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CHEBI:106235 - N-[[(2R,3R)-8-bromo-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-4-fluoro-N-methylbenzamide

ChEBI IDCHEBI:106235
ChEBI NameN-[[(2R,3R)-8-bromo-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-4-fluoro-N-methylbenzamide
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DownloadsMolfile
FormulaC22H25BrFN3O4
Net Charge0
Average Mass494.361
Monoisotopic Mass493.10125
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(Br)cnc2O[C@H]1CN(C)C(=O)c1ccc(F)cc1
InChIInChI=1S/C22H25BrFN3O4/c1-13-10-27(14(2)12-28)22(30)18-8-16(23)9-25-20(18)31-19(13)11-26(3)21(29)15-4-6-17(24)7-5-15/h4-9,13-14,19,28H,10-12H2,1-3H3/t13-,14+,19+/m1/s1
InChIKeyWRXISDPBFZAALF-TYILLQQXSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2R,3R)-8-bromo-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-4-fluoro-N-methylbenzamide (CHEBI:106235) is a carbonyl compound (CHEBI:36586)
N-[[(2R,3R)-8-bromo-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-4-fluoro-N-methylbenzamide (CHEBI:106235) is a organohalogen compound (CHEBI:17792)
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