Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:49 UTC
Update Date2025-03-25 01:01:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02248951
Frequency0.5
Structure
Chemical FormulaC12H12O3
Molecular Mass204.0786
SMILESCOc1ccc(-c2ccoc2)cc1OC
InChI KeyXSHPYEMVHXXRKE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass methoxybenzenes
Direct Parent dimethoxybenzenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • oxacyclic compounds
  • phenoxy compounds
  • Substituents
  • furan
  • phenol ether
  • ether
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • alkyl aryl ether
  • dimethoxybenzene
  • oxacycle
  • organic oxygen compound
  • anisole
  • o-dimethoxybenzene
  • hydrocarbon derivative
  • phenoxy compound
  • organoheterocyclic compound
  • organooxygen compound