Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:47:44 UTC
Update Date2025-03-21 18:01:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00033107
Frequency109.8
Structure
Chemical FormulaC11H16
Molecular Mass148.1252
SMILESCCC(C)c1ccccc1C
InChI KeyAMBAWAHKHZZAAY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • saturated hydrocarbons
  • toluenes
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • saturated hydrocarbon
  • toluene
  • hydrocarbon