Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:39 UTC
Update Date2025-03-21 18:41:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00135523
Frequency18.5
Structure
Chemical FormulaC8H10N4O
Molecular Mass178.0855
SMILESN=C(N)Nc1ccc(C(N)=O)cc1
InChI KeyKILXQBIEMYMRQA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent guanidinobenzoic acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzamides
  • benzoyl derivatives
  • carboximidamides
  • carboxylic acids and derivatives
  • guanidines
  • hydrocarbon derivatives
  • imines
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • guanidine
  • imine
  • benzoyl
  • carboximidamide
  • carboxamide group
  • carboxylic acid derivative
  • benzamide
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • guanidinobenzoic acid or derivatives
  • organic nitrogen compound
  • organooxygen compound