Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:28 UTC
Update Date2025-03-25 00:55:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02211646
Frequency0.5
Structure
Chemical FormulaC14H22N2O
Molecular Mass234.1732
SMILESCC(=O)NCCCN(C)c1c(C)cccc1C
InChI KeyPVUUCDOCDDQXGI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass xylenes
Direct Parent m-xylenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • acetamides
  • amino acids and derivatives
  • aniline and substituted anilines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylarylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • amino acid or derivatives
  • aniline or substituted anilines
  • m-xylene
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • dialkylarylamine
  • amine
  • tertiary amine
  • acetamide
  • organooxygen compound