Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:21 UTC
Update Date2025-03-25 00:51:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02190679
Frequency0.5
Structure
Chemical FormulaC14H16
Molecular Mass184.1252
SMILESC=C(C)C=CC=Cc1ccccc1C
InChI KeyISYXBYGDJFLWQJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass toluenes
Direct Parent toluenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • branched unsaturated hydrocarbons
  • cyclic olefins
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • cyclic olefin
  • branched unsaturated hydrocarbon
  • unsaturated aliphatic hydrocarbon
  • olefin
  • toluene
  • hydrocarbon
  • unsaturated hydrocarbon