Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:56:18 UTC
Update Date2025-03-21 18:04:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00053437
Frequency60.5
Structure
Chemical FormulaC12H16
Molecular Mass160.1252
SMILESCC(C)(C)C=Cc1ccccc1
InChI KeyDXIJHCSGLOHNES-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • cyclic olefins
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • cyclic olefin
  • unsaturated aliphatic hydrocarbon
  • olefin
  • hydrocarbon
  • unsaturated hydrocarbon