Hmdb loader

Showing information for DMID00072134

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:10 UTC
Update Date2025-03-21 18:28:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00072134
Frequency41.5
Structure
Chemical FormulaC22H29N9O7PS+
Molecular Mass594.1643
SMILESCc1ncc(C[n+]2csc(CCOP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(O)C3O)c2C)c(N)n1
InChI KeyDXHMHDXXUFUXRL-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassnucleosides, nucleotides, and analogues
Classpurine nucleotides
Subclass purine ribonucleotides
Direct Parent purine ribonucleoside monophosphates
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • 4,5-disubstituted thiazoles
  • azacyclic compounds
  • dialkyl phosphates
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monosaccharides
  • n-substituted imidazoles
  • organic cations
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • pentose phosphates
  • primary amines
  • purines and purine derivatives
  • secondary alcohols
  • tetrahydrofurans
  • thiamine phosphates
    • Substituents
  • pentose phosphate
  • purine ribonucleoside monophosphate
  • monosaccharide
  • pentose-5-phosphate
  • imidazopyrimidine
  • pyrimidine
  • saccharide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • thiamine
  • organonitrogen compound
  • organopnictogen compound
  • organic cation
  • imidolactam
  • organoheterocyclic compound
  • thiamine-phosphate
  • azole
  • 1,2-diol
  • n-substituted imidazole
  • alcohol
  • azacycle
  • tetrahydrofuran
  • heteroaromatic compound
  • 4,5-disubstituted 1,3-thiazole
  • oxacycle
  • dialkyl phosphate
  • organic oxygen compound
  • phosphoric acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • purine
  • primary amine
  • organic nitrogen compound
  • thiazole
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate
  • organooxygen compound