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CHEBI:123782 - 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-10-yl]-4-oxanecarboxamide

ChEBI IDCHEBI:123782
ChEBI NameN-[(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-10-yl]-4-oxanecarboxamide
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DownloadsMolfile
FormulaC28H38N4O5
Net Charge0
Average Mass510.635
Monoisotopic Mass510.28422
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2cccc(NC(=O)C3CCOCC3)c2O[C@@H]1CN(C)Cc1ccncc1
InChIInChI=1S/C28H38N4O5/c1-19-15-32(20(2)18-33)28(35)23-5-4-6-24(30-27(34)22-9-13-36-14-10-22)26(23)37-25(19)17-31(3)16-21-7-11-29-12-8-21/h4-8,11-12,19-20,22,25,33H,9-10,13-18H2,1-3H3,(H,30,34)/t19-,20-,25+/m0/s1
InChIKeyWRJNAKNVXDMTDS-ZYLNGJIFSA-N
ChEBI Ontology
Outgoing Relation(s)
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-10-yl]-4-oxanecarboxamide (CHEBI:123782) is a aromatic amide (CHEBI:62733)
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