Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:00 UTC
Update Date2025-03-25 00:49:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171583
Frequency0.5
Structure
Chemical FormulaC10H12N6O2
Molecular Mass248.1022
SMILESCN1C(=O)CCC1c1nc2c(=O)[nH]c(N)nc2[nH]1
InChI KeyFIBYNOMWDYBBBB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent hypoxanthines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • purines and purine derivatives
  • pyrimidones
  • pyrrolidine-2-ones
  • tertiary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • amino acid or derivatives
  • pyrimidone
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • pyrrolidone
  • azole
  • vinylogous amide
  • azacycle
  • n-alkylpyrrolidine
  • heteroaromatic compound
  • carboxamide group
  • organic oxygen compound
  • hypoxanthine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound