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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:07 UTC
Update Date2025-03-25 01:01:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251946
Frequency0.5
Structure
Chemical FormulaC9H13O5P
Molecular Mass232.0501
SMILESO=P(O)(O)OCCOCc1ccccc1
InChI KeyXQYJFUCNMHROQH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzylethers
Direct Parent benzylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
    • Substituents
  • ether
  • benzylether
  • dialkyl ether
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • hydrocarbon derivative
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound