Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:50 UTC
Update Date2025-03-25 00:56:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02217110
Frequency0.5
Structure
Chemical FormulaC8H11O5P
Molecular Mass218.0344
SMILESCC(O)c1cccc(OP(=O)(O)O)c1
InChI KeyPBVWTCTXXHWPNE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent phenyl phosphates
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • hydrocarbon derivatives
  • organic oxides
  • phenoxy compounds
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • phenyl phosphate
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound