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Levothyroxine (L-Thyroxine) sodium

CAT: 1568-C17284Size: 100 mgDry Ice: YesHazardous: No
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CAT#:1568-C17284Size:100 mg
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CAS Number
55-03-8
Synonyms
L-T4 sodium, LT4 sodium
SKU
C17284-100mg
Target
THR
Applications
Endocrinology & Hormones
Molecular Formula
C15H10I4NO4.Na
Additionnal Information
Levothyroxine (L-Thyroxine) sodium is the major hormone derived from the thyroid gland. It is the agonist of Thyroid hormone receptor alpha and beta.
Storage Conditions
2 years -80 in solvent

Chemical Information

Levothyroxine Sodium

Levothyroxine sodium anhydrous is the sodium salt of L-thyroxine. It is used as replacement therapy in the treatment of hypothyroidism. It contains a L-thyroxine(1-).

CAS Number55-03-8
PubChem CID23666112
IUPAC Namesodium (2S)-2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoate
Molecular FormulaC15H10I4NNaO4
Molecular Weight798.85
Topological Polar Surface Area95.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity426
SMILES
C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)C[C@@H](C(=O)[O-])N.[Na+]
InChI
InChI=1S/C15H11I4NO4.Na/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);/q;+1/p-1/t12-;/m0./s1
InChIKey
YDTFRJLNMPSCFM-YDALLXLXSA-M
Chemical Structure
2D Structure
2D structure of Levothyroxine Sodium
CAS: 55-03-8
CID: 23666112
Formula: C15H10I4NNaO4
MW: 798.85
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight798.85
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass798.6686
Monoisotopic Mass798.6686
Topological Polar Surface Area95.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity426
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes