Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:26:53 UTC
Update Date2025-03-21 22:18:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00549007
Frequency3.0
Structure
Chemical FormulaC7H13NO
Molecular Mass127.0997
SMILESCC(O)CC1=NCCC1
InChI KeyLTMJNCYNDWEKIY-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
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • ketimine
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • pyrroline
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound