Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:19:16 UTC
Update Date2025-03-24 20:00:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01104056
Frequency1.2
Structure
Chemical FormulaC8H10O2
Molecular Mass138.0681
SMILESCc1cc2c(o1)CCCO2
InChI KeyQXJSZQFXQLWMQJ-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
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • furan
  • oxacycle
  • aromatic heteropolycyclic compound
  • heteroaromatic compound
  • hydrocarbon derivative
  • alkyl aryl ether
  • organoheterocyclic compound