3,5-Diiodo-O-[3-Iodo-4-(Sulfooxy)Phenyl]-L-Tyrosine

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Properties Simple | Detailed

Formula C15H12I3NO7S
IUPAC Name (2s)-2-amino-3-[3,5-diiodo-4-(3-iodo-4-sulfooxy-phenoxy)phenyl]propanoic acid
Molecular Mass 731.037 g·mol−1
Heat of Formation -781.9 ± 16.7 kJ·mol−1
Dipole Moment 3.10 ± 1.08 D
Volume 499.53 Å 3
Surface Area 405.53 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-3-[3,5-diiodo-4-(3-iodo-4-sulfooxy-phenoxy)phenyl]propanoic acid
  • (2s)-2-amino-3-[3,5-diiodo-4-(3-iodo-4-sulfooxyphenoxy)phenyl]propanoic acid
  • (2s)-2-amino-3-[3,5-diiodo-4-(3-iodo-4-sulfoxy-phenoxy)phenyl]propionic acid
  • (2s)-2-amino-3-{3,5-diiodo-4-[3-iodo-4-(sulfooxy)phenoxy]phenyl}propanoic acid
  • 3,3',5-triiodo-l-thyronine sulfate
  • l-tyrosine, 3,5-diiodo-o-(3-iodo-4-(sulfooxy)phenyl)-
  • triiodothyronine sulfate
  • triiodothyronine sulfuric ester
CAS Number(s)
  • 31135-55-4
InChIKey XBQYQXVJBNDCGY-LBPRGKRZSA-N
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