6-Bromo-2-naphthalenyl beta-D-glucopyranosiduronic acid structure

6-Bromo-2-naphthalenyl beta-D-glucopyranosiduronic acid

(2S,3S,4S,5R,6S)-6-(6-bromonaphthalen-2-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

Also Known As: Br-Nap-a-D-GlcA|6-Bromo-2-naphthyl beta-D-glucuronide|6-Bromo-2-naphthyl b-D-glucuronide|EINECS 245-176-1|6-Bromo-2-naphthyl beta-D-glucopyranosiduronic acid|6-BROMO-2-NAPHTHYL-BETA-D-GLUCURONIDE|6-Bromo-2-naphthyl|A-D-glucuronide|HY-W546894|6-Bromo-2-naphthyl beta -D-glucuronide|6-bromonaphthalen-2-yl hexopyranosiduronic acid|(2S,3S,4S,5R,6S)-6-(6-bromonaphthalen-2-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid|6-Bromo-2-naphthalenyl beta-D-glucopyranosiduronic acid|6-Bromo-2-naphthyl|A-D-glucopyranosiduronic acid|6-Bromo-2-naphthalenyl EC-D-glucopyranosiduronic acid|(6-Bromonaphthalen-2-yl)beta-D-glucopyranosiduronic acid|6-Bromonaphthalen-2-yl beta-D-glucopyranosiduronic acid|(2S,3S,4S,5R,6S)-6-((6-Bromonaphthalen-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid|(2S,3S,4S,5R,6S)-6-[(6-bromonaphthalen-2-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid|(2S,3S,4S,5R,6S)-6-((6-Bromonaphthalen-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylicacid|(2S,3S,4S,5R,6S)-6-[(6-bromo-2-naphthyl)oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid

CAS: 22720-35-0
Molecular Formula C16H15BrO7
Molecular Weight 398.00012 g/mol
LogP 0.87
Topological Polar Surface Area 116.45 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 6
Rotatable Bonds 3
Exact Mass 398.00012
Heavy Atoms 24
Complexity 765.2

Chemical Identifiers

CAS Number 22720-35-0
SMILES C1=CC2=C(C=CC(=C2)Br)C=C1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O

Product Overview

6-Bromo-2-naphthalenyl beta-D-glucopyranosiduronic acid (CAS 22720-35-0), with molecular formula C16H15BrO7 and molecular weight 398.00012 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-(6-bromonaphthalen-2-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid.

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