Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:33:53 UTC
Update Date2025-03-21 19:57:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00282784
Frequency7.1
Structure
Chemical FormulaC3H2Cl2O2
Molecular Mass139.9432
SMILESO=C(O)C(Cl)=CCl
InChI KeyYQYHCJZVJNOGBP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass alpha-halocarboxylic acids and derivatives
Direct Parent alpha-halocarboxylic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • chloroalkenes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organochlorides
  • vinyl chlorides
  • vinylogous halides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • chloroalkene
  • organochloride
  • alpha-halocarboxylic acid
  • organohalogen compound
  • vinylogous halide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • vinyl halide
  • haloalkene
  • hydrocarbon derivative
  • vinyl chloride
  • organooxygen compound