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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:56 UTC
Update Date2025-03-25 00:47:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162276
Frequency0.5
Structure
Chemical FormulaC11H15NO3
Molecular Mass209.1052
SMILESC=CC1(C=C)CN2CCC1C(C(=O)O)O2
InChI KeyXJBHNCQYJIHVQG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxazinanes
Subclass 1,2-oxazinanes
Direct Parent 1,2-oxazinanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-organohydroxylamines
  • organic oxides
  • organopnictogen compounds
  • oxacyclic compounds
  • piperidines
  • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • 1,2-oxazinane
  • carboxylic acid derivative
  • n-organohydroxylamine
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • organooxygen compound