CHEBI:106084 - N-[[(2S,3R)-8-bromo-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide

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ChEBI Name N-[[(2S,3R)-8-bromo-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide
ChEBI ID CHEBI:106084
Stars This entity has been manually annotated by a third party.
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Formula C22H32BrN3O4
Net Charge 0
Average Mass 482.412
Monoisotopic Mass 481.15762
InChI InChI=1S/C22H32BrN3O4/c1-14-11-26(15(2)13-27)22(29)18-9-17(23)10-24-20(18)30-19(14)12-25(3)21(28)16-7-5-4-6-8-16/h9-10,14-16,19,27H,4-8,11-13H2,1-3H3/t14-,15-,19-/m1/s1
InChIKey WYZAJQOJJPDCBL-SPYBWZPUSA-N
SMILES C[C@@H]1CN(C(=O)C2=CC(=CN=C2O[C@@H]1CN(C)C(=O)C3CCCCC3)Br)[C@H](C)CO
ChEBI Ontology
Outgoing N-[[(2S,3R)-8-bromo-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methylcyclohexanecarboxamide (CHEBI:106084) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-17445 LINCS
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