Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:24 UTC
Update Date2025-03-21 17:57:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00007050
Frequency735.1
Structure
Chemical FormulaC5H7N3O2
Molecular Mass141.0538
SMILESNCc1c[nH]c(=O)[nH]c1=O
InChI KeyYJHUFZQMNTWHBO-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
  • lactams
  • monoalkylamines
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonic acid derivative
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound