Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:52:40 UTC
Update Date2025-03-24 14:37:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00896776
Frequency1.6
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCOc1ccc(CCO)o1
InChI KeyYSSJTKROBBZKQS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent alkyl aryl ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • alcohol
  • furan
  • oxacycle
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • hydrocarbon derivative
  • alkyl aryl ether
  • organoheterocyclic compound