Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:46 UTC
Update Date2025-03-25 01:01:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02246611
Frequency0.5
Structure
Chemical FormulaC12H18O
Molecular Mass178.1358
SMILESCCC(Cc1ccccc1)C(C)O
InChI KeyVQIIOVRPLODBPE-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
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • alcohol
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound