Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:40 UTC
Update Date2025-03-25 00:48:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168561
Frequency0.5
Structure
Chemical FormulaC16H22
Molecular Mass214.1722
SMILESCC(C)=CC=CCc1c(C)ccc(C)c1C
InChI KeyZNBTZBUTHQVEIT-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
  • branched unsaturated hydrocarbons
  • cyclic olefins
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • cyclic olefin
  • branched unsaturated hydrocarbon
  • unsaturated aliphatic hydrocarbon
  • olefin
  • hydrocarbon
  • unsaturated hydrocarbon