Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:39:21 UTC
Update Date2025-03-21 21:54:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00436712
Frequency4.1
Structure
Chemical FormulaC4H7ClO3
Molecular Mass138.0084
SMILESO=C(O)C(CO)CCl
InChI KeySRRJLMYFEROIFY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl chlorides
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organochlorides
  • primary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alkyl chloride
  • organochloride
  • carboxylic acid derivative
  • organohalogen compound
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound