CHEBI:166538 - Metronidazole-OH

ChEBI IDCHEBI:166538
ChEBI NameMetronidazole-OH
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H9N3O4
Net Charge0
Average Mass187.155
Monoisotopic Mass187.05931
SMILESO=[N+]([O-])c1cnc(CO)n1CCO
InChIInChI=1S/C6H9N3O4/c10-2-1-8-5(4-11)7-3-6(8)9(12)13/h3,10-11H,1-2,4H2
InChIKeyAEHPOYAOLCAMIU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Metronidazole-OH (CHEBI:166538) is a C-nitro compound (CHEBI:35716)
Metronidazole-OH (CHEBI:166538) is a imidazoles (CHEBI:24780)
IUPAC Name 
2-[2-(hydroxymethyl)-5-nitroimidazol-1-yl]ethanol
Manual XrefsDatabases
108713ChemSpider
Registry NumbersSources
CAS:4812-40-2ChemIDplus