Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:57 UTC
Update Date2025-03-25 00:52:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194234
Frequency0.5
Structure
Chemical FormulaC7H12N6O2
Molecular Mass212.1022
SMILESCN(C)c1nc(=O)c(NC(N)=O)c(N)[nH]1
InChI KeyXSPQDPKAXKXBGK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent dialkylarylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aminopyrimidines and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • pyrimidine
  • aminopyrimidine
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • dialkylarylamine
  • organoheterocyclic compound
  • organooxygen compound