Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:52:52 UTC
Update Date2025-03-24 22:24:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01184935
Frequency1.1
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESCC1CCC(O)(CN)O1
InChI KeyKCZFAFXKMFHBCN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hemiacetals
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • tetrahydrofuran
  • oxacycle
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hemiacetal
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound