Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:10:33 UTC
Update Date2025-03-21 18:31:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00087362
Frequency32.6
Structure
Chemical FormulaC9H12N3O7P
Molecular Mass305.0413
SMILESNc1ccn(C2C(O)OC3COP(=O)(O)OC32)c(=O)n1
InChI KeyILOURGFVHUFVIX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hemiacetals
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organic carbonic acids and derivatives
  • organic oxides
  • organic phosphoric acids and derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • tetrahydrofurans
  • Substituents
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • pyrimidone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • organic phosphoric acid derivative
  • amine
  • organooxygen compound