EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:118530 - 4-fluoro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(2-phenylethylamino)ethyl]-3-oxanyl]benzamide

ChEBI IDCHEBI:118530
ChEBI Name4-fluoro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(2-phenylethylamino)ethyl]-3-oxanyl]benzamide
Stars
DownloadsMolfile
FormulaC23H27FN2O4
Net Charge0
Average Mass414.477
Monoisotopic Mass414.19549
SMILESO=C(C[C@H]1CC[C@H](NC(=O)c2ccc(F)cc2)[C@@H](CO)O1)NCCc1ccccc1
InChIInChI=1S/C23H27FN2O4/c24-18-8-6-17(7-9-18)23(29)26-20-11-10-19(30-21(20)15-27)14-22(28)25-13-12-16-4-2-1-3-5-16/h1-9,19-21,27H,10-15H2,(H,25,28)(H,26,29)/t19-,20+,21-/m1/s1
InChIKeyTXCGFGBWYOSXMX-QHAWAJNXSA-N
ChEBI Ontology
Outgoing Relation(s)
4-fluoro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(2-phenylethylamino)ethyl]-3-oxanyl]benzamide (CHEBI:118530) is a C-glycosyl compound (CHEBI:20857)
Manual XrefsDatabases
LSM-29979LINCS