aminopyrrolnitrin (CHEBI:85786)

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ChEBI Name	aminopyrrolnitrin

ChEBI ID	CHEBI:85786

Definition	A member of the class of pyrroles carrying chloro and 2-amino-3-chlorophenyl substituents at positions 3 and 4 respectively.

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

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C10H8Cl2N2

Net Charge

Average Mass

227.09000

Monoisotopic Mass

226.00645

InChI

InChI=1S/C10H8Cl2N2/c11-8-3-1-2-6(10(8)13)7-4-14-5-9(7)12/h1-5,14H,13H2

InChIKey

RWAXAHFFXZKMPA-UHFFFAOYSA-N

SMILES

Nc1c(Cl)cccc1-c1c[nH]cc1Cl

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. androgen antagonist A compound which inhibits or antagonises the biosynthesis or actions of androgens. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via alkaloid )

Application(s):	androgen antagonist A compound which inhibits or antagonises the biosynthesis or actions of androgens.

ChEBI Ontology
Outgoing	aminopyrrolnitrin (CHEBI:85786) has role androgen antagonist (CHEBI:35497) aminopyrrolnitrin (CHEBI:85786) has role bacterial metabolite (CHEBI:76969) aminopyrrolnitrin (CHEBI:85786) is a indole alkaloid (CHEBI:38958) aminopyrrolnitrin (CHEBI:85786) is a monochlorobenzenes (CHEBI:83403) aminopyrrolnitrin (CHEBI:85786) is a pyrroles (CHEBI:26455) aminopyrrolnitrin (CHEBI:85786) is a substituted aniline (CHEBI:48975)

IUPAC Name

2-chloro-6-(4-chloro-1H-pyrrol-3-yl)aniline

Synonyms	Sources
3-chloro-4-(2-amino-3-chlorophenyl)pyrrole	MetaCyc
aminopyrrolnitrin	UniProt
WB 2838	ChemIDplus
WB-2838	ChemIDplus

Last Modified

15 July 2016