(2S)-2-[[3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]-3-hydroxypropanoic acid
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![(2S)-2-[[3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]-3-hydroxypropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/cf1bac504e984b80b1a27b36e8e4a6d2.png "(2S)-2-[[3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]-3-hydroxypropanoic acid")
(2S)-2-[[3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]-3-hydroxypropanoic acid
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CAS No:
49755-92-2
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Formula:
C14H14I3N3O6
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Chemical Name:
(2S)-2-[[3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]-3-hydroxypropanoic acid
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Synonyms:
Serine, N-(3-acetamido-5-methylcarbamoyl-2,4,6-triiodobenzoyl)-, DL-;49755-92-2;BRN 2402873;DL-N-(3-Acetamido-5-methylcarbamoyl-2,4,6-triiodobenzoyl)serine;SCHEMBL11692654;DTXSID50198027
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CAS No:
(2S)-2-[[3-acetamido-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]-3-hydroxypropanoic acid Basic Attributes
700.99 g/mol
700.8017 g/mol
DTXSID50198027
Computed Properties
Molecular Weight:700.99
XLogP3:0.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:700.8017
Monoisotopic Mass:700.8017
Topological Polar Surface Area:145
Heavy Atom Count:26
Complexity:578
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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