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CHEBI:187203 - [2,6-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]oxidanesulfonic acid

ChEBI IDCHEBI:187203
ChEBI Name[2,6-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14O6S
Net Charge0
Average Mass274.294
Monoisotopic Mass274.05111
SMILESCC(C)=CCc1ccc(O)c(OS(=O)(=O)O)c1O
InChIInChI=1S/C11H14O6S/c1-7(2)3-4-8-5-6-9(12)11(10(8)13)17-18(14,15)16/h3,5-6,12-13H,4H2,1-2H3,(H,14,15,16)
InChIKeyRBZKBMOJNNEECT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
[2,6-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]oxidanesulfonic acid (CHEBI:187203) is a aryl sulfate (CHEBI:37919)
IUPAC Name 
[2,6-dihydroxy-3-(3-methylbut-2-enyl)phenyl] hydrogen sulate
Manual XrefsDatabases
74853244ChemSpider
HMDB0133259HMDB