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CHEBI:95671 - N-[[(2R,3S)-8-(2-benzofuranyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-3-fluoro-N-methylbenzenesulfonamide

ChEBI IDCHEBI:95671
ChEBI NameN-[[(2R,3S)-8-(2-benzofuranyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-3-fluoro-N-methylbenzenesulfonamide
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FormulaC29H30FN3O6S
Net Charge0
Average Mass567.639
Monoisotopic Mass567.18393
SMILESC[C@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(F)c2)Oc2ncc(-c3cc4ccccc4o3)cc2C1=O
InChIInChI=1S/C29H30FN3O6S/c1-18-15-33(19(2)17-34)29(35)24-11-21(26-12-20-7-4-5-10-25(20)38-26)14-31-28(24)39-27(18)16-32(3)40(36,37)23-9-6-8-22(30)13-23/h4-14,18-19,27,34H,15-17H2,1-3H3/t18-,19+,27-/m0/s1
InChIKeyCQNONDRQNRMLFE-CUMRGQLISA-N
ChEBI Ontology
Outgoing Relation(s)
N-[[(2R,3S)-8-(2-benzofuranyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-3-fluoro-N-methylbenzenesulfonamide (CHEBI:95671) is a sulfonamide (CHEBI:35358)
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