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CHEBI:126843 - (2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-8-(4-fluorophenyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

ChEBI IDCHEBI:126843
ChEBI Name(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-8-(4-fluorophenyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
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DownloadsMolfile
FormulaC28H38FN3O3
Net Charge0
Average Mass483.628
Monoisotopic Mass483.28972
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(-c3ccc(F)cc3)cnc2O[C@@H]1CN(C)CC1CCCCC1
InChIInChI=1S/C28H38FN3O3/c1-19-15-32(20(2)18-33)28(34)25-13-23(22-9-11-24(29)12-10-22)14-30-27(25)35-26(19)17-31(3)16-21-7-5-4-6-8-21/h9-14,19-21,26,33H,4-8,15-18H2,1-3H3/t19-,20+,26-/m1/s1
InChIKeyKGEIMYZEFZAFAT-BVFVYWQFSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-8-(4-fluorophenyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:126843) is a phenylpyridine (CHEBI:38193)
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