(2S,3S,4S,5R,6S)-6-[6-[(4-acetamidophenyl)sulfonylamino]pyridin-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
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![(2S,3S,4S,5R,6S)-6-[6-[(4-acetamidophenyl)sulfonylamino]pyridin-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/327146c3acbe4eed8b9afa3a455eef5a.png "(2S,3S,4S,5R,6S)-6-[6-[(4-acetamidophenyl)sulfonylamino]pyridin-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid")
(2S,3S,4S,5R,6S)-6-[6-[(4-acetamidophenyl)sulfonylamino]pyridin-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
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CAS No:
69233-18-7
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Formula:
C19H21N3O10S
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Chemical Name:
(2S,3S,4S,5R,6S)-6-[6-[(4-acetamidophenyl)sulfonylamino]pyridin-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
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Synonyms:
acetylsulfapyridine-O-glucuronide;69233-18-7;Acetylsulfapyridine-O-glucuronide;DTXSID20988957;2-(4-Acetylaminophenylsulfonylamino)-5-pyridinyl beta-D-glucopyranosiduronic acid;beta-D-Glucopyranosiduronic acid, 6-(((4-(acetylamino)phenyl)sulfonyl)amino)-3-pyridinyl;6-({4-[(1-Hydroxyethylidene)amino]benzene-1-sulfonyl}amino)pyridin-3-yl hexopyranosiduronic acid
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CAS No:
(2S,3S,4S,5R,6S)-6-[6-[(4-acetamidophenyl)sulfonylamino]pyridin-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid Basic Attributes
483.5 g/mol
483.09476505 g/mol
Computed Properties
Molecular Weight:483.5
XLogP3:-1
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:7
Exact Mass:483.09476505
Monoisotopic Mass:483.09476505
Topological Polar Surface Area:213
Heavy Atom Count:33
Complexity:798
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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