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CHEBI:129186 - N-[(2R,3R)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide

ChEBI IDCHEBI:129186
ChEBI NameN-[(2R,3R)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide
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DownloadsMolfile
FormulaC30H46N4O5
Net Charge0
Average Mass542.721
Monoisotopic Mass542.34682
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2O[C@H]1CN(C)C(=O)NC1CCCCC1
InChIInChI=1S/C30H46N4O5/c1-20-17-34(21(2)19-35)29(37)25-16-24(31-28(36)22-10-6-4-7-11-22)14-15-26(25)39-27(20)18-33(3)30(38)32-23-12-8-5-9-13-23/h14-16,20-23,27,35H,4-13,17-19H2,1-3H3,(H,31,36)(H,32,38)/t20-,21+,27+/m1/s1
InChIKeyBPHDJJLUUFUQJF-BUEREQSYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2R,3R)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclohexanecarboxamide (CHEBI:129186) is a aromatic amide (CHEBI:62733)
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