Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:55 UTC
Update Date2025-03-21 18:41:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00133903
Frequency18.8
Structure
Chemical FormulaC13H16O
Molecular Mass188.1201
SMILESC=CC(=O)Cc1ccc(C(C)C)cc1
InChI KeyMPRUINLXKGIENA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent aromatic monoterpenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • acryloyl compounds
  • cumenes
  • enones
  • hydrocarbon derivatives
  • ketones
  • monocyclic monoterpenoids
  • organic oxides
  • phenylpropanes
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • monocyclic monoterpenoid
  • p-cymene
  • alpha,beta-unsaturated ketone
  • ketone
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • cumene
  • hydrocarbon derivative
  • benzenoid
  • acryloyl-group
  • organooxygen compound
  • aromatic monoterpenoid
  • enone