Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:39 UTC
Update Date2025-03-21 18:38:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119176
Frequency21.9
Structure
Chemical FormulaC9H13NO2
Molecular Mass167.0946
SMILESCN(C)Cc1cc(O)ccc1O
InChI KeyZYXLGIIYEXDMGI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass benzenediols
Direct Parent hydroquinones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aralkylamines
  • benzylamines
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • phenylmethylamines
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • tertiary aliphatic amine
  • 1-hydroxy-2-unsubstituted benzenoid
  • aralkylamine
  • hydroquinone
  • aromatic homomonocyclic compound
  • phenylmethylamine
  • organic oxygen compound
  • benzylamine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound