Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:03:40 UTC
Update Date2025-03-21 18:28:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00070945
Frequency80.8
Structure
Chemical FormulaC7H11N5O
Molecular Mass181.0964
SMILESCN1CCNc2nc(N)[nH]c(=O)c21
InChI KeyGDLDQUVIANWRPK-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
  • azacyclic compounds
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • secondary alkylarylamines
  • vinylogous amides
  • Substituents
  • lactam
  • pyrimidone
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • imidolactam
  • tertiary amine
  • vinylogous amide
  • pterin
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound