Analyte Name

Thyroxine 4'-O-Sulfate-13C6 Disodium Salt

Molecular Formula

13C6 C9 H9 I4 N Na2 O7 S

Molecular Weight

906.853

Accurate Mass

906.628

SMILES

N[C@@H](Cc1cc(I)c(O[13c]2[13cH][13c](I)[13c](OS(=O)(=O)O[Na])[13c](I)[13cH]2)c(I)c1)C(=O)O[Na]

InChI

InChI=1S/C15H11I4NO7S.2Na/c16-8-1-6(3-12(20)15(21)22)2-9(17)13(8)26-7-4-10(18)14(11(19)5-7)27-28(23,24)25;;/h1-2,4-5,12H,3,20H2,(H,21,22)(H,23,24,25);;/q;2*+1/p-2/t12-;;/m0../s1/i4+1,5+1,7+1,10+1,11+1,14+1;;

IUPAC

[(2S)-2-amino-3-[4-(3,5-diiodo-4-sodiooxysulfonyloxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)oxy-3,5-diiodophenyl]propanoyl]oxysodium

SIL Type

Carbon

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat