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CHEBI:35430 - 3,3'-diiodothyronine

ChEBI IDCHEBI:35430
ChEBI Name3,3'-diiodothyronine
Stars
Last Modified28 March 2006
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC15H13I2NO4
Net Charge0
Average Mass525.080
Monoisotopic Mass524.89340
SMILESNC(Cc1ccc(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)O
InChIInChI=1S/C15H13I2NO4/c16-10-7-9(2-3-13(10)19)22-14-4-1-8(5-11(14)17)6-12(18)15(20)21/h1-5,7,12,19H,6,18H2,(H,20,21)
InChIKeyCPCJBZABTUOGNM-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3,3'-diiodothyronine (CHEBI:35430) is a iodothyronine (CHEBI:24864)
Incoming Relation(s)
3,3'-diiodo-L-thyronine (CHEBI:45698) is a 3,3'-diiodothyronine (CHEBI:35430)
IUPAC Name 
3,3'-diiodothyronine
Synonyms  Source
2-amino-3-[4-(4-hydroxy-3-iodophenoxy)-3-iodophenyl]propanoic acidChEBI
O-(4-hydroxy-3-iodophenyl)-3-iodotyrosineIUPAC
3,3'-T2ChemIDplus
Registry NumbersSources
Beilstein:2674477Beilstein
CAS:70-40-6ChemIDplus