chempirical

Levothyroxine sodium

C15H10I4NNaO4CAS 55-03-8798.86 g/mol

Open in Covalent MOL file
H2NIOIOHIIO−ONa+
Aryl halideCarboxylic acidEtherPhenolPrimary amine

Properties

Molecular formula
C15H10I4NNaO4
Molar mass
798.86 g/mol
Exact mass
798.6686 Da
logP
4.18Crippen estimate
Polar surface area
92.8 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
55-03-8
SMILES
N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C([O-])=O.[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

58 names · show all
  • L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-, sodium salt (1:1)
  • Thyroxine, monosodium salt, L-
  • L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-, monosodium salt
  • Dathroid
  • Eltroxin
  • Laevoxin
  • Levoroxine
  • Sodium levothyroxine
  • Sodium thyroxin
  • Sodium L-thyroxine
  • Sodium thyroxine
  • Thyroxine sodium
  • L-Thyroxine sodium
  • L-Thyroxine monosodium salt
  • L-Thyroxine sodium salt
  • Monosodium thyroxine
  • Sodium thyroxinate
  • Thyroxine sodium salt
  • Euthyrox
  • Letter
  • Levaxin
  • Synthroid sodium
  • Thyroxevan
  • Synthroid
  • Oroxine
  • Levothroid
  • Thyradin S
  • Eferox
  • Elthyrone
  • Eutirox
  • Letrox
  • Levo-T
  • Berlthyrox
  • Droxine
  • Levothyrox
  • Levotiroxina
  • Levoxyl
  • Synthrox
  • T 4KP
  • Thevier
  • Throxinique
  • Thyradin
  • Thyrax duotab
  • Thyrex
  • Thyro 4
  • Thyrosit
  • Tiroidine
  • Levotirox
  • Elthyroxine
  • NSC 259940
  • Puran T 4
  • L-Thyroxin henning
  • Leventa
  • T4 Montpellier 100
  • Levolet
  • Unithroid
  • Novothyrox
  • Tirosint

Work with Levothyroxine sodium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-, sodium salt, hydrate (1:1:?)25416-65-3Hydrate (-)-Thyroxine51-48-9Free acid (+-)-Thyroxine300-30-1Free acid, stereo not defined D-Thyroxine51-49-0Free acid, enantiomer Levothyroxine sodium50809-32-0

Similar compounds

Liothyronine sodium55-06-176 % similar 3',5'-Diiodo-L-tyrosine300-39-052 % similar Tetraiodothyroacetic acid67-30-152 % similar Diiodothyronine1041-01-652 % similar Reverse triiodothyronine5817-39-052 % similar Triiodothyronine6893-02-352 % similar 3 5-Diiodo-L-tyrosine dihydrate 9818835-59-149 % similar 3,5-Diiodo-L-tyrosine dihydrate312693-60-049 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook