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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:21 UTC
Update Date2025-03-25 00:56:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218316
Frequency0.5
Structure
Chemical FormulaC10H13N3O5
Molecular Mass255.0855
SMILESCn1c(=N)ccn(C2OOC3C(O)C(O)C32)c1=O
InChI KeySBBIWVOCZUJAMQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 1,2-dioxolanes
  • azacyclic compounds
  • cyclic alcohols and derivatives
  • dialkyl peroxides
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • ureas
  • Substituents
  • alcohol
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • urea
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • cyclobutanol
  • dialkyl peroxide
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam
  • ortho-dioxolane
  • organooxygen compound
  • 1,2-diol