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CHEBI:58795 - 1-hydroxy-5-(methylthio)-3-oxopent-1-en-2-olate

ChEBI IDCHEBI:58795
ChEBI Name1-hydroxy-5-(methylthio)-3-oxopent-1-en-2-olate
Stars
DefinitionConjugate base of 1,2-dihydroxy-5-(methylthio)pent-1-en-3-one arising from deprotonation of the 2-hydroxy group.
Last Modified22 March 2014
DownloadsMolfile
FormulaC6H9O3S
Net Charge-1
Average Mass161.202
Monoisotopic Mass161.02779
SMILESCSCCC(=O)/C([O-])=C/O
InChIInChI=1S/C6H10O3S/c1-10-3-2-5(8)6(9)4-7/h4,7,9H,2-3H2,1H3/p-1/b6-4-
InChIKeyCILXJJLQPTUUSS-XQRVVYSFSA-M
ChEBI Ontology
Outgoing Relation(s)
1-hydroxy-5-(methylthio)-3-oxopent-1-en-2-olate (CHEBI:58795) is a organic anion (CHEBI:25696)
1-hydroxy-5-(methylthio)-3-oxopent-1-en-2-olate (CHEBI:58795) is conjugate base of 1,2-dihydroxy-5-(methylthio)pent-1-en-3-one (CHEBI:49252)
Incoming Relation(s)
1,2-dihydroxy-5-(methylthio)pent-1-en-3-one (CHEBI:49252) is conjugate acid of 1-hydroxy-5-(methylthio)-3-oxopent-1-en-2-olate (CHEBI:58795)
IUPAC Name 
1-hydroxy-5-(methylsulfanyl)-3-oxopent-1-en-2-olate