Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:51:24 UTC
Update Date2025-03-21 18:03:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00041859
Frequency81.9
Structure
Chemical FormulaC16H26
Molecular Mass218.2035
SMILESCC(C)Cc1cc(C(C)C)cc(C(C)C)c1
InChI KeyVPCIIOZOKLUSQQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cumenes
Direct Parent cumenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • phenylpropanes
  • saturated hydrocarbons
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • saturated hydrocarbon
  • cumene
  • hydrocarbon