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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:56 UTC
Update Date2025-03-25 00:46:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157860
Frequency0.5
Structure
Chemical FormulaC10H17NO5S
Molecular Mass263.0827
SMILESO=C(O)CCCC1C2NCCCC2OS1(=O)=O
InChI KeyVHPGDFHPHQIBIV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxathiolanes
Subclass gamma sultones
Direct Parent gamma sultones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • organosulfonic acid esters
  • oxacyclic compounds
  • piperidines
  • short-chain hydroxy acids and derivatives
  • sulfonic acid esters
    • Substituents
  • fatty acyl
  • organosulfonic acid or derivatives
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • amino acid or derivatives
  • amino acid
  • heterocyclic fatty acid
  • fatty acid
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • sulfonic acid ester
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • piperidine
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • organosulfonic acid ester
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • gamma-sultone
  • organooxygen compound
  • amine