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CHEBI:124309 - N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide

ChEBI IDCHEBI:124309
ChEBI NameN-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide
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DownloadsMolfile
FormulaC34H42N4O5
Net Charge0
Average Mass586.733
Monoisotopic Mass586.31552
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2O[C@@H]1CN(C)C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C34H42N4O5/c1-22-19-38(23(2)21-39)33(41)28-18-26(35-32(40)25-11-5-4-6-12-25)16-17-30(28)43-31(22)20-37(3)34(42)36-29-15-9-13-24-10-7-8-14-27(24)29/h7-10,13-18,22-23,25,31,39H,4-6,11-12,19-21H2,1-3H3,(H,35,40)(H,36,42)/t22-,23+,31-/m1/s1
InChIKeyWTDFUXHNPPZUHK-IKBQMQIHSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide (CHEBI:124309) is a naphthalenes (CHEBI:25477)
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