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CHEBI:38722 - aurothiomalic acid

ChEBI IDCHEBI:38722
ChEBI Nameaurothiomalic acid
Stars
DefinitionA sulfur-containing carboxylic acid that is thiomalic acid in which the sulfur atom is linked to a gold atom.
Last Modified5 October 2012
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC4H5AuO4S
Net Charge0
Average Mass346.114
Monoisotopic Mass345.95742
SMILESO=C(O)CC([S][Au])C(=O)O
InChIInChI=1S/C4H6O4S.Au/c5-3(6)1-2(9)4(7)8;/h2,9H,1H2,(H,5,6)(H,7,8);/q;+1/p-1
InChIKeyXJHSMFDIQHVMCY-UHFFFAOYSA-M
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
aurothiomalic acid (CHEBI:38722) has functional parent thiomalic acid (CHEBI:38705)
aurothiomalic acid (CHEBI:38722) is a gold coordination entity (CHEBI:33971)
aurothiomalic acid (CHEBI:38722) is a sulfur-containing carboxylic acid (CHEBI:33576)
aurothiomalic acid (CHEBI:38722) is conjugate acid of aurothiomalate(2−) (CHEBI:68613)
Incoming Relation(s)
(S)-aurothiomalic acid (CHEBI:38727) is a aurothiomalic acid (CHEBI:38722)
aurothiomalate(2−) (CHEBI:68613) is conjugate base of aurothiomalic acid (CHEBI:38722)
IUPAC Names 
gold(1+) 1,2-dicarboxyethanethiolate
1,2-dicarboxyethanethiolatogold(I)
1,2-dicarboxyethylsulfanylgold
Synonyms  Source
aurothiomalateChemIDplus
mercaptobutanedioic acid, monogold(1+) saltChemIDplus
(1,2-dicarboxyethylthio)goldChEBI
Registry NumbersSources
Beilstein:4030297Beilstein
Gmelin:1288314Gmelin
Gmelin:1043252Gmelin
CAS:4846-27-9ChemIDplus