Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:43 UTC
Update Date2025-03-25 00:50:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180159
Frequency0.5
Structure
Chemical FormulaC11H17O5P
Molecular Mass260.0814
SMILESCc1cc(O)c(C(C)(C)C)cc1OP(=O)(O)O
InChI KeyJUVLKKVPAPZUAZ-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
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • meta cresols
  • organic oxides
  • organooxygen compounds
  • phenoxy compounds
  • phenylpropanes
  • toluenes
  • Substituents
  • monocyclic benzene moiety
  • m-cresol
  • 1-hydroxy-2-unsubstituted benzenoid
  • phenyl phosphate
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • toluene
  • organooxygen compound