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Chemical structure of 3,3'-Diiodo-L-thyronine

GC42201

3,3'-Diiodo-L-thyronine

Also known as (2S)-2-amino-3-[4-(4-hydroxy-3-iodophenoxy)-3-iodophenyl]propanoic acid

3,3'-Diiodo-L-thyronine is a metabolite of thyroid hormone that is also known as T2 or 3,3'-T2

ChemicalCAS4604-41-5MW525.1FormulaC15H13I2NO4
CAS number
4604-41-5
Molecular weight
525.1
Formula
C15H13I2NO4
Solubility
DMF： 30 mg/ml,DMSO： 30 mg/ml,DMSO：PBS (pH 7·2) (1：30)： 0·03 mg/ml
InChIKey
CPCJBZABTUOGNM-LBPRGKRZSA-N
Catalogue number
GC42201
Brand
GLPBIO
Computed properties PubChem CID 107564 · XLogP 1.1 · TPSA 92.8 Ų · H-bond donors 3
XLogP
1.1
TPSA
92.8 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
22

SMILES C1=CC(=C(C=C1C[C@@H](C(=O)O)N)I)OC2=CC(=C(C=C2)O)I

Computed descriptors from PubChem (CID 107564), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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