Hmdb loader

Showing information for DMID02458269

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:51:15 UTC
Update Date2025-03-25 01:36:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02458269
Frequency0.5
Structure
Chemical FormulaC6H11NO2
Molecular Mass129.079
SMILESCCC1C(O)=NCC1O
InChI KeyHKRBKRBWPGUDPT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic carboximidic acids
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • azacycle
  • 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
  • cyclic carboximidic acid
  • organooxygen compound