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1057-47-2 | 3,5-diiodo-tyrosyl-3,5-diiodo-tyrosine
CAS No: 1057-47-2 Catalog No: AG009O41 MDL No:
Product Description
Catalog Number:
AG009O41
Chemical Name:
3,5-diiodo-tyrosyl-3,5-diiodo-tyrosine
CAS Number:
1057-47-2
IUPAC Name:
(2S)-2-[[(2S)-2-amino-3-(4-hydroxy-3,5-diiodophenyl)propanoyl]amino]-3-(4-hydroxy-3,5-diiodophenyl)propanoic acid
InChI:
InChI=1S/C18H16I4N2O5/c19-9-1-7(2-10(20)15(9)25)5-13(23)17(27)24-14(18(28)29)6-8-3-11(21)16(26)12(22)4-8/h1-4,13-14,25-26H,5-6,23H2,(H,24,27)(H,28,29)/t13-,14-/m0/s1
InChI Key:
LTKNDEMGPUWUJG-KBPBESRZSA-N
Properties
Complexity:
563
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
847.724g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
847.953g/mol
Monoisotopic Mass:
847.724g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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