LIOTHYRONINE SODIUM

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Search structure


Trade Names	CYTOMEL LIOTHYRONINE SODIUM TRIOSTAT
Synonyms	Basoprocin Cynomel Cytobin Cytomel Ibiothyron L-triiodothyronine hydrochloride L-triiodothyronine sodium salt Liothyronine hydrochloride Liothyronine sodium Liothyronine sodium salt Liotrix (t3) Lyothyronin NSC-758175 NSC-80774 Rathyronine hydrochloride, (s)- Rathyronine sodium, (s)- T3 (liotrix) T3 sodium salt Tertroxin Thybon Triiodothyronine Triiodothyronine sodium salt Triiodothyronine sodium, levo Triiodothyronine,evans Triostat
Status
Molecule Category	Salt-form
ATC	H03AA02
UNII	GCA9VV7D2N
EPA CompTox	DTXSID8047505
Parent Compound:	LIOTHYRONINE


Active Pharmaceutical Ingredients Bioactive chemicals	Exact Similarity SubStructure	Threshold (%) >= 70

Structure


InChI Key	SBXXSUDPJJJJLC-YDALLXLXSA-M
Smiles	N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(=O)[O-].[Na+]
InChI	InChI=1S/C15H12I3NO4.Na/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);/q;+1/p-1/t12-;/m0./s1

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C15H11I3NNaO4
Molecular Weight	672.96
AlogP	3.95
Hydrogen Bond Acceptor	4.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	5.0
Polar Surface Area	92.78
Molecular species	ZWITTERION
Aromatic Rings	2.0
Heavy Atoms	23.0

Metabolites Network

visNetwork

Bioactivity

Mechanism of Action	Action	Reference
Thyroid hormone receptor agonist	AGONIST	DailyMed Wikipedia Wikipedia

Assay Description	Organism	Bioactivity	Reference
Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of Caco-2 cells at 10 uM after 48 hours by high content imaging	Homo sapiens	-3.81 %
SARS-CoV-2 3CL-Pro protease inhibition percentage at 20µM by FRET kind of response from peptide substrate	Severe acute respiratory syndrome coronavirus 2	4.38 %
Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VERO-6 cells at 10 uM after 48 hours exposure to 0.01 MOI SARS CoV-2 virus by high content imaging	Chlorocebus sabaeus	-0.12 %		Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VERO-6 cells at 10 uM after 48 hours exposure to 0.01 MOI SARS CoV-2 virus by high content imaging	Chlorocebus sabaeus	-0.12 %

Cross References

Resources	Reference
ChEBI	6484
ChEMBL	CHEMBL1201119
FDA SRS	GCA9VV7D2N
PubChem	23666110
SureChEMBL	SCHEMBL41654

CONTENTS

PREMIER has received funding from the Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information this manuscript contains.

Elements of the website have been developed under projects PREMIER and the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT is thanked for providing computational resources. Content of the website is provided without guarantee for correctness. Data has been collected and integrated from multiple public sources, for the largest: FDA, HUGO Gene Nomenclature Committee, ChEMBL, IUPHAR/BPS guide to pharmacology, Reactome, UniProt, and Ensembl. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).