Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:46 UTC
Update Date2025-03-21 18:33:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00097507
Frequency28.3
Structure
Chemical FormulaC13H18
Molecular Mass174.1409
SMILESC=C(C)Cc1ccc(C(C)C)cc1
InChI KeyCXCGFLDIFMWUEB-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
  • branched unsaturated hydrocarbons
  • cumenes
  • cyclic olefins
  • monocyclic monoterpenoids
  • phenylpropanes
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • monocyclic benzene moiety
  • cyclic olefin
  • monocyclic monoterpenoid
  • olefin
  • p-cymene
  • hydrocarbon
  • unsaturated hydrocarbon
  • phenylpropane
  • aromatic homomonocyclic compound
  • branched unsaturated hydrocarbon
  • unsaturated aliphatic hydrocarbon
  • cumene
  • benzenoid
  • aromatic monoterpenoid