Hmdb loader
Record Information
HMDB Statusquantified
Creation Date2024-02-20 23:33:31 UTC
Update Date2025-03-21 17:56:08 UTC
HMDB IDHMDB0000957
Metabolite Identification
DeepMet IDDMID00000289
NamePyrocatechol
Frequency14852.0
Structure
Chemical FormulaC6H6O2
Molecular Mass110.0368
SMILESOc1ccccc1O
InChI KeyYCIMNLLNPGFGHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxygen compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • hydrocarbon derivative
  • 1-hydroxy-4-unsubstituted benzenoid
  • organooxygen compound