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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:10 UTC
Update Date2025-03-21 18:36:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00113143
Frequency23.4
Structure
Chemical FormulaC9H12ClN3O3
Molecular Mass245.0567
SMILESNc1ccn(C2CC(O)C(CCl)O2)c(=O)n1
InChI KeyRKDKYGYVMNVJQR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Class2',5'-dideoxyribonucleosides
Subclass 2',5'-dideoxyribonucleosides
Direct Parent 2',5'-dideoxyribonucleosides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl chlorides
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organochlorides
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • aromatic heteromonocyclic compound
  • alkyl chloride
  • organochloride
  • 2',5'-dideoxyribonucleoside
  • monosaccharide
  • pyrimidone
  • organohalogen compound
  • pyrimidine
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • imidolactam
  • organoheterocyclic compound
  • alcohol
  • carbonic acid derivative
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound