Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:02 UTC
Update Date2025-03-25 00:57:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222263
Frequency0.5
Structure
Chemical FormulaC10H15NO
Molecular Mass165.1154
SMILESOCCCNCc1ccccc1
InChI KeyZQJXSIOFSZYGMH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • secondary amine
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine