Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:52:20 UTC
Update Date2025-03-21 22:59:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00609759
Frequency2.6
Structure
Chemical FormulaC8H16NO+
Molecular Mass142.1226
SMILESC[N+]1(C)CCCCCC1=O
InChI KeyJOBCXKSEONYOOO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactams
Subclass caprolactams
Direct Parent caprolactams
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • azepanes
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • caprolactam
  • carbonyl group
  • azacycle
  • carboxylic acid derivative
  • organic oxide
  • azepane
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound