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CHEBI:123629 - 1-cyclohexyl-3-[(2R,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]urea

ChEBI IDCHEBI:123629
ChEBI Name1-cyclohexyl-3-[(2R,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]urea
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FormulaC24H38N4O4
Net Charge0
Average Mass446.592
Monoisotopic Mass446.28931
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)NC3CCCCC3)ccc2O[C@H]1CN(C)C
InChIInChI=1S/C24H38N4O4/c1-16-13-28(17(2)15-29)23(30)20-12-19(10-11-21(20)32-22(16)14-27(3)4)26-24(31)25-18-8-6-5-7-9-18/h10-12,16-18,22,29H,5-9,13-15H2,1-4H3,(H2,25,26,31)/t16-,17+,22+/m1/s1
InChIKeyVXFJIZOVTNBNAE-JLHGSKIFSA-N
ChEBI Ontology
Outgoing Relation(s)
1-cyclohexyl-3-[(2R,3R)-2-[(dimethylamino)methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]urea (CHEBI:123629) is a aromatic ether (CHEBI:35618)
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