Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:14 UTC
Update Date2025-03-21 18:38:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120531
Frequency21.6
Structure
Chemical FormulaC13H10Cl2N2O2
Molecular Mass296.0119
SMILESNC(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)cc1
InChI KeyYSEYZNJONYWFQL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent diphenylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • carbonyl compounds
  • diarylethers
  • dichlorobenzenes
  • hydrocarbon derivatives
  • n-phenylureas
  • organic carbonic acids and derivatives
  • organic oxides
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • diaryl ether
  • phenol ether
  • carbonyl group
  • ether
  • organochloride
  • organohalogen compound
  • 1,3-dichlorobenzene
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • aryl chloride
  • chlorobenzene
  • carbonic acid derivative
  • aryl halide
  • aromatic homomonocyclic compound
  • n-phenylurea
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene
  • phenoxy compound
  • diphenylether
  • organooxygen compound