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4732-82-5 | 3'-monoiodothyronine
CAS No: 4732-82-5 Catalog No: AG00DM3B MDL No:
Product Description
Catalog Number:
AG00DM3B
Chemical Name:
3'-monoiodothyronine
CAS Number:
4732-82-5
IUPAC Name:
(2S)-2-amino-3-[4-(4-hydroxy-3-iodophenoxy)phenyl]propanoic acid
InChI:
InChI=1S/C15H14INO4/c16-12-8-11(5-6-14(12)18)21-10-3-1-9(2-4-10)7-13(17)15(19)20/h1-6,8,13,18H,7,17H2,(H,19,20)/t13-/m0/s1
InChI Key:
RUIUIJSMLKJUDC-ZDUSSCGKSA-N
UNII:
NM2RL113ZR
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
398.997g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
399.184g/mol
Monoisotopic Mass:
398.997g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| 3'-monoiodothyronine sulfate and Triac sulfate are thyroid hormone metabolites in developing sheep. | Pediatric research 20080201 |
| Inhibition of the activity of the native gamma-aminobutyric acid A receptor by metabolites of thyroid hormones: correlations with molecular modeling studies. | Brain research 20040409 |
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