Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:07:46 UTC
Update Date2025-03-25 01:43:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02497075
Frequency0.5
Structure
Chemical FormulaC6H7ClO
Molecular Mass130.0185
SMILESCc1cc(Cl)c(C)o1
InChI KeyVHLSSURDDYLLAV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classaryl halides
Subclass aryl chlorides
Direct Parent aryl chlorides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organochlorides
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • aryl chloride
  • furan
  • aromatic heteromonocyclic compound
  • organochloride
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound