2,4-dinitrophenol(1-) (CHEBI:84561)

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ChEBI Name	2,4-dinitrophenol(1−)

ChEBI ID	CHEBI:84561

ChEBI ASCII Name	2,4-dinitrophenol(1-)

Definition	A phenolate anion obtained from 2,4-dinitrophenol. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Kristian Axelsen

Supplier Information	No supplier information found for this compound.

Download	Molfile XML SDF

Formula

C6H3N2O5

Net Charge

-1

Average Mass

183.09900

Monoisotopic Mass

183.00474

InChI

InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H/p-1

InChIKey

UFBJCMHMOXMLKC-UHFFFAOYSA-M

SMILES

[O-]c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O

Metabolite of Species	Details
Nocardioides sp. (NCBI:txid35761)	of strain JS1661 See: PubMed

Roles Classification
Biological Role(s):	bacterial xenobiotic metabolite Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.

ChEBI Ontology
Outgoing	2,4-dinitrophenol(1−) (CHEBI:84561) has role bacterial xenobiotic metabolite (CHEBI:76976) 2,4-dinitrophenol(1−) (CHEBI:84561) is a phenolate anion (CHEBI:50525) 2,4-dinitrophenol(1−) (CHEBI:84561) is conjugate base of 2,4-dinitrophenol (CHEBI:42017)

Incoming	2,4-dinitrophenol (CHEBI:42017) is conjugate acid of 2,4-dinitrophenol(1−) (CHEBI:84561)

IUPAC Name

2,4-dinitrophenolate

Citation

Last Modified

10 April 2015