Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:38:28 UTC
Update Date2025-03-21 18:47:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00153668
Frequency15.7
Structure
Chemical FormulaC5H7ClO
Molecular Mass118.0185
SMILESCC(=O)C=C(C)Cl
InChI KeyWLEFTWHIDSWPNV-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