U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H12I3NO4
Molecular Weight 662.9785
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LIOTHYRONINE I-131

SMILES

N[C@@H](CC1=CC([131I])=C(OC2=CC([131I])=C(O)C=C2)C([131I])=C1)C(O)=O

InChI

InChIKey=AUYYCJSJGJYCDS-UMVFHIKJSA-N
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/i16+4,17+4,18+4

HIDE SMILES / InChI

Molecular Formula C15H12I3NO4
Molecular Weight 662.9785
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

A radioconjugate of synthetic active thyroid hormone, liothyronine (T3), labeled with Iodine 131. Liothyronine involves many important metabolic functions and is essential to the proper development and differentiation of all cells. I131 liothyronine may be used in radiotherapy in thyroid cancers.

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 17:52:41 GMT 2025
Edited
by admin
on Mon Mar 31 17:52:41 GMT 2025
Record UNII
86AZ0G22V2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LIOTHYRONINE I 131
USAN  
USAN  
Preferred Name English
LIOTHYRONINE I-131
Common Name English
LIOTHYRONINE I 131 [USAN]
Common Name English
L-ALANINE, 3-(4-(4-HYDROXY-3-IODOPHENOXY)-3,5-DIIODOPHENYL)-, LABELED WITH IODINE-131
Common Name English
L-TYROSINE, O-(4-HYDROXY-3-IODOPHENYL)-3,5-DIIODO-, LABELED WITH IODINE-131
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C2124
Created by admin on Mon Mar 31 17:52:41 GMT 2025 , Edited by admin on Mon Mar 31 17:52:41 GMT 2025
NCI_THESAURUS C1553
Created by admin on Mon Mar 31 17:52:41 GMT 2025 , Edited by admin on Mon Mar 31 17:52:41 GMT 2025
Code System Code Type Description
ChEMBL
CHEMBL1544
Created by admin on Mon Mar 31 17:52:41 GMT 2025 , Edited by admin on Mon Mar 31 17:52:41 GMT 2025
PRIMARY
PUBCHEM
23724940
Created by admin on Mon Mar 31 17:52:41 GMT 2025 , Edited by admin on Mon Mar 31 17:52:41 GMT 2025
PRIMARY
FDA UNII
86AZ0G22V2
Created by admin on Mon Mar 31 17:52:41 GMT 2025 , Edited by admin on Mon Mar 31 17:52:41 GMT 2025
PRIMARY
CAS
20196-64-9
Created by admin on Mon Mar 31 17:52:41 GMT 2025 , Edited by admin on Mon Mar 31 17:52:41 GMT 2025
PRIMARY
NCI_THESAURUS
C2396
Created by admin on Mon Mar 31 17:52:41 GMT 2025 , Edited by admin on Mon Mar 31 17:52:41 GMT 2025
PRIMARY
DRUG BANK
DB12425
Created by admin on Mon Mar 31 17:52:41 GMT 2025 , Edited by admin on Mon Mar 31 17:52:41 GMT 2025
PRIMARY
Related Record Type Details
NON-LABELED -> LABELED