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CHEBI:144643 - indoxyl sulfate(1−)

ChEBI IDCHEBI:144643
ChEBI Nameindoxyl sulfate(1−)
Stars
ASCII Nameindoxyl sulfate(1-)
DefinitionAn aryl sulfate oxoanion that is the conjugate base of indoxyl sulfate, obtained by deprotonation of the sulfo group; major species at pH 7.3.
Last Modified12 September 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC8H6NO4S
Net Charge-1
Average Mass212.206
Monoisotopic Mass212.00230
SMILESO=S(=O)([O-])Oc1cnc2ccccc12
InChIInChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)/p-1
InChIKeyBXFFHSIDQOFMLE-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
indoxyl sulfate(1−) (CHEBI:144643) is a aryl sulfate oxoanion (CHEBI:139371)
indoxyl sulfate(1−) (CHEBI:144643) is conjugate base of indoxyl sulfate (CHEBI:43355)
Incoming Relation(s)
indoxyl sulfate (CHEBI:43355) is conjugate acid of indoxyl sulfate(1−) (CHEBI:144643)
IUPAC Name 
1H-indol-3-yl sulfate
UniProt Name  Source
indoxyl sulfateUniProt
Manual XrefsDatabases
CPD-16817MetaCyc