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CHEBI:124581 - N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]cyclopropanecarboxamide

ChEBI IDCHEBI:124581
ChEBI NameN-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]cyclopropanecarboxamide
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DownloadsMolfile
FormulaC29H38N4O6
Net Charge0
Average Mass538.645
Monoisotopic Mass538.27913
SMILESCOc1ccc(NC(=O)N(C)C[C@H]2Oc3ccc(NC(=O)C4CC4)cc3CC(=O)N([C@@H](C)CO)C[C@@H]2C)cc1
InChIInChI=1S/C29H38N4O6/c1-18-15-33(19(2)17-34)27(35)14-21-13-23(30-28(36)20-5-6-20)9-12-25(21)39-26(18)16-32(3)29(37)31-22-7-10-24(38-4)11-8-22/h7-13,18-20,26,34H,5-6,14-17H2,1-4H3,(H,30,36)(H,31,37)/t18-,19-,26+/m0/s1
InChIKeyMBBKRZVZTMIJAL-LZJCXSABSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]cyclopropanecarboxamide (CHEBI:124581) is a ureas (CHEBI:47857)
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