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1628776-32-8 | 3,5-Diiodo-L-thyronine4’-O-Sulfate
CAS No: 1628776-32-8 Catalog No: AG01E2JV MDL No:
Product Description
Catalog Number:
AG01E2JV
Chemical Name:
3,5-Diiodo-L-thyronine4’-O-Sulfate
CAS Number:
1628776-32-8
IUPAC Name:
(2S)-2-amino-3-[3,5-diiodo-4-(4-sulfooxyphenoxy)phenyl]propanoic acid
InChI:
InChI=1S/C15H13I2NO7S/c16-11-5-8(7-13(18)15(19)20)6-12(17)14(11)24-9-1-3-10(4-2-9)25-26(21,22)23/h1-6,13H,7,18H2,(H,19,20)(H,21,22,23)/t13-/m0/s1
InChI Key:
HOUQDJLGYJSQKF-ZDUSSCGKSA-N
Properties
Complexity:
565
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
604.85g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
605.138g/mol
Monoisotopic Mass:
604.85g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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