(2S,3S,4S,5R,6R)-6-[(2,4-dinitrophenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
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![(2S,3S,4S,5R,6R)-6-[(2,4-dinitrophenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/089e644c8b7f45e99d98d83473468860.png "(2S,3S,4S,5R,6R)-6-[(2,4-dinitrophenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid")
(2S,3S,4S,5R,6R)-6-[(2,4-dinitrophenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
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CAS No:
78246-56-7
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Formula:
C13H14N2O11
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Chemical Name:
(2S,3S,4S,5R,6R)-6-[(2,4-dinitrophenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
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Synonyms:
78246-56-7;beta-D-Glucopyranosiduronic acid, (2,4-dinitrophenyl)methyl;DTXSID10999592;2,4-Dinitrobenzyl beta-D-glucuronide;(2,4-Dinitrophenyl)methyl hexopyranosiduronic acid
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CAS No:
(2S,3S,4S,5R,6R)-6-[(2,4-dinitrophenyl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid Basic Attributes
374.26 g/mol
374.05975927 g/mol
Computed Properties
Molecular Weight:374.26
XLogP3:-0.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:4
Exact Mass:374.05975927
Monoisotopic Mass:374.05975927
Topological Polar Surface Area:208
Heavy Atom Count:26
Complexity:547
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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