(2S)-1-[4-(carboxymethylcarbamoyl)-2,3,5,6-tetraiodobenzoyl]pyrrolidine-2-carboxylic acid
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![(2S)-1-[4-(carboxymethylcarbamoyl)-2,3,5,6-tetraiodobenzoyl]pyrrolidine-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9f53ec35003340d893dd0b053da592c3.png "(2S)-1-[4-(carboxymethylcarbamoyl)-2,3,5,6-tetraiodobenzoyl]pyrrolidine-2-carboxylic acid")
(2S)-1-[4-(carboxymethylcarbamoyl)-2,3,5,6-tetraiodobenzoyl]pyrrolidine-2-carboxylic acid
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CAS No:
30046-44-7
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Formula:
C15H12I4N2O6
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Chemical Name:
(2S)-1-[4-(carboxymethylcarbamoyl)-2,3,5,6-tetraiodobenzoyl]pyrrolidine-2-carboxylic acid
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Synonyms:
30046-44-7;BRN 0503697;1-(4-(((Carboxymethyl)amino)carbonyl)-2,3,5,6-tetraiodobenzoyl)-L-proline;L-Proline, 1-(4-(((carboxymethyl)amino)carbonyl)-2,3,5,6-tetraiodobenzoyl)-;1-(4-(Carboxymethyl-carbamoyl)-2,3,5,6-tetrajod-benzoyl)-N-benzyl-aminoessigsaure [German];DTXSID10952440;1-(4-(Carboxymethyl-carbamoyl)-2,3,5,6-tetrajod-benzoyl)-N-benzyl-aminoessigsaure;1-(4-{[(Carboxymethyl)imino](hydroxy)methyl}-2,3,5,6-tetraiodobenzoyl)proline
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CAS No:
(2S)-1-[4-(carboxymethylcarbamoyl)-2,3,5,6-tetraiodobenzoyl]pyrrolidine-2-carboxylic acid Basic Attributes
823.88 g/mol
823.6874 g/mol
Computed Properties
Molecular Weight:823.88
XLogP3:3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:823.6874
Monoisotopic Mass:823.6874
Topological Polar Surface Area:124
Heavy Atom Count:27
Complexity:619
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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