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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:26 UTC
Update Date2025-03-25 00:56:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220866
Frequency0.5
Structure
Chemical FormulaC10H10O4
Molecular Mass194.0579
SMILESO=C1CC(c2cccc(O)c2)OC1O
InChI KeyNDNZKOVJJIODRJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • cyclic ketones
  • furanones
  • hemiacetals
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • aromatic heteromonocyclic compound
  • tetrahydrofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • cyclic ketone
  • 1-hydroxy-4-unsubstituted benzenoid
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • hemiacetal
  • hydrocarbon derivative
  • 3-furanone
  • organoheterocyclic compound
  • organooxygen compound