Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:36 UTC
Update Date2025-03-25 00:53:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198025
Frequency0.5
Structure
Chemical FormulaC12H20
Molecular Mass164.1565
SMILESCCC1=C(C)CCC1C=C(C)C
InChI KeyVVIXKPODMXEFDR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent iridoids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • branched unsaturated hydrocarbons
  • cycloalkenes
  • monocyclic monoterpenoids
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • cyclic olefin
  • monocyclic monoterpenoid
  • branched unsaturated hydrocarbon
  • cycloalkene
  • aliphatic homomonocyclic compound
  • unsaturated aliphatic hydrocarbon
  • olefin
  • 11-noriridane monoterpenoid
  • hydrocarbon
  • unsaturated hydrocarbon