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CHEBI:176346 - [3-(3-hydroxy-4-oxo-4H-chromen-2-yl)phenyl]oxidanesulfonic acid

ChEBI IDCHEBI:176346
ChEBI Name[3-(3-hydroxy-4-oxo-4H-chromen-2-yl)phenyl]oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H10O7S
Net Charge0
Average Mass334.305
Monoisotopic Mass334.01472
SMILESO=c1c(O)c(-c2cccc(OS(=O)(=O)O)c2)oc2ccccc12
InChIInChI=1S/C15H10O7S/c16-13-11-6-1-2-7-12(11)21-15(14(13)17)9-4-3-5-10(8-9)22-23(18,19)20/h1-8,17H,(H,18,19,20)
InChIKeySRJFCVIKXJYSFT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) blood plasma (BTO:0000131) MetaboLights (MTBLS2782) Strain: ICR Mouse [NCIT:C37408]
ChEBI Ontology
Outgoing Relation(s)
[3-(3-hydroxy-4-oxo-4H-chromen-2-yl)phenyl]oxidanesulfonic acid (CHEBI:176346) is a hydroxyflavan (CHEBI:72010)
IUPAC Name 
[3-(3-hydroxy-4-oxochromen-2-yl)phenyl] hydrogen sulate
Manual XrefsDatabases
74853606ChemSpider
HMDB0134560HMDB