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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:27 UTC
Update Date2025-03-25 00:51:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02188654
Frequency0.5
Structure
Chemical FormulaC8H11N4O6PS
Molecular Mass322.0137
SMILESCC(OP(=O)(O)O)C(O)c1nc2c(=O)nc(N)[nH]c2s1
InChI KeyXQRWVLFFBSBUSE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Class1,3-thiazolo[5,4-d]pyrimidines
Subclass 7-oxo-1,3-thiazolo[5,4-d]pyrimidines
Direct Parent 7-oxo-1,3-thiazolo[5,4-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • secondary alcohols
  • thiazoles
  • vinylogous amides
  • Substituents
  • aromatic alcohol
  • 7-oxo-1,3-thiazolo[5,4-d]pyrimidine
  • pyrimidone
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • azole
  • alcohol
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • thiazole
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate
  • organooxygen compound