Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:29 UTC
Update Date2025-03-25 00:53:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02200092
Frequency0.5
Structure
Chemical FormulaC7H7ClN4O2
Molecular Mass214.0258
SMILESN=C(Nc1ccc(Cl)cc1)N[N+](=O)[O-]
InChI KeyFKORGJFCAMBSIT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent chlorobenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • hydrocarbon derivatives
  • imines
  • nitramines
  • nitroguanidines
  • organic oxides
  • organic oxoanionic compounds
  • organochlorides
  • organopnictogen compounds
  • Substituents
  • aryl chloride
  • chlorobenzene
  • guanidine
  • imine
  • organochloride
  • nitroguanidine
  • allyl-type 1,3-dipolar organic compound
  • organic 1,3-dipolar compound
  • organohalogen compound
  • organic nitro compound
  • aryl halide
  • aromatic homomonocyclic compound
  • organic oxide
  • nitramine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic hyponitrite