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CHEBI:126830 - 4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide

ChEBI IDCHEBI:126830
ChEBI Name4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide
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FormulaC23H38N4O6S
Net Charge0
Average Mass498.646
Monoisotopic Mass498.25121
SMILESC[C@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)CCCN(C)C)ccc2O[C@@H]1CN(C)S(C)(=O)=O
InChIInChI=1S/C23H38N4O6S/c1-16-13-27(17(2)15-28)23(30)19-12-18(24-22(29)8-7-11-25(3)4)9-10-20(19)33-21(16)14-26(5)34(6,31)32/h9-10,12,16-17,21,28H,7-8,11,13-15H2,1-6H3,(H,24,29)/t16-,17-,21+/m0/s1
InChIKeyPSOBHRQFTWDSLH-XGHQBKJUSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(dimethylamino)-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]butanamide (CHEBI:126830) is a aromatic amide (CHEBI:62733)
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