Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:49:39 UTC
Update Date2025-03-21 18:51:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00180501
Frequency19.0
Structure
Chemical FormulaC6H8N2O2
Molecular Mass140.0586
SMILESCC(=O)OCc1cnc[nH]1
InChI KeyDWFVOYGDFIDRJK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • imidazole
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound