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CHEBI:58910 - thyroxine sulfate(1−)

ChEBI IDCHEBI:58910
ChEBI Namethyroxine sulfate(1−)
Stars
ASCII Namethyroxine sulfate(1-)
DefinitionConjugate base of thyroxine sulfate having anionic carboxy and sulfate groups and the amino group protonated.
Last Modified4 April 2018
DownloadsMolfile
FormulaC15H10I4NO7S
Net Charge-1
Average Mass855.928
Monoisotopic Mass855.63624
SMILES[NH3+]C(Cc1cc(I)c(Oc2cc(I)c(OS(=O)(=O)[O-])c(I)c2)c(I)c1)C(=O)[O-]
InChIInChI=1S/C15H11I4NO7S/c16-8-1-6(3-12(20)15(21)22)2-9(17)13(8)26-7-4-10(18)14(11(19)5-7)27-28(23,24)25/h1-2,4-5,12H,3,20H2,(H,21,22)(H,23,24,25)/p-1
InChIKeyQYXIJUZWSSQICT-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
thyroxine sulfate(1−) (CHEBI:58910) is a 3,3',5-triiodo-L-thyroninate (CHEBI:60308)
thyroxine sulfate(1−) (CHEBI:58910) is a phenyl sulfate oxoanion (CHEBI:140317)
thyroxine sulfate(1−) (CHEBI:58910) is conjugate base of thyroxine sulfate (CHEBI:53508)
Incoming Relation(s)
L-thyroxine sulfate(1−) (CHEBI:176512) is a thyroxine sulfate(1−) (CHEBI:58910)
thyroxine sulfate (CHEBI:53508) is conjugate acid of thyroxine sulfate(1−) (CHEBI:58910)
IUPAC Name 
2-azaniumyl-3-{4-[3,5-diiodo-4-(sulfonatooxy)phenoxy]-3,5-diiodophenyl}propanoate
UniProt Name  Source
thyroxine sulfateUniProt