Hmdb loader

Showing information for DMID01594764

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:43:40 UTC
Update Date2025-03-24 20:52:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01594764
Frequency0.8
Structure
Chemical FormulaC24H31F3N9O17P3S
Molecular Mass899.0724
SMILESCn1c(SCCC(F)(F)F)nc2c(ncn2C2OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)C(O)C2O)c1=O
InChI KeyJJXJLCHTKYHLEV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpurine nucleotides
Subclass purine ribonucleotides
Direct Parent purine ribonucleoside triphosphates
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl fluorides
  • alkylarylthioethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hypoxanthines
  • imidazoles
  • imidolactams
  • lactams
  • monoalkyl phosphates
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organofluorides
  • organopnictogen compounds
  • oxacyclic compounds
  • pentose phosphates
  • primary amines
  • purine ribonucleoside monophosphates
  • purines and purine derivatives
  • pyrimidones
  • secondary alcohols
  • sulfenyl compounds
  • tetrahydrofurans
  • vinylogous amides
    • Substituents
  • lactam
  • pentose phosphate
  • purine ribonucleoside monophosphate
  • monosaccharide
  • pentose-5-phosphate
  • pyrimidone
  • imidazopyrimidine
  • alkylarylthioether
  • organosulfur compound
  • organohalogen compound
  • aryl thioether
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • imidolactam
  • purine ribonucleoside triphosphate
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole
  • alcohol
  • vinylogous amide
  • sulfenyl compound
  • azacycle
  • tetrahydrofuran
  • alkyl fluoride
  • organofluoride
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • phosphoric acid ester
  • thioether
  • monoalkyl phosphate
  • secondary alcohol
  • hypoxanthine
  • hydrocarbon derivative
  • purine
  • primary amine
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate
  • organooxygen compound