CHEBI:100047 - 4-fluoro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide

ChEBI IDCHEBI:100047
ChEBI Name4-fluoro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide
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DownloadsMolfile
FormulaC20H23FN4O4
Net Charge0
Average Mass402.426
Monoisotopic Mass402.17033
SMILESO=C(C[C@H]1CC[C@@H](NC(=O)c2ccc(F)cc2)[C@H](CO)O1)NCc1ccncn1
InChIInChI=1S/C20H23FN4O4/c21-14-3-1-13(2-4-14)20(28)25-17-6-5-16(29-18(17)11-26)9-19(27)23-10-15-7-8-22-12-24-15/h1-4,7-8,12,16-18,26H,5-6,9-11H2,(H,23,27)(H,25,28)/t16-,17-,18+/m1/s1
InChIKeyKXCVLZMSFBFHGZ-KURKYZTESA-N
ChEBI Ontology
Outgoing Relation(s)
4-fluoro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-pyrimidinylmethylamino)ethyl]-3-oxanyl]benzamide (CHEBI:100047) is a C-glycosyl compound (CHEBI:20857)
Manual XrefsDatabases
LSM-11426LINCS