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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:30 UTC
Update Date2025-03-25 00:53:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02200135
Frequency0.5
Structure
Chemical FormulaC6H10N3O4P
Molecular Mass219.0409
SMILESCc1ncc(C(O)P(=O)(O)O)c(N)n1
InChI KeyBRURQURKMNCLAP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidines and pyrimidine derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organic oxides
  • organic phosphonic acids and derivatives
  • organooxygen compounds
  • organophosphorus compounds
  • organopnictogen compounds
  • primary amines
  • Substituents
  • aromatic alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • organophosphorus compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organophosphonic acid derivative
  • organooxygen compound