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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:20 UTC
Update Date2025-03-21 17:57:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00006903
Frequency741.0
Structure
Chemical FormulaC12H20
Molecular Mass164.1565
SMILESC=C(C)C(C=C(C)C)C=C(C)C
InChI KeyIFNAXEDNCRTEKI-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
  • alkatrienes
  • unsaturated aliphatic hydrocarbons
    • Substituents
  • aliphatic acyclic compound
  • branched unsaturated hydrocarbon
  • alkatriene
  • unsaturated aliphatic hydrocarbon
  • olefin
  • acyclic olefin