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CHEBI:131664 - S-(1,4-dihydroxynonan-3-yl)-L-cysteine

ChEBI IDCHEBI:131664
ChEBI NameS-(1,4-dihydroxynonan-3-yl)-L-cysteine
Stars
ASCII NameS-(1,4-dihydroxynonan-3-yl)-L-cysteine
DefinitionAn L-cysteine derivative in which the sulfur atom carries a 1,4-dihydroxynonan-3-yl substituent. It has been synthesised by reaction of (E)-4-hydroxynon-2-enal (HNE) with L-cysteine, the sulfur atom of cysteine reacting with the double bond function of HNE via formation of a Michael adduct.
Last Modified6 November 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC12H25NO4S
Net Charge0
Average Mass279.402
Monoisotopic Mass279.15043
SMILESCCCCCC(O)C(CCO)SC[C@H](N)C(=O)O
InChIInChI=1S/C12H25NO4S/c1-2-3-4-5-10(15)11(6-7-14)18-8-9(13)12(16)17/h9-11,14-15H,2-8,13H2,1H3,(H,16,17)/t9-,10?,11?/m0/s1
InChIKeyBJOVPICCZZFNCS-WHXUTIOJSA-N
ChEBI Ontology
Outgoing Relation(s)
S-(1,4-dihydroxynonan-3-yl)-L-cysteine (CHEBI:131664) is a L-cysteine derivative (CHEBI:83824)
IUPAC Name 
S-(1,4-dihydroxynonan-3-yl)-L-cysteine
Synonyms  Source
HNE-modified cysteineChEBI
S-[2-hydroxy-1-(2-hydroxyethyl)heptyl]-L-cysteineChEBI
Citations