Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:50 UTC
Update Date2025-03-25 00:49:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02175829
Frequency0.5
Structure
Chemical FormulaC13H24
Molecular Mass180.1878
SMILESCC1=C(C(C)C)C(CC(C)C)CC1
InChI KeyHIBGRZIHCMJKCP-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