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CHEBI:124232 - N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide

ChEBI IDCHEBI:124232
ChEBI NameN-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide
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DownloadsMolfile
FormulaC21H31N3O6S
Net Charge0
Average Mass453.561
Monoisotopic Mass453.19336
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)c2cccc(NC(=O)C3CC3)c2O[C@@H]1CN(C)S(C)(=O)=O
InChIInChI=1S/C21H31N3O6S/c1-13-10-24(14(2)12-25)21(27)16-6-5-7-17(22-20(26)15-8-9-15)19(16)30-18(13)11-23(3)31(4,28)29/h5-7,13-15,18,25H,8-12H2,1-4H3,(H,22,26)/t13-,14+,18-/m1/s1
InChIKeyGZDKJNQYYSUZFY-QWQRMKEZSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide (CHEBI:124232) is a aromatic amide (CHEBI:62733)
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