Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:41 UTC
Update Date2025-03-21 17:57:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00007723
Frequency647.6
Structure
Chemical FormulaC7H8O3
Molecular Mass140.0473
SMILESCc1cc(O)c(O)c(O)c1
InChI KeyNYUABOGYMWADSF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass benzenetriols and derivatives
Direct Parent pyrogallols and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • meta cresols
  • organooxygen compounds
  • para cresols
  • toluenes
  • Substituents
  • monocyclic benzene moiety
  • pyrogallol derivative
  • m-cresol
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • p-cresol
  • hydrocarbon derivative
  • toluene
  • organooxygen compound