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CHEBI:110090 - N-[[(2R,3S)-8-(3-cyanophenyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-pyrazinecarboxamide

ChEBI IDCHEBI:110090
ChEBI NameN-[[(2R,3S)-8-(3-cyanophenyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-pyrazinecarboxamide
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DownloadsMolfile
FormulaC27H28N6O4
Net Charge0
Average Mass500.559
Monoisotopic Mass500.21720
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2cc(-c3cccc(C#N)c3)cnc2O[C@H]1CN(C)C(=O)c1cnccn1
InChIInChI=1S/C27H28N6O4/c1-17-14-33(18(2)16-34)26(35)22-10-21(20-6-4-5-19(9-20)11-28)12-31-25(22)37-24(17)15-32(3)27(36)23-13-29-7-8-30-23/h4-10,12-13,17-18,24,34H,14-16H2,1-3H3/t17-,18-,24-/m0/s1
InChIKeyFWSGSYZJGWMBSU-XFAGBWLFSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2R,3S)-8-(3-cyanophenyl)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-2-pyrazinecarboxamide (CHEBI:110090) is a phenylpyridine (CHEBI:38193)
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