Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:03 UTC
Update Date2025-03-25 00:50:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178651
Frequency0.5
Structure
Chemical FormulaC7H9N3O3
Molecular Mass183.0644
SMILESCNc1nc(=O)c(CC(=O)O)c[nH]1
InChI KeySCMYGHUUGJQIPL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary alkylarylamines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • azacycle
  • amino acid or derivatives
  • amino acid
  • heteroaromatic compound
  • pyrimidone
  • secondary amine
  • carboxylic acid derivative
  • secondary aliphatic/aromatic amine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine