Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:13 UTC
Update Date2025-03-21 18:39:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00125151
Frequency20.5
Structure
Chemical FormulaC3H4N2O4S
Molecular Mass163.9892
SMILESO=S(=O)(O)Oc1cn[nH]c1
InChI KeyIIMJSLMFRDCXSM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass arylsulfates
Direct Parent arylsulfates
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrazoles
  • sulfuric acid monoesters
  • Substituents
  • sulfuric acid monoester
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrazole
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • sulfate-ester
  • hydrocarbon derivative
  • arylsulfate
  • organic nitrogen compound
  • sulfuric acid ester
  • organoheterocyclic compound
  • organooxygen compound
  • azole