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CHEBI:136813 - 11-sulfojasmonate

ChEBI IDCHEBI:136813
ChEBI Name11-sulfojasmonate
Stars
DefinitionA 5-oxo monocarboxylic acid anion obtained by deprotonation of the carboxy and sulfate groups of 11-sulfojasmonic acid. Major species at pH 7.3
Last Modified5 July 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC12H16O7S
Net Charge-2
Average Mass304.320
Monoisotopic Mass304.06277
SMILESCC(/C=C\CC1C(=O)CCC1CC(=O)[O-])OS(=O)(=O)[O-]
InChIInChI=1S/C12H18O7S/c1-8(19-20(16,17)18)3-2-4-10-9(7-12(14)15)5-6-11(10)13/h2-3,8-10H,4-7H2,1H3,(H,14,15)(H,16,17,18)/p-2/b3-2-
InChIKeyXOANNBHPTKIFSM-IHWYPQMZSA-L
ChEBI Ontology
Outgoing Relation(s)
11-sulfojasmonate (CHEBI:136813) is a 5-oxo monocarboxylic acid anion (CHEBI:35975)
11-sulfojasmonate (CHEBI:136813) is a organosulfate oxoanion (CHEBI:58958)
UniProt Name  Source
an 11-sulfojasmonateUniProt
Manual XrefsDatabases
CPD-11256MetaCyc
Citations