Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:32:58 UTC
Update Date2025-03-24 17:51:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00993584
Frequency1.4
Structure
Chemical FormulaC6H9ClO
Molecular Mass132.0342
SMILESCCC(=O)C=C(C)Cl
InChI KeyULRKFIHJLQUENL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass acryloyl compounds
Direct Parent acryloyl compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • chloroalkenes
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organochlorides
  • vinyl chlorides
  • vinylogous halides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • chloroalkene
  • organochloride
  • alpha,beta-unsaturated ketone
  • organohalogen compound
  • vinylogous halide
  • ketone
  • organic oxide
  • vinyl halide
  • haloalkene
  • hydrocarbon derivative
  • acryloyl-group
  • vinyl chloride
  • enone