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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:33 UTC
Update Date2025-03-21 18:37:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00114104
Frequency23.2
Structure
Chemical FormulaC12H16N5O6P
Molecular Mass357.0838
SMILESCCOP1(=O)OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O1
InChI KeyTXRXEHHGCBJORG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpurine nucleotides
Subclass cyclic purine nucleotides
Direct Parent 3',5'-cyclic purine nucleotides
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • pentose phosphates
  • phosphate esters
  • primary amines
  • purines and purine derivatives
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • pentose phosphate
  • monosaccharide
  • imidazopyrimidine
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • 3',5'-cyclic purine ribonucleotide
  • oxacycle
  • organic oxygen compound
  • phosphoric acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • purine
  • primary amine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • amine
  • organooxygen compound