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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:24 UTC
Update Date2025-03-21 18:32:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00091734
Frequency30.6
Structure
Chemical FormulaC7H6O5
Molecular Mass170.0215
SMILESO=C(O)Oc1c(O)cccc1O
InChI KeyJAPFWXFJJPJNKH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass benzenediols
Direct Parent resorcinols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • carbonic acid monoesters
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • phenoxy compounds
    • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carbonic acid derivative
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • resorcinol
  • aromatic homomonocyclic compound
  • organic oxide
  • carbonic acid monoester
  • organic oxygen compound
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound