Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:14 UTC
Update Date2025-03-25 00:45:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151660
Frequency0.5
Structure
Chemical FormulaC8H11N5O2
Molecular Mass209.0913
SMILESN=C(N)N1CCn2cc(C(=O)O)nc2C1
InChI KeyBXAYAEMUNFFKBB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent carbonylimidazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • guanidines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imines
  • monocarboxylic acids and derivatives
  • n-substituted imidazoles
  • organic oxides
  • organopnictogen compounds
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • carboxylic acid
  • azacycle
  • guanidine
  • imine
  • heteroaromatic compound
  • carboximidamide
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • imidazole-4-carbonyl group
  • organic nitrogen compound
  • organooxygen compound
  • n-substituted imidazole