Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:47:57 UTC
Update Date2025-03-21 18:50:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00176352
Frequency13.2
Structure
Chemical FormulaC5H9NO
Molecular Mass99.0684
SMILESCC1=NC(C)CO1
InChI KeyBEQDKWKSUMQVMX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass oxazolines
Direct Parent oxazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • imidoesters
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • imido ester
  • propargyl-type 1,3-dipolar organic compound
  • oxacycle
  • oxazoline
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound