chempirical

Liothyronine sodium

C15H11I3NNaO4CAS 55-06-1672.96 g/mol

Open in Covalent MOL file
H2NIOOHIIO−ONa+
Aryl halideCarboxylic acidEtherPhenolPrimary amine

Properties

Molecular formula
C15H11I3NNaO4
Molar mass
672.96 g/mol
Exact mass
672.7720 Da
logP
3.57Crippen estimate
Polar surface area
92.8 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
55-06-1
SMILES
N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C([O-])=O.[Na+]
InChIKey
LXHCVQFUTOUZEQ-YDALLXLXSA-N
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);/t12-;/m0./s1

Weigh it out

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

Names and synonyms

31 names · show all
  • L-Tyrosine, O-(4-hydroxy-3-iodophenyl)-3,5-diiodo-, sodium salt (1:1)
  • Alanine, 3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-, monosodium salt, L-
  • L-Tyrosine, O-(4-hydroxy-3-iodophenyl)-3,5-diiodo-, monosodium salt
  • Cytomel sodium
  • Tertroxin
  • Sodium triiodo-L-thyronine
  • Sodium 3,3′,5-triiodo-L-thyronine
  • Sodium 3,5,3′-triiodothyronine
  • Sodium triiodothyronine
  • Triiodothyronine sodium salt
  • L-Triiodothyronine sodium salt
  • Sodium liothyronine
  • Liothyronin sodium
  • Basoprocin
  • Cynomel
  • Cytomel
  • Ibiothyron
  • 3,3′,5-Triiodo-L-thyronine sodium salt
  • 3,3′,5-Triiodothyronine sodium salt
  • Sodium L-3,3′,5-triiodothyronine
  • T3 Sodium salt
  • Sodium T3
  • Triothyrone
  • Sodium L-triiodothyronine
  • Liothyroniinde sodium salt
  • Cytomine
  • Cyomel
  • Triostat
  • Cytobin
  • 3,5,3′-Triiodo-L-thyronine monosodium salt
  • 3,3′,5-Triiodo-L-thyronine sodium

Work with Liothyronine 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

Similar compounds

Levothyroxine sodium50809-32-076 % similar Levothyroxine sodium55-03-876 % similar L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-, sodium salt, hydrate (1:1:?)25416-65-372 % similar Triiodothyronine6893-02-371 % similar 3,3′-Diiodo-L-thyronine4604-41-555 % similar Triac51-24-154 % similar Diiodothyronine1041-01-654 % similar (±)-Thyroxine300-30-152 % similar

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

Elsewhere

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