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CHEBI:193243 - [4-(5,7-dihydroxy-4-oxo-4H-chromen-3-yl)phenyl]oxidanesulfonic acid

ChEBI IDCHEBI:193243
ChEBI Name[4-(5,7-dihydroxy-4-oxo-4H-chromen-3-yl)phenyl]oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H10O8S
Net Charge0
Average Mass350.304
Monoisotopic Mass350.00964
SMILESO=c1c(-c2ccc(OS(=O)(=O)O)cc2)coc2cc(O)cc(O)c12
InChIInChI=1S/C15H10O8S/c16-9-5-12(17)14-13(6-9)22-7-11(15(14)18)8-1-3-10(4-2-8)23-24(19,20)21/h1-7,16-17H,(H,19,20,21)
InChIKeyKIWWRRLFZKBEAL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
[4-(5,7-dihydroxy-4-oxo-4H-chromen-3-yl)phenyl]oxidanesulfonic acid (CHEBI:193243) is a isoflavones (CHEBI:38757)
IUPAC Name 
[4-(5,7-dihydroxy-4-oxochromen-3-yl)phenyl] hydrogen sulate
Manual XrefsDatabases
58811468ChemSpider