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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:45 UTC
Update Date2025-03-25 00:51:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02184723
Frequency0.5
Structure
Chemical FormulaC29H35Cl2N11O
Molecular Mass623.2403
SMILESN=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1)NC(=N)Nc1ccc(Cl)cc1
InChI KeyJUEINDRJCCXBKZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent benzanilides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-arylbiguanides
  • aryl chlorides
  • benzamides
  • benzoyl derivatives
  • carboximidamides
  • carboxylic acids and derivatives
  • chlorobenzenes
  • guanidinobenzoic acids and derivatives
  • hydrocarbon derivatives
  • imines
  • organic oxides
  • organochlorides
  • organooxygen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • benzanilide
  • guanidine
  • imine
  • organochloride
  • benzoyl
  • carboxylic acid derivative
  • organohalogen compound
  • benzamide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • 1-arylbiguanide
  • aryl chloride
  • chlorobenzene
  • benzoic acid or derivatives
  • carboximidamide
  • carboxamide group
  • aryl halide
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • arylbiguanide
  • organic oxygen compound
  • hydrocarbon derivative
  • guanidinobenzoic acid or derivatives
  • organic nitrogen compound
  • biguanide
  • halobenzene
  • organooxygen compound