Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:11 UTC
Update Date2025-03-25 00:56:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02215638
Frequency0.5
Structure
Chemical FormulaC16H24
Molecular Mass216.1878
SMILESCCC=CCCCCCc1ccccc1C
InChI KeyXRGFPSZMKFMAKA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass toluenes
Direct Parent toluenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • cyclic olefins
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • cyclic olefin
  • unsaturated aliphatic hydrocarbon
  • olefin
  • toluene
  • hydrocarbon
  • unsaturated hydrocarbon