Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:19 UTC
Update Date2025-03-25 00:48:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167778
Frequency0.5
Structure
Chemical FormulaC18H21NO3
Molecular Mass299.1521
SMILESCC(C)NCC(O)COc1cccc2c1oc1ccccc12
InChI KeyKDHNVUICDHIIGE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzofurans
Subclass dibenzofurans
Direct Parent dibenzofurans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • dialkylamines
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • phenol ethers
  • secondary alcohols
  • Substituents
  • alcohol
  • furan
  • phenol ether
  • secondary aliphatic amine
  • ether
  • dibenzofuran
  • heteroaromatic compound
  • alkyl aryl ether
  • secondary amine
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • amine