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CHEBI:230386 - Pimonidazole

Default Structure
ChEBI IDCHEBI:230386
ChEBI NamePimonidazole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H18N4O3
Net Charge0
Average Mass254.290
Monoisotopic Mass254.13789
SMILESO=[N+]([O-])c1nccn1CC(O)CN1CCCCC1
InChIInChI=1S/C11H18N4O3/c16-10(8-13-5-2-1-3-6-13)9-14-7-4-12-11(14)15(17)18/h4,7,10,16H,1-3,5-6,8-9H2
InChIKeyWVWOOAYQYLJEFD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
Pimonidazole (CHEBI:230386) has role antineoplastic agent (CHEBI:35610)
Pimonidazole (CHEBI:230386) has role antitubercular agent (CHEBI:33231)
Pimonidazole (CHEBI:230386) has role cardiovascular drug (CHEBI:35554)
Pimonidazole (CHEBI:230386) is a C-nitro compound (CHEBI:35716)
Pimonidazole (CHEBI:230386) is a organic molecular entity (CHEBI:50860)
Pimonidazole (CHEBI:230386) is a racemate (CHEBI:60911)
IUPAC Name 
1-(2-nitroimidazol-1-yl)-3-piperidin-1-ylpropan-2-ol
INNs  Source
pimonidazolWHO MedNet
pimonidazoleWHO MedNet
Synonyms  Source
NSC-380540ChEMBL
PD 126675ChEMBL
PD-126675ChEMBL
RO 03-8799ChEMBL
RO-03-8799ChEMBL
RO-038799ChEMBL
Manual XrefsDatabases
46214ChemSpider
DB12485DrugBank
HMDB0256554HMDB
Citations