Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:56 UTC
Update Date2025-03-25 01:01:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251555
Frequency0.5
Structure
Chemical FormulaC11H16O3
Molecular Mass196.1099
SMILESOCCCOc1ccc(CCO)cc1
InChI KeyXTLGVNIUSZHBTO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass tyrosols and derivatives
Direct Parent tyrosols and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkyl aryl ethers
  • hydrocarbon derivatives
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • hydrocarbon derivative
  • tyrosol derivative
  • phenoxy compound
  • organooxygen compound