Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:11 UTC
Update Date2025-03-21 18:38:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120406
Frequency21.6
Structure
Chemical FormulaC11H16O2
Molecular Mass180.115
SMILESCC(C)C(CO)c1cccc(O)c1
InChI KeyITBAIHYGKNPTPZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • hydrocarbon derivatives
  • primary alcohols
  • Substituents
  • alcohol
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound