Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:33 UTC
Update Date2025-03-21 18:37:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00114094
Frequency23.2
Structure
Chemical FormulaC7H5NO2
Molecular Mass135.032
SMILESN#Cc1cccc(O)c1O
InChI KeyXHPDHXXZBWDFIB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzonitriles
Direct Parent benzonitriles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • nitriles
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • nitrile
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • benzonitrile
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • carbonitrile
  • organooxygen compound