Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:24 UTC
Update Date2025-03-21 17:59:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00020664
Frequency195.3
Structure
Chemical FormulaC12H24
Molecular Mass168.1878
SMILESCC(=CC(C)C)CCCC(C)C
InChI KeyJVORASKOPYYKKM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasshydrocarbons
Classunsaturated hydrocarbons
Subclass branched unsaturated hydrocarbons
Direct Parent branched unsaturated hydrocarbons
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkenes
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • aliphatic acyclic compound
  • branched unsaturated hydrocarbon
  • alkene
  • unsaturated aliphatic hydrocarbon
  • olefin
  • acyclic olefin