CHEBI:96231 - 4-fluoro-N-[[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pyridin-4-yl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzenesulfonamide

ChEBI IDCHEBI:96231
ChEBI Name4-fluoro-N-[[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pyridin-4-yl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzenesulfonamide
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FormulaC26H29FN4O5S
Net Charge0
Average Mass528.606
Monoisotopic Mass528.18427
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(-c3ccncc3)cnc2O[C@H]1CN(C)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C26H29FN4O5S/c1-17-14-31(18(2)16-32)26(33)23-12-20(19-8-10-28-11-9-19)13-29-25(23)36-24(17)15-30(3)37(34,35)22-6-4-21(27)5-7-22/h4-13,17-18,24,32H,14-16H2,1-3H3/t17-,18+,24+/m1/s1
InChIKeyOLGOXCLKPVLFFW-YTZAWJCFSA-N
ChEBI Ontology
Outgoing Relation(s)
4-fluoro-N-[[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-pyridin-4-yl-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylbenzenesulfonamide (CHEBI:96231) is a bipyridines (CHEBI:50511)
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