Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:03 UTC
Update Date2025-03-25 01:00:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02244884
Frequency0.5
Structure
Chemical FormulaC14H21N3O
Molecular Mass247.1685
SMILESCN(C)CC(O)CNCc1c[nH]c2ccccc12
InChI KeyQUKZTDNTOVMZLP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • azacyclic compounds
  • benzenoids
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrroles
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • 1,2-aminoalcohol
  • indole
  • heteroaromatic compound
  • tertiary aliphatic amine
  • secondary amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound