Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:03:01 UTC
Update Date2025-03-21 18:07:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00069400
Frequency43.5
Structure
Chemical FormulaC14H22O2
Molecular Mass222.162
SMILESCC(C)C(O)c1ccc(O)c(C(C)(C)C)c1
InChI KeyPQDJUYHBTLNTRS-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
  • aromatic alcohols
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • 1-hydroxy-2-unsubstituted benzenoid
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • organooxygen compound