chloridazone-desphenyl (CHEBI:83479)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	chloridazone-desphenyl

ChEBI ID	CHEBI:83479

Definition	A heteroaryl hydroxy compound that is pyridazin-3-ol substituted by an amino group at position 5 and a chloro group at position 4. It is a metabolite of the herbicide chloridazone.

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

Supplier Information

Download	Molfile XML SDF

Formula

C4H4ClN3O

Net Charge

Average Mass

145.54700

Monoisotopic Mass

145.00429

InChI

InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)

InChIKey

FEWPCPCEGBPTAL-UHFFFAOYSA-N

SMILES

Nc1cnnc(O)c1Cl

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):	marine xenobiotic metabolite Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.

ChEBI Ontology
Outgoing	chloridazone-desphenyl (CHEBI:83479) has role marine xenobiotic metabolite (CHEBI:83399) chloridazone-desphenyl (CHEBI:83479) is a heteroaryl hydroxy compound (CHEBI:74818) chloridazone-desphenyl (CHEBI:83479) is a organochlorine compound (CHEBI:36683) chloridazone-desphenyl (CHEBI:83479) is a primary arylamine (CHEBI:50471) chloridazone-desphenyl (CHEBI:83479) is a pyridazines (CHEBI:37921)

IUPAC Name

5-amino-4-chloropyridazin-3-ol

Citation	Type	Source
22322333	PubMed citation	Europe PMC

Last Modified

11 November 2014