Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:44:51 UTC
Update Date2025-03-24 14:02:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00734305
Frequency2.1
Structure
Chemical FormulaC3H4Cl2O2
Molecular Mass141.9588
SMILESCC(=O)OC(Cl)Cl
InChI KeyVCLHGSKRBKVKAS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organochlorides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound