Hmdb loader

Showing information for DMID00129699

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:06 UTC
Update Date2025-03-21 18:40:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129699
Frequency19.6
Structure
Chemical FormulaC15H24N4O6PS+
Molecular Mass419.1149
SMILESCc1ncc(C[n+]2csc(CCOP(=O)(O)OCC(O)CO)c2C)c(N)n1
InChI KeyUZTPCAGLXVATOA-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent thiamine phosphates
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • 4,5-disubstituted thiazoles
  • azacyclic compounds
  • dialkyl phosphates
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organic cations
  • organic oxides
  • organopnictogen compounds
  • primary alcohols
  • primary amines
  • secondary alcohols
    • Substituents
  • aromatic heteromonocyclic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • organic cation
  • primary alcohol
  • imidolactam
  • thiamine-phosphate
  • azole
  • 1,2-diol
  • alcohol
  • azacycle
  • heteroaromatic compound
  • 4,5-disubstituted 1,3-thiazole
  • dialkyl phosphate
  • organic oxygen compound
  • phosphoric acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • thiazole
  • organic phosphoric acid derivative
  • amine
  • alkyl phosphate
  • organooxygen compound