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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:40 UTC
Update Date2025-03-21 18:36:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111960
Frequency23.7
Structure
Chemical FormulaC10H13NO
Molecular Mass163.0997
SMILESCOc1ccc2c(c1)CCN2C
InChI KeyBACGBOIFTFSBHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • dialkylarylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
    • Substituents
  • phenol ether
  • ether
  • azacycle
  • indole
  • alkyl aryl ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dialkylarylamine
  • amine
  • tertiary amine
  • organooxygen compound