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English
3,5-Diiodo-O-[3-iodo-4-(sulfooxy)phenyl]tyrosine
group of stereoisomers with the chemical formula C₁₅H₁₂I₃NO₇S
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
730.746866724
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₂I₃NO₇S
0 references
canonical SMILES
O=C(O)C(N)CC1=CC(I)=C(OC2=CC=C(OS(=O)(=O)O)C(I)=C2)C(I)=C1
0 references
found in taxon
Homo sapiens
1 reference
stated in
A community-driven global reconstruction of human metabolism.
Identifiers
InChI
InChI=1S/C15H12I3NO7S/c16-9-6-8(1-2-13(9)26-27(22,23)24)25-14-10(17)3-7(4-11(14)18)5-12(19)15(20)21/h1-4,6,12H,5,19H2,(H,20,21)(H,22,23,24)
0 references
InChIKey
XBQYQXVJBNDCGY-UHFFFAOYSA-N
0 references
PubChem CID
44237231
1 reference
stated in
PubChem
retrieved
3 January 2023
based on heuristic
inferred from InChIKey
UniChem compound ID
63974034
1 reference
stated in
UniChem
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