Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:36 UTC
Update Date2025-03-25 00:54:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02207172
Frequency0.5
Structure
Chemical FormulaC3H5N5O4S
Molecular Mass207.0062
SMILESNc1nc(O)nc(NS(=O)(=O)O)n1
InChI KeyJSHMJNCOLBOXKH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass aminotriazines
Direct Parent aminotriazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • sulfuric acid monoamides
  • Substituents
  • amino-1,3,5-triazine
  • organic sulfuric acid or derivatives
  • aromatic heteromonocyclic compound
  • azacycle
  • aminotriazine
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • halo-s-triazine
  • organonitrogen compound
  • sulfuric acid monoamide
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,3,5-triazine
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound