Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:42 UTC
Update Date2025-03-25 00:52:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02193688
Frequency0.5
Structure
Chemical FormulaC11H16ClNO
Molecular Mass213.092
SMILESCN(C)CCCOc1ccccc1Cl
InChI KeyUNFVBIKYMRESAE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • aryl chlorides
  • chlorobenzenes
  • hydrocarbon derivatives
  • organochlorides
  • organopnictogen compounds
  • phenoxy compounds
  • trialkylamines
  • Substituents
  • aryl chloride
  • chlorobenzene
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • organochloride
  • tertiary aliphatic amine
  • alkyl aryl ether
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • phenoxy compound
  • amine
  • tertiary amine
  • organooxygen compound