Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:39 UTC
Update Date2025-03-25 00:51:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186850
Frequency0.5
Structure
Chemical FormulaC13H21N3O2
Molecular Mass251.1634
SMILESNCCCNCCCNC(=O)c1ccccc1O
InChI KeyHMCMIZGDIMGEQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent salicylamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • amino acids and derivatives
  • benzamides
  • benzoyl derivatives
  • carboxylic acids and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • vinylogous acids
  • Substituents
  • amino acid or derivatives
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • benzamide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • secondary aliphatic amine
  • 1-hydroxy-4-unsubstituted benzenoid
  • secondary amine
  • carboxamide group
  • salicylamide
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • vinylogous acid
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • amine