Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:28:27 UTC
Update Date2025-03-21 19:18:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00270029
Frequency7.6
Structure
Chemical FormulaC8H9NO
Molecular Mass135.0684
SMILESC=CNc1ccc(O)cc1
InChI KeyISTWBZBCJZWALO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent secondary alkylarylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • secondary aliphatic/aromatic amine
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound