Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:01:02 UTC
Update Date2025-03-21 18:06:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00064588
Frequency47.6
Structure
Chemical FormulaC4H6NO4PS
Molecular Mass194.9755
SMILESO=P(O)(O)OCc1cncs1
InChI KeyODEPFQFHZGZJTH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent monoalkyl phosphates
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • thiazoles
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • monoalkyl phosphate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • thiazole
  • organoheterocyclic compound
  • organooxygen compound
  • azole