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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:36:24 UTC
Update Date2025-03-21 17:57:19 UTC
HMDB IDHMDB0003536
Metabolite Identification
DeepMet IDDMID00007066
NamedIDP
Frequency1006.6
Structure
Chemical FormulaC10H14N4O10P2
Molecular Mass412.0185
SMILESO=c1[nH]cnc2c1ncn2C1CC(O)C(COP(=O)(O)OP(=O)(O)O)O1
InChI KeyBKUSIKGSPSFQAC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpurine nucleotides
Subclass purine deoxyribonucleotides
Direct Parent purine 2'-deoxyribonucleoside diphosphates
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hypoxanthines
  • imidazoles
  • lactams
  • monoalkyl phosphates
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organic pyrophosphates
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pentose phosphates
  • purines and purine derivatives
  • pyrimidones
  • secondary alcohols
  • tetrahydrofurans
  • vinylogous amides
    • Substituents
  • lactam
  • pentose phosphate
  • monosaccharide
  • pyrimidone
  • imidazopyrimidine
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole
  • alcohol
  • vinylogous amide
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • purine 2'-deoxyribonucleoside diphosphate
  • organic pyrophosphate
  • oxacycle
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hypoxanthine
  • hydrocarbon derivative
  • purine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound