Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:59 UTC
Update Date2025-03-25 00:51:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185284
Frequency0.5
Structure
Chemical FormulaC12H20N2O
Molecular Mass208.1576
SMILESNC(=O)C1=CN(C2CCCCC2)CCC1
InChI KeyNXDORFXNHYCUSK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass cyclohexylamines
Direct Parent cyclohexylamines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • enamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • primary carboxylic acid amides
  • tetrahydropyridines
  • trialkylamines
  • vinylogous amides
  • Substituents
  • primary carboxylic acid amide
  • vinylogous amide
  • carbonyl group
  • azacycle
  • amino acid or derivatives
  • tertiary aliphatic amine
  • tetrahydropyridine
  • cyclohexylamine
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound
  • enamine