Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:04:05 UTC
Update Date2025-03-24 14:10:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00780291
Frequency1.9
Structure
Chemical FormulaC5H9NO2
Molecular Mass115.0633
SMILESCN1COCCC1=O
InChI KeyKWPNFXFPBKCJCM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxazinanes
Subclass 1,3-oxazinanes
Direct Parent 1,3-oxazinanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • tertiary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • azacycle
  • 1,3-oxazinane
  • carboxamide group
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound