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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:50 UTC
Update Date2025-03-25 01:01:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251342
Frequency0.5
Structure
Chemical FormulaC14H10O3S
Molecular Mass258.0351
SMILESOc1ccc(-c2sc3cc(O)ccc3c2O)cc1
InChI KeyHOWHTANBQYBSIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzothiophenes
Subclass 1-benzothiophenes
Direct Parent 1-benzothiophenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • thiophenes
    • Substituents
  • monocyclic benzene moiety
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • thiophene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • 1-benzothiophene
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound