Preferred Name

azathioprine

Synonyms

Imuran (TN)

6-(1'-Methyl-4'-nitro-5'-imidazolyl)-mercaptopurine

6-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)-1H-purine

6-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-7H-purine

Definitions

A thiopurine that is 6-mercaptopurine in which the mercapto hydrogen is replaced by a 1-methyl-4-nitroimidazol-5-yl group. It is a prodrug for mercaptopurine and is used as an immunosuppressant, prescribed for the treatment of inflammatory conditions and after organ transplantation and also for treatment of Crohn's didease and MS.

ID

http://purl.obolibrary.org/obo/CHEBI_2948

charge

0

database_cross_reference

Wikipedia:Azathioprine

PMID:25440430

PMID:20080917

CAS:446-86-6

PMID:11064448

PMID:17970886

PMID:25581826

PMID:28166217

PMID:16954801

PMID:17381669

PMID:15628319

PMID:9345422

PMID:25248004

Drug_Central:269

PMID:25314066

PMID:16397313

KEGG:D00238

PMID:16764353

PMID:18008354

Reaxys:1225351

PMID:15973722

PMID:25443086

PMID:9273463

PMID:19243907

PMID:18336531

PMID:8738760

KEGG:C06837

PMID:15476481

PMID:25641386

PMID:16344342

DrugBank:DB00993

PMID:15199672

formula

C9H7N7O2S

has role

http://purl.obolibrary.org/obo/CHEBI_50908

http://purl.obolibrary.org/obo/CHEBI_35705

http://purl.obolibrary.org/obo/CHEBI_50266

http://purl.obolibrary.org/obo/CHEBI_35610

http://purl.obolibrary.org/obo/CHEBI_59517

http://purl.obolibrary.org/obo/CHEBI_50903

http://purl.obolibrary.org/obo/CHEBI_35221

has_exact_synonym

6-[(1-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]-7H-purine

has_obo_namespace

chebi_ontology

has_related_synonym

Imuran (TN)

6-(1'-Methyl-4'-nitro-5'-imidazolyl)-mercaptopurine

6-((1-Methyl-4-nitro-1H-imidazol-5-yl)thio)-1H-purine

id

CHEBI:2948

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C9H7N7O2S/c1-15-4-14-7(16(17)18)9(15)19-8-5-6(11-2-10-5)12-3-13-8/h2-4H,1H3,(H,10,11,12,13)

inchikey

LMEKQMALGUDUQG-UHFFFAOYSA-N

label

azathioprine

mass

277.26386

monoisotopicmass

277.038

notation

CHEBI:2948

prefLabel

azathioprine

smiles

Cn1cnc(c1Sc1ncnc2nc[nH]c12)[N+]([O-])=O

textual definition

A thiopurine that is 6-mercaptopurine in which the mercapto hydrogen is replaced by a 1-methyl-4-nitroimidazol-5-yl group. It is a prodrug for mercaptopurine and is used as an immunosuppressant, prescribed for the treatment of inflammatory conditions and after organ transplantation and also for treatment of Crohn's didease and MS.

subClassOf

http://purl.obolibrary.org/obo/CHEBI_35666

http://purl.obolibrary.org/obo/CHEBI_35716

http://purl.obolibrary.org/obo/CHEBI_24780

http://purl.obolibrary.org/obo/CHEBI_35683

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