Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:19:11 UTC
Update Date2025-03-21 19:11:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00248883
Frequency8.4
Structure
Chemical FormulaC8H11NO
Molecular Mass137.0841
SMILESCc1ccc(C)c(O)c1N
InChI KeyCAMQCQPKZNSFND-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent p-xylenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • meta cresols
  • organooxygen compounds
  • organopnictogen compounds
  • ortho cresols
  • primary amines
  • p-xylenes
  • Substituents
  • m-cresol
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • p-xylene
  • organic oxygen compound
  • o-cresol
  • organonitrogen compound
  • organopnictogen compound
  • p-xylenol
  • phenol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound