Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:05 UTC
Update Date2025-03-25 00:52:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196797
Frequency0.5
Structure
Chemical FormulaC19H24
Molecular Mass252.1878
SMILESCCC=CCC1=C(C)CCC1=Cc1ccc(C)cc1
InChI KeyMZSJJARJQZRFDG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass toluenes
Direct Parent toluenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • branched unsaturated hydrocarbons
  • cycloalkenes
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • cyclic olefin
  • branched unsaturated hydrocarbon
  • cycloalkene
  • unsaturated aliphatic hydrocarbon
  • olefin
  • toluene
  • hydrocarbon
  • unsaturated hydrocarbon