Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:32:41 UTC
Update Date2025-03-25 01:05:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02276046
Frequency0.5
Structure
Chemical FormulaC7H11NO
Molecular Mass125.0841
SMILESCC(O)=CC1=NCCC1
InChI KeyQJWITLVXXDEDNM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • ketimines
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • ketimine
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • pyrroline
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound