Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:54:53 UTC
Update Date2025-03-21 20:07:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00331080
Frequency5.8
Structure
Chemical FormulaC8H8O
Molecular Mass120.0575
SMILESc1cc2ccc1CCO2
InChI KeySQRKKSUHCGKKQS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent alkyl aryl ethers
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • benzenoids
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • benzenoid
  • alkyl aryl ether
  • organoheterocyclic compound