Hmdb loader
Record Information
HMDB Statuspredicted
Creation Date2024-02-20 23:35:15 UTC
Update Date2025-03-21 17:56:55 UTC
HMDB IDHMDB0125105
Metabolite Identification
DeepMet IDDMID00004422
Name1-ethyl-3-methoxybenzene
Frequency1270.2
Structure
Chemical FormulaC9H12O
Molecular Mass136.0888
SMILESCCc1cccc(OC)c1
InChI KeyDWLZULQNIPIABE-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