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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:26:59 UTC
Update Date2025-03-25 00:17:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01269253
Frequency1.0
Structure
Chemical FormulaC6H9NO3
Molecular Mass143.0582
SMILESCC(=O)N1CCCOC1=O
InChI KeyXNQQPFRBCLWNGQ-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
  • acetamides
  • azacyclic compounds
  • carbamate esters
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dicarboximides
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • 1,3-oxazinane
  • carbamic acid ester
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • acetamide
  • organooxygen compound