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CHEBI:96529 - N-[[(2R,3S)-8-(3-cyanophenyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-4-oxanecarboxamide

ChEBI IDCHEBI:96529
ChEBI NameN-[[(2R,3S)-8-(3-cyanophenyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-4-oxanecarboxamide
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DownloadsMolfile
FormulaC28H34N4O5
Net Charge0
Average Mass506.603
Monoisotopic Mass506.25292
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(-c3cccc(C#N)c3)cc2C1=O
InChIInChI=1S/C28H34N4O5/c1-18-15-32(19(2)17-33)28(35)24-12-23(22-6-4-5-20(11-22)13-29)14-30-26(24)37-25(18)16-31(3)27(34)21-7-9-36-10-8-21/h4-6,11-12,14,18-19,21,25,33H,7-10,15-17H2,1-3H3/t18-,19+,25-/m0/s1
InChIKeyJPQXACXLPZYWDI-CEYNDMKZSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2R,3S)-8-(3-cyanophenyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-4-oxanecarboxamide (CHEBI:96529) is a phenylpyridine (CHEBI:38193)
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