Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:10 UTC
Update Date2025-03-21 18:33:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00095999
Frequency28.8
Structure
Chemical FormulaC13H20
Molecular Mass176.1565
SMILESCCCCCc1ccccc1CC
InChI KeyPENKITWMTIONPT-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
  • saturated hydrocarbons
  • Substituents
  • aromatic homomonocyclic compound
  • saturated hydrocarbon
  • monocyclic benzene moiety
  • hydrocarbon