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CHEBI:111550 - N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide

ChEBI IDCHEBI:111550
ChEBI NameN-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide
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DownloadsMolfile
FormulaC29H45N3O5
Net Charge0
Average Mass515.695
Monoisotopic Mass515.33592
SMILESC[C@@H]1CN([C@H](C)CO)C(=O)c2cccc(NC(=O)C3CCOCC3)c2O[C@@H]1CN(C)CC1CCCCC1
InChIInChI=1S/C29H45N3O5/c1-20-16-32(21(2)19-33)29(35)24-10-7-11-25(30-28(34)23-12-14-36-15-13-23)27(24)37-26(20)18-31(3)17-22-8-5-4-6-9-22/h7,10-11,20-23,26,33H,4-6,8-9,12-19H2,1-3H3,(H,30,34)/t20-,21-,26-/m1/s1
InChIKeyQPEXUVZRKHXLPB-IPVFLDMMSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide (CHEBI:111550) is a aromatic amide (CHEBI:62733)
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