Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:03 UTC
Update Date2025-03-25 00:54:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02208254
Frequency0.5
Structure
Chemical FormulaC16H26N2O
Molecular Mass262.2045
SMILESCC(CCCN(C)N=O)c1ccc(C(C)(C)C)cc1
InChI KeySVFSPFUNBJRECX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylbutylamines
Direct Parent phenylbutylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic monoterpenoids
  • hydrocarbon derivatives
  • monocyclic monoterpenoids
  • organic n-nitroso compounds
  • organic oxides
  • organopnictogen compounds
  • phenylpropanes
  • Substituents
  • monoterpenoid
  • organic nitroso compound
  • monocyclic monoterpenoid
  • p-cymene
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic n-nitroso compound
  • organic oxide
  • phenylbutylamine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • aromatic monoterpenoid