Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:00 UTC
Update Date2025-03-21 17:57:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00006128
Frequency851.5
Structure
Chemical FormulaC11H16
Molecular Mass148.1252
SMILESCc1ccc(C)c(C(C)C)c1
InChI KeyCLSBTDGUHSQYTO-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
  • p-xylenes
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • xylene
  • saturated hydrocarbon
  • p-xylene
  • cumene
  • hydrocarbon