AG00BBOI

25416-65-3 | Sodium levothyroxine

AG00BBOI

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CAS Number	25416-65-3
Catalog Number	AG00BBOI(AGN-PC-0R176J)
Chemical Name	Sodium levothyroxine
EC Number	200-221-4
IUPAC Name	sodium;(2S)-2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoate;hydrate
InChI	InChI=1S/C15H11I4NO4.Na.H2O/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);;1H2/q;+1;/p-1/t12-;;/m0../s1
InChI Key	ANMYAHDLKVNJJO-LTCKWSDVSA-M
MDL Number	MFCD06408007
Molecular Formula	C15H13I4NNaO5
Molecular Weight	817.8751
SMILES	O.O(c1cc(I)c(c(c1)I)O)c1c(I)cc(cc1I)C[C@@H](C(=O)O)N.[Na]
UNII	B82379R9W0
Synonyms	3,5,3',5'-Tetraiodothyronine, Berlthyrox, Dexnon, Eferox, Eltroxin, Eltroxine, Euthyrox, Eutirox, L Thyrox, L Thyroxin beta, L Thyroxin Henning, L Thyroxine, L Thyroxine Roche, L-3,5,3',5'-Tetraiodothyronine, L-Thyrox, L-Thyroxin beta, L-Thyroxin Henning, L-Thyroxine, L-Thyroxine Roche, Lévothyrox, Levo T, Levo-T, Levothroid, Levothyroid, Levothyroxin Deladande, Levothyroxin Delalande, Levothyroxine, Levothyroxine Sodium, Levoxine, Levoxyl, Novothyral, Novothyrox, O-(4-Hydroxy-3,5-diiodophenyl) 3,5-diiodo-L-tyrosine, O-(4-Hydroxy-3,5-diiodophenyl)-3,5-diiodotyrosine, Oroxine, Sodium Levothyroxine, Synthroid, Synthrox, T4 Thyroid Hormone, Thevier, Thyrax, Thyroid Hormone, T4, Thyroxin, Thyroxine, Tiroidine, Tiroxina Leo, Unithroid, 25416-65-3, Levothyroxine sodium, Levothyroxine sodium hydrate, L-Thyroxine sodium xhydrate, Levothyroxine sodium monohydrate, UNII-B82379R9W0, Sodium levothyroxine, CHEBI:6447, L-Thyroxine sodium salt hydrate, levothroid, synthroid, Levoxyl, B82379R9W0, 798.85 (anhydrous), C15H10I4NNaO4.xH2O, Latequatro, Letequatro, Levoroxin, Levotiron, Tiroxina, Tivoral, Levo-Tiroxina Glaxo, T4 (LIOTRIX), Monosodium L-thyroxine hydrate, Levothroid (TN), Synthroid (TN), AK162020, Levoxyl (TN), Levothyroxine sodium [USP:INN:JAN], Levothyroxine sodium (USP), Levothyroxine sodium, hydrate, SCHEMBL2327406, CHEMBL2103741, KS-00000SLA, ANMYAHDLKVNJJO-LTCKWSDVSA-M, L-thyroxine sodium salt monohydrate, CT-231, Levothyroxine sodium hydrate (JP17), AKOS015895962, KS-1237, L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-, monosodium salt, hydrate, L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-, monosodium salt, monohydrate, 31178-59-3, H510, Sodium O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-L-tyrosine hydrate, ST24047481, D01010, J10017, I06-1254, 3,3 inverted exclamation marka,5,5 inverted exclamation marka-Tetraiodo-L-thyronine monosodium salt hydrate, thyroxine, Unithroid, Levo-T, DEXTROTHYROXINE SODIUM, UNII-9J765S329G, CID63008, C15-H10-I4-N-Na-O4.x-H2-O, t4,

Complexity	426
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	816.679g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	816.871g/mol
Monoisotopic Mass	816.679g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	96.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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