EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:125583 - (2R)-2-amino-3-[[5-(2-hydroperoxyethyl)-2,3-dihydroxyphenyl]thio]propanoic acid

ChEBI IDCHEBI:125583
ChEBI Name(2R)-2-amino-3-[[5-(2-hydroperoxyethyl)-2,3-dihydroxyphenyl]thio]propanoic acid
Stars
DownloadsMolfile
FormulaC11H15NO6S
Net Charge0
Average Mass289.309
Monoisotopic Mass289.06201
SMILESN[C@@H](CSc1cc(CCOO)cc(O)c1O)C(=O)O
InChIInChI=1S/C11H15NO6S/c12-7(11(15)16)5-19-9-4-6(1-2-18-17)3-8(13)10(9)14/h3-4,7,13-14,17H,1-2,5,12H2,(H,15,16)/t7-/m0/s1
InChIKeyWTBCXMYMTQGUPP-ZETCQYMHSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R)-2-amino-3-[[5-(2-hydroperoxyethyl)-2,3-dihydroxyphenyl]thio]propanoic acid (CHEBI:125583) is a S-conjugate (CHEBI:64987)
Manual XrefsDatabases
LSM-37124LINCS