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CHEBI:486417 - S-(2-acetamidoethyl) (2S,3R)-3-hydroxy-2-methylpentanethioate

ChEBI IDCHEBI:486417
ChEBI NameS-(2-acetamidoethyl) (2S,3R)-3-hydroxy-2-methylpentanethioate
Stars
ASCII NameS-(2-acetamidoethyl) (2S,3R)-3-hydroxy-2-methylpentanethioate
DefinitionA thioester formed by condensation of (2S,3R)-3-hydroxy-2-methylpentanoic acid with N-(2-sulfanylethyl)acetamide.
Last Modified20 July 2010
DownloadsMolfile
FormulaC10H19NO3S
Net Charge0
Average Mass233.333
Monoisotopic Mass233.10856
SMILESCC[C@@H](O)[C@H](C)C(=O)SCCNC(C)=O
InChIInChI=1S/C10H19NO3S/c1-4-9(13)7(2)10(14)15-6-5-11-8(3)12/h7,9,13H,4-6H2,1-3H3,(H,11,12)/t7-,9+/m0/s1
InChIKeyOFOFOJMLEBUWJQ-IONNQARKSA-N
ChEBI Ontology
Outgoing Relation(s)
S-(2-acetamidoethyl) (2S,3R)-3-hydroxy-2-methylpentanethioate (CHEBI:486417) is a diketide (CHEBI:55385)
S-(2-acetamidoethyl) (2S,3R)-3-hydroxy-2-methylpentanethioate (CHEBI:486417) is a thioester (CHEBI:51277)
IUPAC Name 
S-(2-acetamidoethyl) (2S,3R)-3-hydroxy-2-methylpentanethioate
Synonym  Source
(2S,3R)-S-2-acetamidoethyl 3-hydroxy-2-methylpentanethioateChEMBL