Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:28 UTC
Update Date2025-03-21 18:28:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00072863
Frequency41.0
Structure
Chemical FormulaC10H13Cl2O4P
Molecular Mass297.9929
SMILESCCOP(=O)(OCC)Oc1ccc(Cl)cc1Cl
InChI KeyTVZVEGZSJDAAKQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent aryl dialkyl phosphates
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl chlorides
  • dialkyl phosphates
  • dichlorobenzenes
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • organooxygen compounds
  • phenoxy compounds
  • Substituents
  • aryl chloride
  • chlorobenzene
  • monocyclic benzene moiety
  • organochloride
  • organohalogen compound
  • aryl halide
  • 1,3-dichlorobenzene
  • aromatic homomonocyclic compound
  • dialkyl phosphate
  • organic oxide
  • aryl dialkyl phosphate
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • halobenzene
  • phenoxy compound
  • organooxygen compound