Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:58 UTC
Update Date2025-03-21 18:28:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00074085
Frequency40.1
Structure
Chemical FormulaC11H16
Molecular Mass148.1252
SMILESCCCc1cc(C)ccc1C
InChI KeyPWEDYOIWLPZSRP-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
  • p-xylenes
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • xylene
  • saturated hydrocarbon
  • p-xylene
  • hydrocarbon