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CHEBI:124128 - 4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide

ChEBI IDCHEBI:124128
ChEBI Name4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide
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DownloadsMolfile
FormulaC28H41N5O4
Net Charge0
Average Mass511.667
Monoisotopic Mass511.31585
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)CCCN(C)C)ccc2O[C@@H]1CN(C)Cc1ccncc1
InChIInChI=1S/C28H41N5O4/c1-20-16-33(21(2)19-34)28(36)24-15-23(30-27(35)7-6-14-31(3)4)8-9-25(24)37-26(20)18-32(5)17-22-10-12-29-13-11-22/h8-13,15,20-21,26,34H,6-7,14,16-19H2,1-5H3,(H,30,35)/t20-,21-,26+/m0/s1
InChIKeyMVSRNOMMKUCTOT-ISJBWFOZSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide (CHEBI:124128) is a aromatic amide (CHEBI:62733)
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