Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:32:52 UTC
Update Date2025-03-24 17:51:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00993360
Frequency1.4
Structure
Chemical FormulaC8H15NO
Molecular Mass141.1154
SMILESCC1(C)CCCCC(O)=N1
InChI KeyYKCXFNSULUOZCS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepines
Subclass azepines
Direct Parent azepines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic carboximidic acids
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • azepine
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • cyclic carboximidic acid
  • organooxygen compound