Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:32 UTC
Update Date2025-03-25 00:50:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02181999
Frequency0.5
Structure
Chemical FormulaC3H4Br2O3
Molecular Mass245.8527
SMILESO=C(O)C(O)(Br)CBr
InChI KeyCZXFSIXFRWBACB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass alpha hydroxy acids and derivatives
Direct Parent alpha hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkyl bromides
  • alpha-halocarboxylic acids
  • bromohydrins
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organobromides
  • Substituents
  • alcohol
  • alpha-halocarboxylic acid or derivatives
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • halohydrin
  • alpha-hydroxy acid
  • alpha-halocarboxylic acid
  • carboxylic acid derivative
  • organohalogen compound
  • alkyl bromide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • bromohydrin
  • organobromide
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound