Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:51:41 UTC
Update Date2025-03-21 18:03:10 UTC
HMDB IDHMDB0302512
Metabolite Identification
DeepMet IDDMID00042558
NameEthyl guaiacol
Frequency80.2
Structure
Chemical FormulaC9H12O2
Molecular Mass152.0837
SMILESCCOc1ccccc1OC
InChI KeyOMONCKYJLBVWOQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • hydrocarbon derivatives
  • methoxybenzenes
  • phenoxy compounds
  • Substituents
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound