Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:50 UTC
Update Date2025-03-25 00:53:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02200905
Frequency0.5
Structure
Chemical FormulaC13H18N2O
Molecular Mass218.1419
SMILESCOc1ccc2c(c1)C1C(C2)N(C)CN1C
InChI KeyPPOTWWIBBWRMDY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanes
Direct Parent indanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • aminals
  • anisoles
  • azacyclic compounds
  • hydrocarbon derivatives
  • imidazolidines
  • organopnictogen compounds
  • Substituents
  • imidazolidine
  • phenol ether
  • ether
  • azacycle
  • aminal
  • alkyl aryl ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • indane
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound