCOc1nc(O)c2[nH]c(=O)[nH]c(=O)c2n1
InChI KeyIEVASDLCOFBSAY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyrimidines
  • lactams
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • ether
  • carbonic acid derivative
  • lactam
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • hydroxypyrimidine
  • alkyl aryl ether
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound