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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:57 UTC
Update Date2025-03-21 18:35:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105337
Frequency25.6
Structure
Chemical FormulaC8H13Cl2NO4
Molecular Mass257.0222
SMILESCC(=O)NC1(CCl)OC(CCl)C(O)C1O
InChI KeyXEEOYKYCNPSYFJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • acetamides
  • alkyl chlorides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
    • Substituents
  • carbonyl group
  • alkyl chloride
  • organochloride
  • monosaccharide
  • carboxylic acid derivative
  • organohalogen compound
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • organoheterocyclic compound
  • acetamide
  • 1,2-diol
  • alcohol
  • tetrahydrofuran
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound