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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:16 UTC
Update Date2025-03-25 00:54:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204161
Frequency0.5
Structure
Chemical FormulaC15H15O5+
Molecular Mass275.0914
SMILESOc1ccc(-c2cc(O)c3c([o+]2)CC(O)C(O)C3)cc1
InChI KeyOHLFZQNTMAESNM-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-diols
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic cations
  • oxacyclic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • monocyclic benzene moiety
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic cation
  • organoheterocyclic compound
  • organooxygen compound
  • 1,2-diol