Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:45 UTC
Update Date2025-03-21 18:33:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00097453
Frequency28.3
Structure
Chemical FormulaC13H20
Molecular Mass176.1565
SMILESCCC(C)C(C)(C)c1ccccc1
InChI KeyDKBSYWNXGSWHQV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • saturated hydrocarbons
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • saturated hydrocarbon
  • hydrocarbon