Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:34:46 UTC
Update Date2025-03-24 20:48:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01574181
Frequency0.8
Structure
Chemical FormulaC5H5ClO2
Molecular Mass131.9978
SMILESO=C1C=CC(CCl)O1
InChI KeyBVTGEACBMCNXFC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass furanones
Direct Parent butenolides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl chlorides
  • carbonyl compounds
  • dihydrofurans
  • enoate esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • organochlorides
  • oxacyclic compounds
  • Substituents
  • enoate ester
  • carbonyl group
  • alkyl chloride
  • organochloride
  • carboxylic acid derivative
  • organohalogen compound
  • lactone
  • oxacycle
  • alpha,beta-unsaturated carboxylic ester
  • 2-furanone
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound