Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:30 UTC
Update Date2025-03-25 00:49:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02172740
Frequency0.5
Structure
Chemical FormulaC13H22
Molecular Mass178.1722
SMILESCCCC(C)C1=C(C)C=CC(C)C1
InChI KeySMECIRTYLNZFSV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent monocyclic monoterpenoids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • branched unsaturated hydrocarbons
  • cyclic olefins
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • cyclic olefin
  • monocyclic monoterpenoid
  • branched unsaturated hydrocarbon
  • aliphatic homomonocyclic compound
  • unsaturated aliphatic hydrocarbon
  • olefin
  • hydrocarbon
  • unsaturated hydrocarbon