Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:55:46 UTC
Update Date2025-03-21 18:04:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00052257
Frequency62.3
Structure
Chemical FormulaC13H18O
Molecular Mass190.1358
SMILESOC(c1ccccc1)C1CCCCC1
InChI KeyQDYKZBKCLHBUHU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound