Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-21 09:18:06 UTC
Update Date2025-03-24 20:15:43 UTC
HMDB IDHMDB0060458
Metabolite Identification
DeepMet IDDMID01390389
Namecis-3-Chloroallyl aldehyde
Frequency0.9
Structure
Chemical FormulaC3H3ClO
Molecular Mass89.9872
SMILESO=CC=CCl
InChI KeyZSOPPQGHWJVKJB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classvinyl halides
Subclass vinylogous halides
Direct Parent vinylogous halides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • chloroalkenes
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • vinyl chlorides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • chloroalkene
  • organochloride
  • aldehyde
  • vinylogous halide
  • organic oxide
  • organic oxygen compound
  • haloalkene
  • hydrocarbon derivative
  • vinyl chloride
  • organooxygen compound