Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:23 UTC
Update Date2025-03-21 18:42:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00137213
Frequency18.2
Structure
Chemical FormulaC14H22
Molecular Mass190.1722
SMILESCc1ccc(C(C)C)cc1C(C)(C)C
InChI KeyPBUGHBAPXVLIDZ-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
  • cumenes
  • monocyclic monoterpenoids
  • phenylpropanes
  • saturated hydrocarbons
  • toluenes
  • Substituents
  • saturated hydrocarbon
  • monocyclic benzene moiety
  • monocyclic monoterpenoid
  • p-cymene
  • hydrocarbon
  • phenylpropane
  • aromatic homomonocyclic compound
  • cumene
  • benzenoid
  • toluene
  • aromatic monoterpenoid