Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:08 UTC
Update Date2025-03-25 00:57:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02224748
Frequency0.5
Structure
Chemical FormulaC5H5N3O3
Molecular Mass155.0331
SMILESNc1[nH]c(=O)c(=O)[nH]c1C=O
InChI KeyYRFUQRRTHWTXKO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrazines
Direct Parent pyrazine carboxylic acids and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl-aldehydes
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • aldehyde
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrazine carboxylic acid or derivatives
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound