Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:32 UTC
Update Date2025-03-25 00:51:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02184227
Frequency0.5
Structure
Chemical FormulaC9H14N3O7PS
Molecular Mass339.029
SMILESNC(=S)c1cn(C2OC(COP(=O)(O)O)C(O)C2O)cn1
InChI KeyPNBUZUGZMWBOHK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent pentose phosphates
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • carbonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazole ribonucleosides and ribonucleotides
  • imidazoles
  • monoalkyl phosphates
  • monosaccharides
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • thioamides
  • thiocarbonyl compounds
  • thiocarboxylic acid amides
  • Substituents
  • imidazole ribonucleoside
  • carbonyl group
  • aromatic heteromonocyclic compound
  • pentose phosphate
  • thiocarbonyl group
  • pentose-5-phosphate
  • organosulfur compound
  • organic oxide
  • thioamide
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • azole
  • 1,2-diol
  • n-substituted imidazole
  • alcohol
  • azacycle
  • thiocarboxylic acid amide
  • tetrahydrofuran
  • heteroaromatic compound
  • oxacycle
  • phosphoric acid ester
  • monoalkyl phosphate
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate