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CHEBI:31517 - Doranidazole

Default Structure
ChEBI IDCHEBI:31517
ChEBI NameDoranidazole
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC8H13N3O6
Net Charge0
Average Mass247.207
Monoisotopic Mass247.08044
SMILESO=[N+]([O-])c1nccn1CO[C@H](CO)[C@@H](O)CO
InChIInChI=1S/C8H13N3O6/c12-3-6(14)7(4-13)17-5-10-2-1-9-8(10)11(15)16/h1-2,6-7,12-14H,3-5H2/t6-,7+/m0/s1
InChIKeyFIITXXIVUIXYMI-NKWVEPMBSA-N
ChEBI Ontology
Outgoing Relation(s)
Doranidazole (CHEBI:31517) is a C-nitro compound (CHEBI:35716)
Synonyms  Source
DoranidazoleKEGG COMPOUND
RP 343KEGG COMPOUND
Manual XrefsDatabases
D01834KEGG DRUG
Registry NumbersSources
CAS:149838-23-3KEGG COMPOUND