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diethyl 2-sulfanylbutanedioate

CHEBI:CHEBI_195233

Definition

A diester resulting from the formal condensation of the carboxy groups of thiomalic acid with ethanol. It is a metabolite of the insecticide malathion.

Chemical Information

Molecular Formula
C8H14O4S
Molecular Mass
206.260
Charge
0
SMILES
CCOC(=O)CC(S)C(=O)OCC
InChI
InChI=1S/C8H14O4S/c1-3-11-7(9)5-6(13)8(10)12-4-2/h6,13H,3-5H2,1-2H3
InChIKey
KLXFSKITMRWDPM-UHFFFAOYSA-N

Alternative Names

  • 1,4-diethyl 2-sulfanylbutanedioate
  • 2-mercaptosuccinic acid diethyl ester
  • diethyl 2-mercaptobutanedioate
  • diethyl 2-mercaptosuccinate
  • diethyl 2-sulfanylbutanedioate
  • diethyl mercaptosuccinate
  • FEMA 4972
  • mercaptosuccinic acid diethyl ester

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

oboInOwl#hasDbXref
Reaxys:1779749
core#notation
CHEBI:195233

Additional References

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Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
oboInOwl#hasDbXref
Reaxys:1779749
oboInOwl#id
CHEBI:195233
core#notation
CHEBI:195233
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_76976
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
chebi#has_functional_parent
http://purl.obolibrary.org/obo/CHEBI_141474
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
owl#someValuesFrom
t107891
owl#annotatedSource
t145164