Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:42 UTC
Update Date2025-03-25 00:49:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177864
Frequency0.5
Structure
Chemical FormulaC11H12O
Molecular Mass160.0888
SMILESc1c2c(cc3c1CCO3)CCC2
InChI KeyYTAKFHJIOYJRQR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanes
Direct Parent indanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • coumarans
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • indane
  • hydrocarbon derivative
  • alkyl aryl ether
  • organoheterocyclic compound
  • coumaran
  • organooxygen compound