Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:19:18 UTC
Update Date2025-03-24 14:16:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00816876
Frequency1.8
Structure
Chemical FormulaC11H12
Molecular Mass144.0939
SMILESC=C=C(C)c1ccc(C)cc1
InChI KeyJOXPBUHITCFBPL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropenes
Direct Parent phenylpropenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • branched unsaturated hydrocarbons
  • cyclic allenes
  • toluenes
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • branched unsaturated hydrocarbon
  • phenylpropene
  • cyclic allene
  • unsaturated aliphatic hydrocarbon
  • toluene
  • hydrocarbon
  • unsaturated hydrocarbon