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CHEBI:188418 - [4-(3-hydroxybutyl)-2-methoxyphenyl]oxidanesulfonic acid

ChEBI IDCHEBI:188418
ChEBI Name[4-(3-hydroxybutyl)-2-methoxyphenyl]oxidanesulfonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O6S
Net Charge0
Average Mass276.310
Monoisotopic Mass276.06676
SMILESCOc1cc(CCC(C)O)ccc1OS(=O)(=O)O
InChIInChI=1S/C11H16O6S/c1-8(12)3-4-9-5-6-10(11(7-9)16-2)17-18(13,14)15/h5-8,12H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyCKMMXVYVYMKBBD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) blood serum (BTO:0000133) MetaboLights (MTBLS3886)
ChEBI Ontology
Outgoing Relation(s)
[4-(3-hydroxybutyl)-2-methoxyphenyl]oxidanesulfonic acid (CHEBI:188418) is a aryl sulfate (CHEBI:37919)
IUPAC Name 
[4-(3-hydroxybutyl)-2-methoxyphenyl] hydrogen sulate
Manual XrefsDatabases
HMDB0135717HMDB
74853929ChemSpider