Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:42 UTC
Update Date2025-03-21 18:01:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00035417
Frequency105.9
Structure
Chemical FormulaC9H12N2O5
Molecular Mass228.0746
SMILESO=c1ncc(C2OC(CO)C(O)C2O)c[nH]1
InChI KeyAKWKAAFZXAQGAN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkyl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • ether
  • carbonic acid derivative
  • aromatic heteromonocyclic compound
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • monosaccharide
  • pyrimidone
  • dialkyl ether
  • oxacycle
  • saccharide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound