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Reference substances

Reference substances

IUPAC name:
O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodotyrosine

Inventory

EC number:
200-101-1
EC name:
DL-thyroxin
CAS number:
51-48-9
CAS number:
51-48-9
Synonyms
Names:
L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-
Tyrosine
Identifier:
IUPAC name
tyrosine
Identifier:
other: Molecular formula
C9H11NO3
Identifier:
other: InChl
InChI=1/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)
Identifier:
other: SMILES notation
NC(Cc1ccc(O)cc1)C(=O)O
O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodotyrosine

Molecular and structural information

Molecular formula:
C15H11I4NO4
Molecular weight:
776.87
SMILES notation:
N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(=O)O
InChl:
InChI=1/C15H11I4NO4/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)
Structural formula:
Chemical structure

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