Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:54:14 UTC
Update Date2025-03-21 22:01:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00471602
Frequency3.7
Structure
Chemical FormulaC9H10
Molecular Mass118.0782
SMILESCC1=CC2=C(C)C1C=C2
InChI KeyKPGQKBVUKCCJMY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasshydrocarbons
Classpolycyclic hydrocarbons
Subclass polycyclic hydrocarbons
Direct Parent polycyclic hydrocarbons
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • branched unsaturated hydrocarbons
  • cyclic olefins
  • unsaturated aliphatic hydrocarbons
  • Substituents
  • cyclic olefin
  • branched unsaturated hydrocarbon
  • unsaturated aliphatic hydrocarbon
  • olefin
  • polycyclic hydrocarbon
  • unsaturated hydrocarbon
  • aliphatic homopolycyclic compound