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

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ChEBI Name 4-nitrophenyl β-D-glucoside
ChEBI ID CHEBI:90259
ChEBI 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.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C12H15NO8
Net Charge 0
Average Mass 301.250
Monoisotopic Mass 301.07977
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
SMILES O1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1OC=2C=CC(=CC2)[N+]([O-])=O)O)O)O)CO
Roles Classification
Application(s): 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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 β-D-glucoside (CHEBI:22798)
4-nitrophenyl β-D-glucoside (CHEBI:90259) is a C-nitro compound (CHEBI:35716)
IUPAC Name
4-nitrophenyl β-D-glucopyranoside
Synonyms Sources
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 Types Sources
2492-87-7 CAS Registry Number ChemIDplus
92211 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
23201198 PubMed citation Europe PMC
9255974 PubMed citation Europe PMC
Last Modified
06 November 2015