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 IDDMID00135516
Frequency18.5
Structure
Chemical FormulaC9H11N5O3
Molecular Mass237.0862
SMILESNc1nc(=O)c2c([nH]1)=NCC(CCC(=O)O)N=2
InChI KeyZMRZEEINONKIRD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpteridines and derivatives
Subclass pterins and derivatives
Direct Parent pterins and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • vinylogous amides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • pyrimidone
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • vinylogous amide
  • pterin
  • azacycle
  • heteroaromatic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound