Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:05 UTC
Update Date2025-03-21 18:38:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120171
Frequency21.6
Structure
Chemical FormulaC12H18O
Molecular Mass178.1358
SMILESCC(C)C(CO)Cc1ccccc1
InChI KeyMOMVXPYYGZAHRC-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
  • primary alcohols
  • Substituents
  • alcohol
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxygen compound
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound