Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:20 UTC
Update Date2025-03-25 00:55:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213723
Frequency0.5
Structure
Chemical FormulaC15H20N2O
Molecular Mass244.1576
SMILESCNC1(O)CCC(c2c[nH]c3ccccc23)CC1
InChI KeyNJRYXVPZGCFSFF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • cyclic alcohols and derivatives
  • cyclohexanols
  • dialkylamines
  • hemiaminals
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • secondary aliphatic amine
  • azacycle
  • indole
  • heteroaromatic compound
  • cyclohexanol
  • cyclic alcohol
  • secondary amine
  • hemiaminal
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • amine
  • alkanolamine