Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:59 UTC
Update Date2025-03-25 00:56:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02217488
Frequency0.5
Structure
Chemical FormulaC15H22O3
Molecular Mass250.1569
SMILESOc1ccc(CC(O)CC2CCC(O)CC2)cc1
InChI KeyLBMAFWSPMFUTTJ-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
  • benzene and substituted derivatives
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • Substituents
  • monocyclic benzene moiety
  • cyclohexanol
  • 1-hydroxy-2-unsubstituted benzenoid
  • cyclic alcohol
  • aromatic homomonocyclic compound
  • phenol
  • hydrocarbon derivative
  • benzenoid