Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:46 UTC
Update Date2025-03-25 00:52:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02193817
Frequency0.5
Structure
Chemical FormulaC8H12N2O3PS2+
Molecular Mass279.0021
SMILESCCOP(=S)(S)Oc1ccc([N+](N)=O)cc1
InChI KeyGDNGNXFRUVEQDV-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylhydrazines
Direct Parent phenylhydrazines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic oxoazanium compounds
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • phosphorodithioic acid o,o-diesters
  • Substituents
  • dithiophosphate o-ester
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic oxoazanium
  • phenoxy compound
  • phenylhydrazine
  • phosphorodithioic acid o,o-diester
  • organic dithiophosphate
  • organooxygen compound