Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:58 UTC
Update Date2025-03-21 18:39:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00126967
Frequency20.1
Structure
Chemical FormulaC10H16N4O3
Molecular Mass240.1222
SMILESCC(O)C(O)C1CNc2c(c(=O)ncn2C)N1
InChI KeyJNSGFLDEWMBMLG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • secondary alkylarylamines
  • vinylogous amides
  • Substituents
  • alcohol
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • secondary amine
  • secondary aliphatic/aromatic amine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound
  • 1,2-diol