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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:47 UTC
Update Date2025-03-25 00:51:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02187164
Frequency0.5
Structure
Chemical FormulaC12H21NO4
Molecular Mass243.1471
SMILESCC(C)(C)OC(=O)N1CCC2(CC1)OCCO2
InChI KeyIRDYCXRTVGCLGY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazaspirodecane derivatives
Subclass azaspirodecane derivatives
Direct Parent azaspirodecane derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • azacyclic compounds
  • carbamate esters
  • carbonyl compounds
  • hydrocarbon derivatives
  • ketals
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • piperidinecarboxylic acids
  • piperidines
  • Substituents
  • meta-dioxolane
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • carbamic acid ester
  • azaspirodecane
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • acetal
  • ketal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • piperidinecarboxylic acid
  • organic nitrogen compound
  • piperidine
  • organooxygen compound