Terminology Service for NFDI4Health

3,3',5-triiodo-L-thyronine zwitterion

Go to external page http://purl.obolibrary.org/obo/CHEBI_533015


The amino acid zwitterion formed from 3,3',5-triiodo-L-thyronine by tranfer of a proton from the carboxy group to the amino group. It is the major species at pH 7.3.

Term info

Label

3,3',5-triiodo-L-thyronine zwitterion

Synonyms
  • (2S)-2-azaniumyl-3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]propanoate
database cross reference
Subsets

3_STAR

IUPAC NAME
(2S)-2-azaniumyl-3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]propanoate [ IUPAC ]

charge

0

formula

C15H12I3NO4

has obo namespace

chebi_ontology

has related synonym

3,3',5-triiodo-L-thyronine, (S)-2-Amino-3-[4-(4-hydroxy-3-iodo-phenoxy)-3,5-diiodo-phenyl]-propionic acid

id

CHEBI:533015

inchi

InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1

inchikey

AUYYCJSJGJYCDS-LBPRGKRZSA-N

mass

650.97350

monoisotopicmass

650.79004

smiles

[NH3+][C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C([O-])=O