Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:43 UTC
Update Date2025-03-25 00:46:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152797
Frequency0.5
Structure
Chemical FormulaC13H20N4O
Molecular Mass248.1637
SMILESN=C(NCCCCN)NC(=O)Cc1ccccc1
InChI KeyMSLMUKXPTSWOBF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids and derivatives
  • guanidines
  • hydrocarbon derivatives
  • imines
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • guanidine
  • imine
  • carboximidamide
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • phenylacetamide
  • organooxygen compound