Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:16 UTC
Update Date2025-03-21 18:05:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00058077
Frequency54.5
Structure
Chemical FormulaC13H18O2
Molecular Mass206.1307
SMILESOc1cccc(CC2CCC(O)CC2)c1
InChI KeyDQZIJSLEWKPICC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
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
  • hydrocarbon derivatives
  • Substituents
  • monocyclic benzene moiety
  • cyclohexanol
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • cyclic alcohol
  • aromatic homomonocyclic compound
  • phenol
  • hydrocarbon derivative
  • benzenoid