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N-Formyl Thyroxine-[13C6]

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General Information
Catalog: BLP-005004
CAS: 1346604-89-4
Molecular Formula: C10[13C]6H11I4NO5
Molecular Weight: 810.84

Chemical Structure

Description	N-Formyl Thyroxine-[13C6] is the labelled analogue of N-Formyl Thyroxine, which is a derivative of Levothyroxine.
Synonyms	N-Formyl Thyroxine-13C6; N-Formyl-O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-L-tyrosine-13C6
IUPAC Name	(2S)-2-formamido-3-[4-(4-hydroxy-3,5-diiodo(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)oxy-3,5-diiodophenyl]propanoic acid
Related CAS	671235-41-9 (unlabelled)
Canonical SMILES	C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)CC(C(=O)O)NC=O
InChI	InChI=1S/C16H11I4NO5/c17-9-4-8(5-10(18)14(9)23)26-15-11(19)1-7(2-12(15)20)3-13(16(24)25)21-6-22/h1-2,4-6,13,23H,3H2,(H,21,22)(H,24,25)/t13-/m0/s1/i4+1,5+1,8+1,9+1,10+1,14+1
InChI Key	DNRNTTVIRGKKSQ-GBLPCCAPSA-N
Solubility	Slightly soluble in DMSO
Appearance	White Solid
Storage	Store at 2-8°C under inert atmosphere