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CHEBI:193848 - {4-[(1Z)-2-hydroxy-3-oxobut-1-en-1-yl]-2-methoxyphenyl}oxidanesulfonic acid

ChEBI IDCHEBI:193848
ChEBI Name{4-[(1Z)-2-hydroxy-3-oxobut-1-en-1-yl]-2-methoxyphenyl}oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12O7S
Net Charge0
Average Mass288.277
Monoisotopic Mass288.03037
SMILESCOc1cc(/C=C(\O)C(C)=O)ccc1OS(=O)(=O)O
InChIInChI=1S/C11H12O7S/c1-7(12)9(13)5-8-3-4-10(11(6-8)17-2)18-19(14,15)16/h3-6,13H,1-2H3,(H,14,15,16)/b9-5-
InChIKeyLCJPHBCQHYDSBL-UITAMQMPSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
ChEBI Ontology
Outgoing Relation(s)
{4-[(1Z)-2-hydroxy-3-oxobut-1-en-1-yl]-2-methoxyphenyl}oxidanesulfonic acid (CHEBI:193848) is a aryl sulfate (CHEBI:37919)
IUPAC Name 
[4-[(Z)-2-hydroxy-3-oxobut-1-enyl]-2-methoxyphenyl] hydrogen sulate
Manual XrefsDatabases
74853913ChemSpider