4-nitrophenyl beta-D-glucoside (CHEBI:90259)

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CHEBI:90259 - 4-nitrophenyl β-D-glucoside

ChEBI ID	CHEBI:90259
ChEBI Name	4-nitrophenyl β-D-glucoside
Stars
ASCII Name	4-nitrophenyl beta-D-glucoside
Definition	A β-D-glucoside that is β-D-glucopyranose in which the anomeric hydroxy hydrogen is replaced by a 4-nitrophenyl group.
Last Modified	6 November 2015
Submitter	Steve
Downloads	Molfile

Formula	C12H15NO8
Net Charge	0
Average Mass	301.251
Monoisotopic Mass	301.07977
SMILES	O=[N+]([O-])c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
InChI	InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
InChIKey	IFBHRQDFSNCLOZ-RMPHRYRLSA-N

Roles Classification

Application:

chromogenic compound Colourless, endogenous or exogenous pigment precursors that may be transformed by biological mechanisms into coloured compounds. They are used in biochemical assays and in diagnosis as indicators, particularly in the form of enzyme substrates.

ChEBI Ontology

Outgoing Relation(s)
	4-nitrophenyl β-D-glucoside (CHEBI:90259) has functional parent 4-nitrophenol (CHEBI:16836)
	4-nitrophenyl β-D-glucoside (CHEBI:90259) has role chromogenic compound (CHEBI:75050)
	4-nitrophenyl β-D-glucoside (CHEBI:90259) is a C-nitro compound (CHEBI:35716)
	4-nitrophenyl β-D-glucoside (CHEBI:90259) is a β-D-glucoside (CHEBI:22798)

IUPAC Name
4-nitrophenyl β-D-glucopyranoside

Synonyms	Source
1-O-p-Nitrophenyl-D-glucose	ChemIDplus
4-Nitrophenyl beta-D-glucopyranoside	ChemIDplus
4-Nitrophenyl beta-D-glucoside	ChemIDplus
p-nitrophenyl β-D-glucoside	ChEBI
p-Nitrophenyl-beta-glucoside	ChemIDplus

Registry Numbers	Sources
Reaxys:92211	Reaxys
CAS:2492-87-7	ChemIDplus

Citations