CHEBI:95758 - 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]-2-methoxy-N-methylbenzenesulfonamide

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ChEBI Name 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]-2-methoxy-N-methylbenzenesulfonamide
ChEBI ID CHEBI:95758
Stars This entity has been manually annotated by a third party.
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Formula C22H28BrN3O6S
Net Charge 0
Average Mass 542.445
Monoisotopic Mass 541.08822
InChI InChI=1S/C22H28BrN3O6S/c1-14-11-26(15(2)13-27)22(28)17-9-16(23)10-24-21(17)32-19(14)12-25(3)33(29,30)20-8-6-5-7-18(20)31-4/h5-10,14-15,19,27H,11-13H2,1-4H3/t14-,15+,19-/m1/s1
InChIKey LJNOUGNZSXLUFQ-ZRGWGRIASA-N
SMILES C[C@@H]1CN(C(=O)C2=CC(=CN=C2O[C@@H]1CN(C)S(=O)(=O)C3=CC=CC=C3OC)Br)[C@@H](C)CO
ChEBI Ontology
Outgoing 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]-2-methoxy-N-methylbenzenesulfonamide (CHEBI:95758) is a sulfonamide (CHEBI:35358)
Manual Xref Database
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