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(Q82796774)
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English
O-Benzyl-3,5-diiodo-L-tyrosine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
522.9141393399999
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₆H₁₅I₂NO₃
0 references
canonical SMILES
NC(Cc1cc(I)c(OCc2ccccc2)c(I)c1)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1=CC=C(C=C1)COC2=C(C=C(C=C2I)C[C@@H](C(=O)O)N)I
0 references
Identifiers
InChI
InChI=1S/C16H15I2NO3/c17-12-6-11(8-14(19)16(20)21)7-13(18)15(12)22-9-10-4-2-1-3-5-10/h1-7,14H,8-9,19H2,(H,20,21)/t14-/m0/s1
0 references
InChIKey
NCBIOIFTGGTKPS-AWEZNQCLSA-N
0 references
CAS Registry Number
61505-37-1
0 references
PubChem CID
71395160
1 reference
matched by identifier from
InChIKey
InChIKey
NCBIOIFTGGTKPS-AWEZNQCLSA-N
UniChem compound ID
68517631
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70816796
1 reference
matched by identifier from
InChIKey
InChIKey
NCBIOIFTGGTKPS-AWEZNQCLSA-N
DSSTOX compound identifier
DTXCID30767538
0 references
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