Hmdb loader
Record Information
HMDB Statusquantified
Creation Date2024-02-20 23:34:59 UTC
Update Date2025-03-21 17:56:49 UTC
HMDB IDHMDB0000301
Metabolite Identification
DeepMet IDDMID00003807
NameUrocanic acid
Frequency2261.0
Structure
Chemical FormulaC6H6N2O2
Molecular Mass138.0429
SMILESO=C(O)C=Cc1cnc[nH]1
InChI KeyLOIYMIARKYCTBW-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 acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound