(2S,3S,4S,5R,6S)-6-(2-carbamoylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
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(2S,3S,4S,5R,6S)-6-(2-carbamoylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
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CAS No:
18338-81-3
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Formula:
C13H15NO8
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Chemical Name:
(2S,3S,4S,5R,6S)-6-(2-carbamoylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
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Synonyms:
salicylamide glucuronide;Salicylamide glucuronide;18338-81-3;DTXSID70939712;(2S,3S,4S,5R,6S)-6-(2-carbamoylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid;2-[Hydroxy(imino)methyl]phenyl hexopyranosiduronic acid;beta-D-Glucopyranosiduronic acid, 2-(aminocarbonyl)phenyl
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CAS No:
(2S,3S,4S,5R,6S)-6-(2-carbamoylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid Basic Attributes
313.26 g/mol
313.07976644 g/mol
Computed Properties
Molecular Weight:313.26
XLogP3:-1.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:313.07976644
Monoisotopic Mass:313.07976644
Topological Polar Surface Area:160
Heavy Atom Count:22
Complexity:430
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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