Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:08:39 UTC
Update Date2025-03-21 18:30:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00082954
Frequency34.7
Structure
Chemical FormulaC13H16
Molecular Mass172.1252
SMILESCC1=CCCc2c(C)cc(C)cc21
InChI KeyHQJFIGBRLMXLMU-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