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CHEBI:175687 - UK-121,265

ChEBI IDCHEBI:175687
ChEBI NameUK-121,265
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H14F3N5O2
Net Charge0
Average Mass365.315
Monoisotopic Mass365.10996
SMILESC[C@@H](c1nc[n+]([O-])cc1F)[C@](O)(Cn1cncn1)c1ccc(F)cc1F
InChIInChI=1S/C16H14F3N5O2/c1-10(15-14(19)5-24(26)9-21-15)16(25,6-23-8-20-7-22-23)12-3-2-11(17)4-13(12)18/h2-5,7-10,25H,6H2,1H3/t10-,16+/m0/s1
InChIKeyKPLFPLUCFPRUHU-MGPLVRAMSA-N
ChEBI Ontology
Outgoing Relation(s)
UK-121,265 (CHEBI:175687) is a alkylbenzene (CHEBI:38976)
IUPAC Name 
(2R,3S)-2-(2,4-diluorophenyl)-3-(5-luoro-1-oxidopyrimidin-1-ium-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol
Manual XrefsDatabases
8219919ChemSpider
HMDB0060893HMDB
Registry NumbersSources
CAS:618109-05-0ChemIDplus