Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:25 UTC
Update Date2025-03-25 00:53:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02199933
Frequency0.5
Structure
Chemical FormulaC15H22
Molecular Mass202.1722
SMILESC=CC(C)Cc1ccc(CC(C)C)cc1
InChI KeyXMBBDXPMQKKUPD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • cyclic olefins
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • cyclic olefin
  • unsaturated aliphatic hydrocarbon
  • olefin
  • hydrocarbon
  • unsaturated hydrocarbon