Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:14:02 UTC
Update Date2025-03-24 16:44:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00947970
Frequency1.5
Structure
Chemical FormulaC9H16
Molecular Mass124.1252
SMILESC=C(CCC)C(C)=CC
InChI KeyCAHATEJRQPUMQL-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
  • alkadienes
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • aliphatic acyclic compound
  • branched unsaturated hydrocarbon
  • alkadiene
  • unsaturated aliphatic hydrocarbon
  • olefin
  • acyclic olefin