Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:07:03 UTC
Update Date2025-03-21 23:08:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00643968
Frequency2.5
Structure
Chemical FormulaC5H6N2O2
Molecular Mass126.0429
SMILESCn1cc(O)cnc1=O
InChI KeyPPEHGHNMBPQDMP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyrimidines
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • hydroxypyrimidine
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound