Hmdb loader

Showing information for DMID02248537

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:38 UTC
Update Date2025-03-25 01:01:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02248537
Frequency0.5
Structure
Chemical FormulaC7H7ClN2O
Molecular Mass170.0247
SMILESN=CNc1ccc(O)c(Cl)c1
InChI KeyIHGMDGIIWZPAMT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass halophenols
Direct Parent halophenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl chlorides
  • chlorobenzenes
  • formamidines
  • hydrocarbon derivatives
  • imines
  • o-chlorophenols
  • organochlorides
  • organooxygen compounds
  • organopnictogen compounds
    • Substituents
  • aryl chloride
  • 2-chlorophenol
  • chlorobenzene
  • monocyclic benzene moiety
  • imine
  • organochloride
  • 1-hydroxy-2-unsubstituted benzenoid
  • amidine
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • 2-halophenol
  • formamidine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • organooxygen compound