Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:35 UTC
Update Date2025-03-25 00:57:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02225676
Frequency0.5
Structure
Chemical FormulaC15H15IO2
Molecular Mass354.0117
SMILESCC(C)(c1ccc(O)cc1)c1ccc(O)cc1I
InChI KeyBOXZRIPQDYFZPG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent bisphenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl iodides
  • halophenols
  • hydrocarbon derivatives
  • iodobenzenes
  • m-iodophenols
  • organoiodides
  • organooxygen compounds
  • phenylpropanes
  • Substituents
  • 3-halophenol
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • iodobenzene
  • organoiodide
  • aryl halide
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • aryl iodide
  • halobenzene
  • 3-iodophenol
  • bisphenol
  • organooxygen compound