Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:55 UTC
Update Date2025-03-25 00:50:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178351
Frequency0.5
Structure
Chemical FormulaC9H11ClO
Molecular Mass170.0498
SMILESClCCCOc1ccccc1
InChI KeyAZXLOLRTEJEZHJ-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
  • alkyl chlorides
  • hydrocarbon derivatives
  • organochlorides
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • alkyl chloride
  • organochloride
  • alkyl aryl ether
  • organohalogen compound
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound