3,3'-Diiodothyronine-4-Sulfate
[CAS# 64192-57-0]

Identification

• Name: 3,3'-Diiodothyronine-4-Sulfate
• Synonyms: (2S)-2-Amino-3-[3-Iodo-4-(3-Iodo-4-Sulfooxy-Phenoxy)Phenyl]Propanoic Acid; (2S)-2-Amino-3-[3-Iodo-4-(3-Iodo-4-Sulfoxy-Phenoxy)Phenyl]Propionic Acid; 3,3'-Diiodothyronine-4-Sulfate
• Molecular Formula: C₁₅H₁₃I₂NO₇S
• Molecular Weight: 605.14
• CAS Registry Number: 64192-57-0
• SMILES: [C@H](C(=O)O)(N)CC2=CC(=C(OC1=CC=C(C(=C1)I)O[S](=O)(=O)O)C=C2)I
• InChI: 1S/C15H13I2NO7S/c16-10-5-8(6-12(18)15(19)20)1-3-13(10)24-9-2-4-14(11(17)7-9)25-26(21,22)23/h1-5,7,12H,6,18H2,(H,19,20)(H,21,22,23)/t12-/m0/s1
• InChIKey: NBAZIIRGURJZJA-LBPRGKRZSA-N

Properties

• Density: 2.175g/cm³ (Cal.)