Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:13:37 UTC
Update Date2025-03-24 22:40:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01236658
Frequency1.1
Structure
Chemical FormulaC6H9NO
Molecular Mass111.0684
SMILESCN1C2C=CC1OC2
InChI KeyBBHURHBDQIPTFP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyrans
Direct Parent pyrans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxazolidines
  • pyrrolines
  • Substituents
  • azacycle
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • pyrroline
  • oxazolidine
  • pyran
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound