thyroxine (CHEBI:30660)

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ChEBI Name	thyroxine

ChEBI ID	CHEBI:30660

Definition	An iodothyronine compound having iodo substituents at the 3-, 3'-, 5- and 5'-positions.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	ZINC000008216889

Download	Molfile XML SDF

Formula

C15H11I4NO4

Net Charge

Average Mass

776.87006

Monoisotopic Mass

776.68669

InChI

InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)

InChIKey

XUIIKFGFIJCVMT-UHFFFAOYSA-N

SMILES

NC(Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	mitogen A chemical substance that encourages a cell to commence cell division, triggering mitosis.

ChEBI Ontology
Outgoing	thyroxine (CHEBI:30660) has role mitogen (CHEBI:52290) thyroxine (CHEBI:30660) is a 2-halophenol (CHEBI:53291) thyroxine (CHEBI:30660) is a iodophenol (CHEBI:24863) thyroxine (CHEBI:30660) is a iodothyronine (CHEBI:24864) thyroxine (CHEBI:30660) is a non-proteinogenic α-amino acid (CHEBI:83925) thyroxine (CHEBI:30660) is a tyrosine derivative (CHEBI:62761) thyroxine (CHEBI:30660) is tautomer of thyroxine zwitterion (CHEBI:305790)

Incoming	thyroxine sulfate (CHEBI:53508) has functional parent thyroxine (CHEBI:30660) D-thyroxine (CHEBI:30659) is a thyroxine (CHEBI:30660) L-thyroxine (CHEBI:18332) is a thyroxine (CHEBI:30660) thyroxine zwitterion (CHEBI:305790) is tautomer of thyroxine (CHEBI:30660)

IUPAC Name

thyroxine

Synonyms	Sources
2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoic acid	IUPAC
DL-Thyroxine	ChemIDplus
O-(4-Hydroxy-3,5-diiodophenyl)-3,5-diiodo-DL-tyrosine	ChemIDplus
Thx	IUPAC

Citations

Last Modified

17 December 2014