Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:44 UTC
Update Date2025-03-21 18:31:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00085507
Frequency33.4
Structure
Chemical FormulaC13H20O
Molecular Mass192.1514
SMILESCCC(C)C(C)(C)c1ccc(O)cc1
InChI KeyRLWQHAIXLMFQPL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • Substituents
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • phenol
  • hydrocarbon derivative
  • organooxygen compound