Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:37 UTC
Update Date2025-03-25 00:51:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189026
Frequency0.5
Structure
Chemical FormulaC16H22
Molecular Mass214.1722
SMILESCC(C)CC1=CC(C)(C)Cc2ccccc21
InChI KeyMVIXZZUBAAPQHY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • branched unsaturated hydrocarbons
  • cyclic olefins
  • polycyclic hydrocarbons
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • cyclic olefin
  • naphthalene
  • branched unsaturated hydrocarbon
  • unsaturated aliphatic hydrocarbon
  • olefin
  • aromatic homopolycyclic compound
  • polycyclic hydrocarbon
  • hydrocarbon
  • unsaturated hydrocarbon