CHEBI:75492 - 5-bromo-4-chloro-3-indolyl sulfate

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ChEBI Name 5-bromo-4-chloro-3-indolyl sulfate ChEBI ID CHEBI:75492 Definition An aryl sulfate that is indoxyl sulfate in which the indole moiety is substituted at positions 4 and 5 by chlorine and bromine, respectively. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H5BrClNO4S Net Charge 0 Average Mass 326.55200 Monoisotopic Mass 324.88112 InChI InChI=1S/C8H5BrClNO4S/c9-4-1-2-5-7(8(4)10)6(3-11-5)15-16(12,13)14/h1-3,11H,(H,12,13,14) InChIKey KZKSBQXQOQUOQO-UHFFFAOYSA-N SMILES OS(=O)(=O)Oc1c[nH]c2ccc(Br)c(Cl)c12 ChEBI Ontology Outgoing 5-bromo-4-chloro-3-indolyl sulfate (CHEBI:75492) has functional parent indoxyl (CHEBI:17840) 5-bromo-4-chloro-3-indolyl sulfate (CHEBI:75492) is a aryl sulfate (CHEBI:37919) 5-bromo-4-chloro-3-indolyl sulfate (CHEBI:75492) is a indoles (CHEBI:24828) 5-bromo-4-chloro-3-indolyl sulfate (CHEBI:75492) is a organobromine compound (CHEBI:37141) 5-bromo-4-chloro-3-indolyl sulfate (CHEBI:75492) is a organochlorine compound (CHEBI:36683) IUPAC Name 5-bromo-4-chloro-1H-indol-3-yl hydrogen sulfate Synonym Source 5-bromo-4-chloroindoxyl sulfate ChEBI Registry Number Type Source 1544133 Reaxys Registry Number Reaxys Last Modified 06 September 2013