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CHEBI:113922 - N-[[(2S,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]-N,4-dimethylbenzenesulfonamide

ChEBI IDCHEBI:113922
ChEBI NameN-[[(2S,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]-N,4-dimethylbenzenesulfonamide
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DownloadsMolfile
FormulaC22H28BrN3O5S
Net Charge0
Average Mass526.453
Monoisotopic Mass525.09330
SMILESCc1ccc(S(=O)(=O)N(C)C[C@H]2Oc3ncc(Br)cc3C(=O)N([C@@H](C)CO)C[C@H]2C)cc1
InChIInChI=1S/C22H28BrN3O5S/c1-14-5-7-18(8-6-14)32(29,30)25(4)12-20-15(2)11-26(16(3)13-27)22(28)19-9-17(23)10-24-21(19)31-20/h5-10,15-16,20,27H,11-13H2,1-4H3/t15-,16+,20-/m1/s1
InChIKeyRBKHQDVGCDKRON-GQIGUUNPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2S,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]-N,4-dimethylbenzenesulfonamide (CHEBI:113922) is a sulfonamide (CHEBI:35358)
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