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CHEBI:57261 - 3,3',5'-triiodo-L-thyronine zwitterion

ChEBI IDCHEBI:57261
ChEBI Name3,3',5'-triiodo-L-thyronine zwitterion
Stars
ASCII Name3,3',5'-triiodo-L-thyronine zwitterion
DefinitionZwitterionic form of 3,3',5'-triiodo-L-thyronine.
Last Modified24 October 2024
DownloadsMolfile
FormulaC15H12I3NO4
Net Charge0
Average Mass650.976
Monoisotopic Mass650.79005
SMILES[NH3+][C@@H](Cc1ccc(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)[O-]
InChIInChI=1S/C15H12I3NO4/c16-9-3-7(4-12(19)15(21)22)1-2-13(9)23-8-5-10(17)14(20)11(18)6-8/h1-3,5-6,12,20H,4,19H2,(H,21,22)/t12-/m0/s1
InChIKeyHZCBWYNLGPIQRK-LBPRGKRZSA-N
ChEBI Ontology
Outgoing Relation(s)
3,3',5'-triiodo-L-thyronine zwitterion (CHEBI:57261) is a amino-acid zwitterion (CHEBI:35238)
3,3',5'-triiodo-L-thyronine zwitterion (CHEBI:57261) is tautomer of 3,3',5'-triiodo-L-thyronine (CHEBI:11684)
Incoming Relation(s)
3,3',5'-triiodo-L-thyronine sulfate(1−) (CHEBI:176513) has functional parent 3,3',5'-triiodo-L-thyronine zwitterion (CHEBI:57261)
3,3',5'-triiodo-L-thyronine (CHEBI:11684) is tautomer of 3,3',5'-triiodo-L-thyronine zwitterion (CHEBI:57261)
IUPAC Name 
(2S)-2-azaniumyl-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3-iodophenyl]propanoate
UniProt Name  Source
3,3',5'-triiodo-L-thyronineUniProt
Manual XrefsDatabases
CPD-10813MetaCyc