Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:16 UTC
Update Date2025-03-25 01:01:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02252294
Frequency0.5
Structure
Chemical FormulaC9H15N3O3
Molecular Mass213.1113
SMILESNCc1cnn(C2CC(O)C(CO)O2)c1
InChI KeyWCYGRLZMJBUNJF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • pyrazoles
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • monosaccharide
  • pyrazole
  • oxacycle
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • primary alcohol
  • organoheterocyclic compound
  • azole