Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:07:41 UTC
Update Date2025-03-25 01:43:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02496913
Frequency0.5
Structure
Chemical FormulaC5H3ClO2
Molecular Mass129.9822
SMILESO=C1C=CC(O)=C1Cl
InChI KeyTVEUMIBXYYZCIC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous acids
Subclass vinylogous acids
Direct Parent vinylogous acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alpha-chloroketones
  • chloroalkenes
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • vinyl chlorides
  • Substituents
  • carbonyl group
  • chloroalkene
  • organochloride
  • cyclic ketone
  • organohalogen compound
  • alpha-chloroketone
  • ketone
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • vinyl halide
  • haloalkene
  • aliphatic homomonocyclic compound
  • alpha-haloketone
  • hydrocarbon derivative
  • vinyl chloride
  • organooxygen compound