Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:25 UTC
Update Date2025-03-25 00:59:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236546
Frequency0.5
Structure
Chemical FormulaC14H20O3
Molecular Mass236.1412
SMILESOc1cc(O)cc(CCC2CCC(O)CC2)c1
InChI KeyKESKQXWGAIIDSO-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
  • benzene and substituted derivatives
  • cyclic alcohols and derivatives
  • cyclohexanols
  • hydrocarbon derivatives
  • Substituents
  • alcohol
  • monocyclic benzene moiety
  • cyclohexanol
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • cyclic alcohol
  • resorcinol
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound