Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:04 UTC
Update Date2025-03-25 00:48:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169435
Frequency0.5
Structure
Chemical FormulaC22H30N2O
Molecular Mass338.2358
SMILESCCCCCCc1ccc(NCC(=O)Nc2c(C)cccc2C)cc1
InChI KeyXIPWAOHURMYAQC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha amino acids
  • anilides
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • phenylalkylamines
  • secondary alkylarylamines
  • secondary carboxylic acid amides
  • m-xylenes
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • n-arylamide
  • xylene
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alpha-amino acid amide
  • m-xylene
  • secondary amine
  • carboxamide group
  • secondary aliphatic/aromatic amine
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • organic oxygen compound
  • phenylalkylamine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound