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Showing information for DMID00211104

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:02:58 UTC
Update Date2025-03-21 19:01:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00211104
Frequency10.4
Structure
Chemical FormulaC8H11NO
Molecular Mass137.0841
SMILESCOc1cc(C)ccc1N
InChI KeyCJJLEUQMMMLOFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • hydrocarbon derivatives
  • methoxybenzenes
  • organopnictogen compounds
  • phenoxy compounds
  • primary amines
  • toluenes
    • Substituents
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • anisole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • phenoxy compound
  • toluene
  • amine
  • organooxygen compound