Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:55:48 UTC
Update Date2025-03-21 18:04:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00052332
Frequency62.2
Structure
Chemical FormulaC14H18
Molecular Mass186.1409
SMILESCC1=CC(C)(C)c2cc(C)c(C)cc21
InChI KeyWEPXPSCQWLYBMV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindenes and isoindenes
Subclass indenes and isoindenes
Direct Parent indenes and isoindenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • branched unsaturated hydrocarbons
  • cyclic olefins
  • polycyclic hydrocarbons
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • cyclic olefin
  • indene
  • branched unsaturated hydrocarbon
  • unsaturated aliphatic hydrocarbon
  • olefin
  • aromatic homopolycyclic compound
  • polycyclic hydrocarbon
  • hydrocarbon
  • unsaturated hydrocarbon