Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:59 UTC
Update Date2025-03-25 00:58:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230969
Frequency0.5
Structure
Chemical FormulaC30H54N2OS
Molecular Mass490.3957
SMILESCCCCCCCCCCCCCCCCCC(=O)NCCSCc1ccc(CN(C)C)cc1
InChI KeyAFGVBLVMYREKGU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylmethylamines
Direct Parent phenylmethylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amino acids and derivatives
  • aralkylamines
  • benzylamines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • n-acyl amines
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • sulfenyl compounds
  • trialkylamines
  • Substituents
  • fatty acyl
  • carbonyl group
  • amino acid or derivatives
  • fatty amide
  • organosulfur compound
  • carboxylic acid derivative
  • aralkylamine
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • tertiary amine
  • sulfenyl compound
  • dialkylthioether
  • tertiary aliphatic amine
  • carboxamide group
  • n-acyl-amine
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • phenylmethylamine
  • organic oxygen compound
  • benzylamine
  • thioether
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound