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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:27 UTC
Update Date2025-03-25 00:54:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204572
Frequency0.5
Structure
Chemical FormulaC10H13O4P
Molecular Mass228.0551
SMILESO=P(O)(O)OC1CCCc2ccccc21
InChI KeyCVQJUDJKXMCPBD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
  • organooxygen compounds
    • Substituents
  • tetralin
  • organic oxide
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • aromatic homopolycyclic compound
  • hydrocarbon derivative
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound