(2S)-2-amino-3-[3,5-diiodo-4-[3-iodo-4-(phenylcarbamoyloxy)phenoxy]phenyl]propanoic acid
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![(2S)-2-amino-3-[3,5-diiodo-4-[3-iodo-4-(phenylcarbamoyloxy)phenoxy]phenyl]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6f8fe0a0526b4c81bce76c2390377ef9.png "(2S)-2-amino-3-[3,5-diiodo-4-[3-iodo-4-(phenylcarbamoyloxy)phenoxy]phenyl]propanoic acid")
(2S)-2-amino-3-[3,5-diiodo-4-[3-iodo-4-(phenylcarbamoyloxy)phenoxy]phenyl]propanoic acid
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CAS No:
99780-73-1
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Formula:
C22H17I3N2O5
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Chemical Name:
(2S)-2-amino-3-[3,5-diiodo-4-[3-iodo-4-(phenylcarbamoyloxy)phenoxy]phenyl]propanoic acid
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Synonyms:
carb T3;carbamylated triiodothyronine;triiodothyronine, carbamylated;99780-73-1;Carb T3;Carbamylated triiodothyronine;Triiodothyronine, carbamylated;DTXSID20912474;O-{4-[Hydroxy(phenylimino)methoxy]-3-iodophenyl}-3,5-diiodotyrosine;L-Tyrosine, 3,5-diiodo-O-(3-iodo-4-(((phenylamino)carbonyl)oxy)phenyl)-, (1R-(1alpha(Z),2beta(1E,3S*),5alpha))-
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CAS No:
(2S)-2-amino-3-[3,5-diiodo-4-[3-iodo-4-(phenylcarbamoyloxy)phenoxy]phenyl]propanoic acid Basic Attributes
770.1 g/mol
769.8272 g/mol
Computed Properties
Molecular Weight:770.1
XLogP3:3.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:769.8272
Monoisotopic Mass:769.8272
Topological Polar Surface Area:111
Heavy Atom Count:32
Complexity:625
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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