Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:10 UTC
Update Date2025-03-21 18:37:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00115614
Frequency22.8
Structure
Chemical FormulaC11H13N5O4
Molecular Mass279.0968
SMILESNc1ncnc2c1ncn2C1OC2C(O)C(CO)OC21
InChI KeyJCWNZVXXQBXRLP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent purines and purine derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,4-dioxepanes
  • azacyclic compounds
  • dialkyl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monosaccharides
  • n-substituted imidazoles
  • organopnictogen compounds
  • oxacyclic compounds
  • oxetanes
  • primary alcohols
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • ether
  • monosaccharide
  • dialkyl ether
  • pyrimidine
  • saccharide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • primary alcohol
  • imidolactam
  • azole
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • 1,4-dioxepane
  • heteroaromatic compound
  • dioxepane
  • oxacycle
  • organic oxygen compound
  • oxetane
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • purine
  • organic nitrogen compound
  • amine
  • organooxygen compound