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CHEBI:130776 - N-[(2S,3S)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-(dimethylamino)butanamide

ChEBI IDCHEBI:130776
ChEBI NameN-[(2S,3S)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-(dimethylamino)butanamide
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DownloadsMolfile
FormulaC29H47N5O5
Net Charge0
Average Mass545.725
Monoisotopic Mass545.35772
SMILESC[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)CCCN(C)C)cc2C1=O
InChIInChI=1S/C29H47N5O5/c1-20-17-34(21(2)19-35)28(37)24-16-23(30-27(36)12-9-15-32(3)4)13-14-25(24)39-26(20)18-33(5)29(38)31-22-10-7-6-8-11-22/h13-14,16,20-22,26,35H,6-12,15,17-19H2,1-5H3,(H,30,36)(H,31,38)/t20-,21+,26+/m0/s1
InChIKeyHVZAAXCGJPPTNA-LZCXECNNSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3S)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4-(dimethylamino)butanamide (CHEBI:130776) is a aromatic amide (CHEBI:62733)
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